Changes between Initial Version and Version 1 of Ticket #15691


Ignore:
Timestamp:
Jul 29, 2024, 10:22:14 AM (15 months ago)
Author:
Eric Pettersen
Comment:

Legend:

Unmodified
Added
Removed
Modified

  • Ticket #15691

    • Property Component Unassigned → Window Toolkit
    • Property Owner set to Eric Pettersen
    • Property Platform → all
    • Property Project → ChimeraX
    • Property Status new → accepted
    • Property Summary ChimeraX bug report submission → Crash running open-file dialog

  • Ticket #15691 – Description

    initial v1  
    785785       0x1a1059000 -        0x1a106dfff  libLinearAlgebra.dylib (1336.140.1)  /System/Library/Frameworks/Accelerate.framework/Versions/A/Frameworks/vecLib.framework/Versions/A/libLinearAlgebra.dylib
    786786       0x1a106e000 -        0x1a1271fff  com.apple.MetalPerformanceShaders.MPSNeuralNetwork (1.0 - 1)  /System/Library/Frameworks/MetalPerformanceShaders.framework/Versions/A/Frameworks/MPSNeuralNetwork.framework/Versions/A/MPSNeuralNetwork
    787        0x1a1272000 -        0x1a12bbfff  com.apple.MetalPerformanceShaders.MPSRayIntersector (1.0 - 1)  /System/Library/Frameworks/MetalPerformanceShaders.framework/Versions/A/Frameworks/MPSRayIntersector.framework/Versions/A/MPSRayIntersector
    788        0x1a12bc000 -        0x1a140efff  com.apple.MLCompute (1.0 - 1)  /System/Library/Frameworks/MLCompute.framework/Versions/A/MLCompute
    789        0x1a140f000 -        0x1a143dfff  com.apple.MetalPerformanceShaders.MPSMatrix (1.0 - 1)  /System/Library/Frameworks/MetalPerformanceShaders.framework/Versions/A/Frameworks/MPSMatrix.framework/Versions/A/MPSMatrix
    790        0x1a143e000 -        0x1a1490fff  com.apple.MetalPerformanceShaders.MPSNDArray (1.0 - 1)  /System/Library/Frameworks/MetalPerformanceShaders.framework/Versions/A/Frameworks/MPSNDArray.framework/Versions/A/MPSNDArray
    791        0x1a1491000 -        0x1a1518fff  com.apple.MetalPerformanceShaders.MPSImage (1.0 - 1)  /System/Library/Frameworks/MetalPerformanceShaders.framework/Versions/A/Frameworks/MPSImage.framework/Versions/A/MPSImage
    792        0x1a1519000 -        0x1a1528fff  com.apple.AppleFSCompression (125 - 1.0)  /System/Library/PrivateFrameworks/AppleFSCompression.framework/Versions/A/AppleFSCompression
    793        0x1a1529000 -        0x1a1535fff  libbz2.1.0.dylib (44)  /usr/lib/libbz2.1.0.dylib
    794        0x1a1536000 -        0x1a153afff  libsystem_coreservices.dylib (127.1)  /usr/lib/system/libsystem_coreservices.dylib
    795        0x1a153b000 -        0x1a156bfff  com.apple.CoreServices.OSServices (1122.44 - 1122.44)  /System/Library/Frameworks/CoreServices.framework/Versions/A/Frameworks/OSServices.framework/Versions/A/OSServices
    796        0x1a156c000 -        0x1a167cfff  com.apple.AuthKit (1.0 - 1)  /System/Library/PrivateFrameworks/AuthKit.framework/Versions/A/AuthKit
    797        0x1a167d000 -        0x1a16affff  com.apple.UserNotifications (1.0 - 348.5)  /System/Library/Frameworks/UserNotifications.framework/Versions/A/UserNotifications
    798        0x1a16b0000 -        0x1a171ffff  com.apple.CoreSpotlight (1.0 - 2150.26)  /System/Library/Frameworks/CoreSpotlight.framework/Versions/A/CoreSpotlight
    799        0x1a1720000 -        0x1a1731fff  libz.1.dylib (76)  /usr/lib/libz.1.dylib
    800        0x1a1732000 -        0x1a175ffff  libsystem_m.dylib (3186.100.3)  /usr/lib/system/libsystem_m.dylib
    801        0x1a1760000 -        0x1a1760fff  libcharset.1.dylib (59)  /usr/lib/libcharset.1.dylib
    802        0x1a1761000 -        0x1a1766fff  libmacho.dylib (980)  /usr/lib/system/libmacho.dylib
    803        0x1a1767000 -        0x1a177efff  libkxld.dylib (7195.141.6)  /usr/lib/system/libkxld.dylib
    804        0x1a177f000 -        0x1a178cfff  libcommonCrypto.dylib (60178.120.3)  /usr/lib/system/libcommonCrypto.dylib
    805        0x1a178d000 -        0x1a1797fff  libunwind.dylib (201)  /usr/lib/system/libunwind.dylib
    806        0x1a1798000 -        0x1a179ffff  liboah.dylib (203.58)  /usr/lib/liboah.dylib
    807        0x1a17a0000 -        0x1a17a8fff  libcopyfile.dylib (173.40.2)  /usr/lib/system/libcopyfile.dylib
    808        0x1a17a9000 -        0x1a17acfff  libcompiler_rt.dylib (102.2)  /usr/lib/system/libcompiler_rt.dylib
    809        0x1a17ad000 -        0x1a17affff  libsystem_collections.dylib (1439.141.1)  /usr/lib/system/libsystem_collections.dylib
    810        0x1a17b0000 -        0x1a17b2fff  libsystem_secinit.dylib (87.60.1)  /usr/lib/system/libsystem_secinit.dylib
    811        0x1a17b3000 -        0x1a17b5fff  libremovefile.dylib (49.120.1)  /usr/lib/system/libremovefile.dylib
    812        0x1a17b6000 -        0x1a17b6fff  libkeymgr.dylib (31)  /usr/lib/system/libkeymgr.dylib
    813        0x1a17b7000 -        0x1a17bffff  libsystem_dnssd.dylib (1310.140.1)  /usr/lib/system/libsystem_dnssd.dylib
    814        0x1a17c0000 -        0x1a17c5fff  libcache.dylib (83)  /usr/lib/system/libcache.dylib
    815        0x1a17c6000 -        0x1a17c7fff  libSystem.B.dylib (1292.120.1)  /usr/lib/libSystem.B.dylib
    816        0x1a17c8000 -        0x1a17cbfff  libfakelink.dylib (3)  /usr/lib/libfakelink.dylib
    817        0x1a17cc000 -        0x1a17ccfff  com.apple.SoftLinking (1.0 - 1)  /System/Library/PrivateFrameworks/SoftLinking.framework/Versions/A/SoftLinking
    818        0x1a17cd000 -        0x1a1808fff  libpcap.A.dylib (98.100.3)  /usr/lib/libpcap.A.dylib
    819        0x1a1809000 -        0x1a18fefff  libiconv.2.dylib (59)  /usr/lib/libiconv.2.dylib
    820        0x1a18ff000 -        0x1a1911fff  libcmph.dylib (8)  /usr/lib/libcmph.dylib
    821        0x1a1912000 -        0x1a1982fff  libarchive.2.dylib (83.100.2)  /usr/lib/libarchive.2.dylib
    822        0x1a1983000 -        0x1a19f3fff  com.apple.SearchKit (1.4.1 - 1.4.1)  /System/Library/Frameworks/CoreServices.framework/Versions/A/Frameworks/SearchKit.framework/Versions/A/SearchKit
    823        0x1a19f4000 -        0x1a19f5fff  libThaiTokenizer.dylib (3)  /usr/lib/libThaiTokenizer.dylib
    824        0x1a19f6000 -        0x1a1a1afff  com.apple.applesauce (1.0 - 16.28)  /System/Library/PrivateFrameworks/AppleSauce.framework/Versions/A/AppleSauce
    825        0x1a1a1b000 -        0x1a1a31fff  libapple_nghttp2.dylib (1.41)  /usr/lib/libapple_nghttp2.dylib
    826        0x1a1a32000 -        0x1a1a44fff  libSparseBLAS.dylib (1336.140.1)  /System/Library/Frameworks/Accelerate.framework/Versions/A/Frameworks/vecLib.framework/Versions/A/libSparseBLAS.dylib
    827        0x1a1a45000 -        0x1a1a46fff  com.apple.MetalPerformanceShaders.MetalPerformanceShaders (1.0 - 1)  /System/Library/Frameworks/MetalPerformanceShaders.framework/Versions/A/MetalPerformanceShaders
    828        0x1a1a47000 -        0x1a1a4bfff  libpam.2.dylib (28.40.1)  /usr/lib/libpam.2.dylib
    829        0x1a1a4c000 -        0x1a1a6afff  libcompression.dylib (96.120.1)  /usr/lib/libcompression.dylib
    830        0x1a1a6b000 -        0x1a1a6ffff  libQuadrature.dylib (7)  /System/Library/Frameworks/Accelerate.framework/Versions/A/Frameworks/vecLib.framework/Versions/A/libQuadrature.dylib
    831        0x1a1a70000 -        0x1a1f2cfff  libLAPACK.dylib (1336.140.1)  /System/Library/Frameworks/Accelerate.framework/Versions/A/Frameworks/vecLib.framework/Versions/A/libLAPACK.dylib
    832        0x1a1f2d000 -        0x1a1f7ffff  com.apple.DictionaryServices (1.2 - 341)  /System/Library/Frameworks/CoreServices.framework/Versions/A/Frameworks/DictionaryServices.framework/Versions/A/DictionaryServices
    833        0x1a1f80000 -        0x1a1f98fff  liblzma.5.dylib (16)  /usr/lib/liblzma.5.dylib
    834        0x1a1f99000 -        0x1a1f9afff  libcoretls_cfhelpers.dylib (169.100.1)  /usr/lib/libcoretls_cfhelpers.dylib
    835        0x1a1f9b000 -        0x1a207ffff  com.apple.APFS (1677.141.2 - 1677.141.2)  /System/Library/PrivateFrameworks/APFS.framework/Versions/A/APFS
    836        0x1a2080000 -        0x1a208dfff  libxar.1.dylib (452)  /usr/lib/libxar.1.dylib
    837        0x1a208e000 -        0x1a2091fff  libutil.dylib (58.40.2)  /usr/lib/libutil.dylib
    838        0x1a2092000 -        0x1a20bbfff  libxslt.1.dylib (17.6)  /usr/lib/libxslt.1.dylib
    839        0x1a20bc000 -        0x1a20c6fff  libChineseTokenizer.dylib (37.1)  /usr/lib/libChineseTokenizer.dylib
    840        0x1a20c7000 -        0x1a2136fff  libvMisc.dylib (760.100.3)  /System/Library/Frameworks/Accelerate.framework/Versions/A/Frameworks/vecLib.framework/Versions/A/libvMisc.dylib
    841        0x1a2137000 -        0x1a21c8fff  libate.dylib (3.0.6)  /usr/lib/libate.dylib
    842        0x1a21c9000 -        0x1a21d0fff  libIOReport.dylib (64.100.1)  /usr/lib/libIOReport.dylib
    843        0x1a21d1000 -        0x1a21e5fff  com.apple.CrashReporterSupport (10.13 - 15053.1)  /System/Library/PrivateFrameworks/CrashReporterSupport.framework/Versions/A/CrashReporterSupport
    844        0x1a21fe000 -        0x1a2278fff  com.apple.CVNLP (1.0 - 119)  /System/Library/PrivateFrameworks/CVNLP.framework/Versions/A/CVNLP
    845        0x1a229a000 -        0x1a22cbfff  com.apple.pluginkit.framework (1.0 - 1)  /System/Library/PrivateFrameworks/PlugInKit.framework/Versions/A/PlugInKit
    846        0x1a22cc000 -        0x1a22d3fff  libMatch.1.dylib (38)  /usr/lib/libMatch.1.dylib
    847        0x1a22d4000 -        0x1a2357fff  libCoreStorage.dylib (554.140.2)  /usr/lib/libCoreStorage.dylib
    848        0x1a2358000 -        0x1a23a3fff  com.apple.AppleVAFramework (6.1.3 - 6.1.3)  /System/Library/PrivateFrameworks/AppleVA.framework/Versions/A/AppleVA
    849        0x1a23a4000 -        0x1a23befff  libexpat.1.dylib (26.141.1)  /usr/lib/libexpat.1.dylib
    850        0x1a23bf000 -        0x1a23c7fff  libheimdal-asn1.dylib (597.140.2)  /usr/lib/libheimdal-asn1.dylib
    851        0x1a23c8000 -        0x1a23dafff  com.apple.IconFoundation (479.4 - 479.4)  /System/Library/PrivateFrameworks/IconFoundation.framework/Versions/A/IconFoundation
    852        0x1a23db000 -        0x1a243efff  com.apple.IconServices (479.4 - 479.4)  /System/Library/PrivateFrameworks/IconServices.framework/Versions/A/IconServices
    853        0x1a243f000 -        0x1a24e1fff  com.apple.MediaExperience (1.0 - 1)  /System/Library/PrivateFrameworks/MediaExperience.framework/Versions/A/MediaExperience
    854        0x1a24e2000 -        0x1a2508fff  com.apple.persistentconnection (1.0 - 1.0)  /System/Library/PrivateFrameworks/PersistentConnection.framework/Versions/A/PersistentConnection
    855        0x1a2509000 -        0x1a2516fff  com.apple.GraphVisualizer (1.0 - 100.1)  /System/Library/PrivateFrameworks/GraphVisualizer.framework/Versions/A/GraphVisualizer
    856        0x1a2517000 -        0x1a2929fff  com.apple.vision.FaceCore (4.3.2 - 4.3.2)  /System/Library/PrivateFrameworks/FaceCore.framework/Versions/A/FaceCore
    857        0x1a292a000 -        0x1a2969fff  com.apple.OTSVG (1.0 - 677.6.0.2)  /System/Library/PrivateFrameworks/OTSVG.framework/Versions/A/OTSVG
    858        0x1a296a000 -        0x1a2971fff  com.apple.xpc.AppServerSupport (1.0 - 2038.120.1)  /System/Library/PrivateFrameworks/AppServerSupport.framework/Versions/A/AppServerSupport
    859        0x1a2972000 -        0x1a2980fff  libhvf.dylib (1.0 - $[CURRENT_PROJECT_VERSION])  /System/Library/PrivateFrameworks/FontServices.framework/libhvf.dylib
    860        0x1a2981000 -        0x1a2987fff  libspindump.dylib (295.2)  /usr/lib/libspindump.dylib
    861        0x1a2988000 -        0x1a2a3afff  com.apple.Heimdal (4.0 - 2.0)  /System/Library/PrivateFrameworks/Heimdal.framework/Versions/A/Heimdal
    862        0x1a2a3b000 -        0x1a2a55fff  com.apple.login (3.0 - 3.0)  /System/Library/PrivateFrameworks/login.framework/Versions/A/login
    863        0x1a2a56000 -        0x1a2b2efff  com.apple.corebrightness (1.0 - 1)  /System/Library/PrivateFrameworks/CoreBrightness.framework/Versions/A/CoreBrightness
    864        0x1a2bcb000 -        0x1a2bcefff  libodfde.dylib (26)  /usr/lib/libodfde.dylib
    865        0x1a2bcf000 -        0x1a2c09fff  com.apple.bom (14.0 - 235)  /System/Library/PrivateFrameworks/Bom.framework/Versions/A/Bom
    866        0x1a2c0a000 -        0x1a2c4dfff  com.apple.AppleJPEG (1.0 - 1)  /System/Library/PrivateFrameworks/AppleJPEG.framework/Versions/A/AppleJPEG
    867        0x1a2c4e000 -        0x1a2d2ffff  libJP2.dylib (2130.7.3)  /System/Library/Frameworks/ImageIO.framework/Versions/A/Resources/libJP2.dylib
    868        0x1a2d30000 -        0x1a2d33fff  com.apple.WatchdogClient.framework (1.0 - 98.120.2)  /System/Library/PrivateFrameworks/WatchdogClient.framework/Versions/A/WatchdogClient
    869        0x1a2d34000 -        0x1a2d6cfff  com.apple.MultitouchSupport.framework (4440.3 - 4440.3)  /System/Library/PrivateFrameworks/MultitouchSupport.framework/Versions/A/MultitouchSupport
    870        0x1a2d6d000 -        0x1a2e9dfff  com.apple.VideoToolbox (1.0 - 2780.10)  /System/Library/Frameworks/VideoToolbox.framework/Versions/A/VideoToolbox
    871        0x1a2e9e000 -        0x1a2ed0fff  libAudioToolboxUtility.dylib (1181.72)  /usr/lib/libAudioToolboxUtility.dylib
    872        0x1a2ed1000 -        0x1a2ef2fff  libPng.dylib (2130.7.3)  /System/Library/Frameworks/ImageIO.framework/Versions/A/Resources/libPng.dylib
    873        0x1a2ef3000 -        0x1a2f4ffff  libTIFF.dylib (2130.7.3)  /System/Library/Frameworks/ImageIO.framework/Versions/A/Resources/libTIFF.dylib
    874        0x1a2f50000 -        0x1a2f6efff  com.apple.IOPresentment (58 - 37)  /System/Library/PrivateFrameworks/IOPresentment.framework/Versions/A/IOPresentment
    875        0x1a2f6f000 -        0x1a2f73fff  com.apple.GPUWrangler (6.3.5 - 6.3.5)  /System/Library/PrivateFrameworks/GPUWrangler.framework/Versions/A/GPUWrangler
    876        0x1a2f74000 -        0x1a2f76fff  libRadiance.dylib (2130.7.3)  /System/Library/Frameworks/ImageIO.framework/Versions/A/Resources/libRadiance.dylib
    877        0x1a2f77000 -        0x1a2f7cfff  com.apple.DSExternalDisplay (3.1 - 380)  /System/Library/PrivateFrameworks/DSExternalDisplay.framework/Versions/A/DSExternalDisplay
    878        0x1a2f7d000 -        0x1a2f9dfff  libJPEG.dylib (2130.7.3)  /System/Library/Frameworks/ImageIO.framework/Versions/A/Resources/libJPEG.dylib
    879        0x1a2f9e000 -        0x1a2fcdfff  com.apple.ATSUI (1.0 - 1)  /System/Library/Frameworks/ApplicationServices.framework/Versions/A/Frameworks/ATSUI.framework/Versions/A/ATSUI
    880        0x1a2fce000 -        0x1a2fd2fff  libGIF.dylib (2130.7.3)  /System/Library/Frameworks/ImageIO.framework/Versions/A/Resources/libGIF.dylib
    881        0x1a2fd3000 -        0x1a2fdcfff  com.apple.CMCaptureCore (1.0 - 82.6)  /System/Library/PrivateFrameworks/CMCaptureCore.framework/Versions/A/CMCaptureCore
    882        0x1a2fdd000 -        0x1a3024fff  com.apple.print.framework.PrintCore (16.1 - 531.1)  /System/Library/Frameworks/ApplicationServices.framework/Versions/A/Frameworks/PrintCore.framework/Versions/A/PrintCore
    883        0x1a3025000 -        0x1a30d8fff  com.apple.TextureIO (3.10.9 - 3.10.9)  /System/Library/PrivateFrameworks/TextureIO.framework/Versions/A/TextureIO
    884        0x1a30d9000 -        0x1a30e1fff  com.apple.InternationalSupport (1.0 - 61.1)  /System/Library/PrivateFrameworks/InternationalSupport.framework/Versions/A/InternationalSupport
    885        0x1a30e2000 -        0x1a3156fff  com.apple.datadetectorscore (8.0 - 674)  /System/Library/PrivateFrameworks/DataDetectorsCore.framework/Versions/A/DataDetectorsCore
    886        0x1a3157000 -        0x1a31b6fff  com.apple.UserActivity (439 - 439)  /System/Library/PrivateFrameworks/UserActivity.framework/Versions/A/UserActivity
    887        0x1a31b7000 -        0x1a3956fff  com.apple.MediaToolbox (1.0 - 2780.10)  /System/Library/Frameworks/MediaToolbox.framework/Versions/A/MediaToolbox
    888        0x1a3e06000 -        0x1a3e70fff  com.apple.imfoundation (10.0 - 1000)  /System/Library/PrivateFrameworks/IMFoundation.framework/Versions/A/IMFoundation
    889        0x1a3e71000 -        0x1a3e98fff  com.apple.locationsupport (2420.19.23 - 2420.19.23)  /System/Library/PrivateFrameworks/LocationSupport.framework/Versions/A/LocationSupport
    890        0x1a3e99000 -        0x1a3ecefff  libSessionUtility.dylib (76.69)  /System/Library/PrivateFrameworks/AudioSession.framework/libSessionUtility.dylib
    891        0x1a3ecf000 -        0x1a3ff7fff  com.apple.audio.toolbox.AudioToolbox (1.14 - 1.14)  /System/Library/Frameworks/AudioToolbox.framework/Versions/A/AudioToolbox
    892        0x1a3ff8000 -        0x1a405ffff  com.apple.audio.AudioSession (1.0 - 76.69)  /System/Library/PrivateFrameworks/AudioSession.framework/Versions/A/AudioSession
    893        0x1a4060000 -        0x1a4072fff  libAudioStatistics.dylib (27.64)  /usr/lib/libAudioStatistics.dylib
    894        0x1a4073000 -        0x1a4086fff  com.apple.speech.synthesis.framework (9.0.66 - 9.0.66)  /System/Library/Frameworks/ApplicationServices.framework/Versions/A/Frameworks/SpeechSynthesis.framework/Versions/A/SpeechSynthesis
    895        0x1a4087000 -        0x1a40f5fff  com.apple.ApplicationServices.ATS (377 - 516)  /System/Library/Frameworks/ApplicationServices.framework/Versions/A/Frameworks/ATS.framework/Versions/A/ATS
    896        0x1a40f6000 -        0x1a410efff  libresolv.9.dylib (68)  /usr/lib/libresolv.9.dylib
    897        0x1a410f000 -        0x1a4122fff  libsasl2.2.dylib (214)  /usr/lib/libsasl2.2.dylib
    898        0x1a418c000 -        0x1a41bcfff  com.apple.securityinterface (10.0 - 55149.120.1)  /System/Library/Frameworks/SecurityInterface.framework/Versions/A/SecurityInterface
    899        0x1a41d6000 -        0x1a423afff  com.apple.CoreMediaIO (1000.0 - 5325)  /System/Library/Frameworks/CoreMediaIO.framework/Versions/A/CoreMediaIO
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    1016        0x1aacad000 -        0x1aacb9fff  com.apple.CoreDuetDaemonProtocol (1.0 - 1)  /System/Library/PrivateFrameworks/CoreDuetDaemonProtocol.framework/Versions/A/CoreDuetDaemonProtocol
    1017        0x1aacba000 -        0x1aacc0fff  com.apple.ASEProcessing (1.26.0 - 1.26.0)  /System/Library/PrivateFrameworks/ASEProcessing.framework/Versions/A/ASEProcessing
    1018        0x1aaf57000 -        0x1ab20cfff  com.apple.spotlight.index (10.7.0 - 2150.26)  /System/Library/PrivateFrameworks/SpotlightIndex.framework/Versions/A/SpotlightIndex
    1019        0x1ab3a4000 -        0x1ab3f3fff  com.apple.CalDAV (8.0 - 795)  /System/Library/PrivateFrameworks/CalDAV.framework/Versions/A/CalDAV
    1020        0x1ab3f4000 -        0x1ab49cfff  com.apple.CoreSuggestions (1.0 - 1115.519)  /System/Library/PrivateFrameworks/CoreSuggestions.framework/Versions/A/CoreSuggestions
    1021        0x1ab49d000 -        0x1ab626fff  com.apple.ical.EventKit (3.0 - 1414.5.1)  /System/Library/Frameworks/EventKit.framework/Versions/A/EventKit
    1022        0x1ab627000 -        0x1ab8e3fff  com.apple.CalendarPersistence (8.0 - 1071.4.4)  /System/Library/PrivateFrameworks/CalendarPersistence.framework/Versions/A/CalendarPersistence
    1023        0x1ab8e4000 -        0x1ab90bfff  com.apple.CalendarAgentLink (8.0 - 250)  /System/Library/PrivateFrameworks/CalendarAgentLink.framework/Versions/A/CalendarAgentLink
    1024        0x1ab90c000 -        0x1ab917fff  com.apple.RTCReporting (11.85.2 - 11.85.2)  /System/Library/PrivateFrameworks/RTCReporting.framework/Versions/A/RTCReporting
    1025        0x1abada000 -        0x1abaeffff  com.apple.CoreML.AppleNeuralEngine (1.0 - 1)  /System/Library/PrivateFrameworks/AppleNeuralEngine.framework/Versions/A/AppleNeuralEngine
    1026        0x1abb45000 -        0x1abbb1fff  com.apple.audio.midi.CoreMIDI (2.0 - 88)  /System/Library/Frameworks/CoreMIDI.framework/Versions/A/CoreMIDI
    1027        0x1abc49000 -        0x1abc4cfff  com.apple.Cocoa (6.11 - 23)  /System/Library/Frameworks/Cocoa.framework/Versions/A/Cocoa
    1028        0x1abc96000 -        0x1ac17ffff  com.apple.AppleMediaServices (1.0 - 1)  /System/Library/PrivateFrameworks/AppleMediaServices.framework/Versions/A/AppleMediaServices
    1029        0x1ac180000 -        0x1ac183fff  com.apple.IOSurfaceAccelerator (1.0.0 - 1.0.0)  /System/Library/PrivateFrameworks/IOSurfaceAccelerator.framework/Versions/A/IOSurfaceAccelerator
    1030        0x1ac1b9000 -        0x1ac5c6fff  com.apple.MediaRemote (1.0 - 1)  /System/Library/PrivateFrameworks/MediaRemote.framework/Versions/A/MediaRemote
    1031        0x1ac8df000 -        0x1ac8e6fff  com.apple.DisplayServicesFW (3.1 - 380)  /System/Library/PrivateFrameworks/DisplayServices.framework/Versions/A/DisplayServices
    1032        0x1ad192000 -        0x1ad1c3fff  libtidy.A.dylib (18.2)  /usr/lib/libtidy.A.dylib
    1033        0x1ad1c4000 -        0x1ad1e4fff  com.apple.MarkupUI (1.0 - 383.6)  /System/Library/PrivateFrameworks/MarkupUI.framework/Versions/A/MarkupUI
    1034        0x1ad1e5000 -        0x1ad1fafff  com.apple.Engram (1.0 - 1)  /System/Library/PrivateFrameworks/Engram.framework/Versions/A/Engram
    1035        0x1ad1fb000 -        0x1ad222fff  com.apple.openscripting (1.7 - 190)  /System/Library/Frameworks/Carbon.framework/Versions/A/Frameworks/OpenScripting.framework/Versions/A/OpenScripting
    1036        0x1ad223000 -        0x1ad226fff  com.apple.securityhi (9.0 - 55008)  /System/Library/Frameworks/Carbon.framework/Versions/A/Frameworks/SecurityHI.framework/Versions/A/SecurityHI
    1037        0x1ad227000 -        0x1ad22afff  com.apple.ink.framework (10.15 - 227)  /System/Library/Frameworks/Carbon.framework/Versions/A/Frameworks/Ink.framework/Versions/A/Ink
    1038        0x1ad22b000 -        0x1ad22efff  com.apple.CommonPanels (1.2.6 - 101)  /System/Library/Frameworks/Carbon.framework/Versions/A/Frameworks/CommonPanels.framework/Versions/A/CommonPanels
    1039        0x1ad22f000 -        0x1ad236fff  com.apple.ImageCapture (1711.5.2 - 1711.5.2)  /System/Library/Frameworks/Carbon.framework/Versions/A/Frameworks/ImageCapture.framework/Versions/A/ImageCapture
    1040        0x1ad237000 -        0x1ae30bfff  com.apple.JavaScriptCore (16611 - 16611.3.10.1.6)  /System/Library/Frameworks/JavaScriptCore.framework/Versions/A/JavaScriptCore
    1041        0x1ae379000 -        0x1ae48dfff  com.apple.AVFCapture (1.0 - 82.6)  /System/Library/PrivateFrameworks/AVFCapture.framework/Versions/A/AVFCapture
    1042        0x1ae48e000 -        0x1ae51ffff  com.apple.Quagga (47 - 47)  /System/Library/PrivateFrameworks/Quagga.framework/Versions/A/Quagga
    1043        0x1ae520000 -        0x1ae757fff  com.apple.CMCapture (1.0 - 82.6)  /System/Library/PrivateFrameworks/CMCapture.framework/Versions/A/CMCapture
    1044        0x1aeae8000 -        0x1aeb93fff  com.apple.accounts.AccountsDaemon (113 - 113)  /System/Library/PrivateFrameworks/AccountsDaemon.framework/Versions/A/AccountsDaemon
    1045        0x1aeb94000 -        0x1aeb96fff  com.apple.OAuth (25 - 25)  /System/Library/PrivateFrameworks/OAuth.framework/Versions/A/OAuth
    1046        0x1af171000 -        0x1af17dfff  com.apple.HID (1.0 - 1)  /System/Library/PrivateFrameworks/HID.framework/Versions/A/HID
    1047        0x1af17e000 -        0x1af27dfff  com.apple.QuickLookUIFramework (5.0 - 928.4)  /System/Library/Frameworks/Quartz.framework/Versions/A/Frameworks/QuickLookUI.framework/Versions/A/QuickLookUI
    1048        0x1af27e000 -        0x1af29cfff  com.apple.IOGPU (21.11 - 21.11)  /System/Library/PrivateFrameworks/IOGPU.framework/Versions/A/IOGPU
    1049        0x1af64e000 -        0x1af6cdfff  com.apple.coredav (1.0.1 - 889)  /System/Library/PrivateFrameworks/CoreDAV.framework/Versions/A/CoreDAV
    1050        0x1af6ce000 -        0x1af725fff  com.apple.ExchangeWebServices (8.0 - 814.100.1)  /System/Library/PrivateFrameworks/ExchangeWebServices.framework/Versions/A/ExchangeWebServices
    1051        0x1af726000 -        0x1af768fff  com.apple.MediaServices (1.0 - 1)  /System/Library/PrivateFrameworks/MediaServices.framework/Versions/A/MediaServices
    1052        0x1af876000 -        0x1af876fff  com.apple.marco (10.0 - 1000)  /System/Library/PrivateFrameworks/Marco.framework/Versions/A/Marco
    1053        0x1afa68000 -        0x1afaa5fff  com.apple.contacts.ContactsAutocomplete (1.0 - 1152.4)  /System/Library/PrivateFrameworks/ContactsAutocomplete.framework/Versions/A/ContactsAutocomplete
    1054        0x1afaa6000 -        0x1afab2fff  com.apple.KerberosHelper (4.0 - 1.0)  /System/Library/PrivateFrameworks/KerberosHelper.framework/Versions/A/KerberosHelper
    1055        0x1afab3000 -        0x1afaf6fff  com.apple.ResponseKit (1.0 - 165.2)  /System/Library/PrivateFrameworks/ResponseKit.framework/Versions/A/ResponseKit
    1056        0x1afaf7000 -        0x1afb18fff  com.apple.proactive.support.ProactiveEventTracker (1.0 - 294.7)  /System/Library/PrivateFrameworks/ProactiveEventTracker.framework/Versions/A/ProactiveEventTracker
    1057        0x1aff3c000 -        0x1aff40fff  com.apple.PhoneNumbers (1.0 - 1)  /System/Library/PrivateFrameworks/PhoneNumbers.framework/Versions/A/PhoneNumbers
    1058        0x1aff41000 -        0x1aff48fff  com.apple.URLFormatting (146 - 146.22)  /System/Library/PrivateFrameworks/URLFormatting.framework/Versions/A/URLFormatting
    1059        0x1b280f000 -        0x1b282ffff  com.apple.quicklook.QuickLookSupport (1.0 - 135.5)  /System/Library/PrivateFrameworks/QuickLookSupport.framework/Versions/A/QuickLookSupport
    1060        0x1b2830000 -        0x1b28c3fff  com.apple.AirPlaySync (1.0 - 2780.10)  /System/Library/PrivateFrameworks/AirPlaySync.framework/Versions/A/AirPlaySync
    1061        0x1b347f000 -        0x1b34fefff  com.apple.CorePDF (4.0 - 529)  /System/Library/PrivateFrameworks/CorePDF.framework/Versions/A/CorePDF
    1062        0x1b34ff000 -        0x1b3502fff  com.apple.print.framework.Print (15 - 271)  /System/Library/Frameworks/Carbon.framework/Versions/A/Frameworks/Print.framework/Versions/A/Print
    1063        0x1b3503000 -        0x1b3506fff  com.apple.Carbon (160 - 164)  /System/Library/Frameworks/Carbon.framework/Versions/A/Carbon
    1064        0x1b3607000 -        0x1b3607fff  com.apple.avfoundation (2.0 - 2020.10)  /System/Library/Frameworks/AVFoundation.framework/Versions/A/AVFoundation
    1065        0x1b37cd000 -        0x1b37e9fff  com.apple.private.SystemPolicy (1.0 - 1)  /System/Library/PrivateFrameworks/SystemPolicy.framework/Versions/A/SystemPolicy
    1066        0x1b3989000 -        0x1b39a8fff  com.apple.sidecar-core (1.0 - 231)  /System/Library/PrivateFrameworks/SidecarCore.framework/Versions/A/SidecarCore
    1067        0x1b39a9000 -        0x1b39b0fff  com.apple.QuickLookNonBaseSystem (1.0 - 1)  /System/Library/PrivateFrameworks/QuickLookNonBaseSystem.framework/Versions/A/QuickLookNonBaseSystem
    1068        0x1b3de7000 -        0x1b3decfff  com.apple.FeatureFlagsSupport (1.0 - 28.60.1)  /System/Library/PrivateFrameworks/FeatureFlagsSupport.framework/Versions/A/FeatureFlagsSupport
    1069        0x1b3f60000 -        0x1b3f7bfff  com.apple.SafariServices.framework (16611 - 16611.3.10.1.6)  /System/Library/Frameworks/SafariServices.framework/Versions/A/SafariServices
    1070        0x1b413a000 -        0x1b4145fff  com.apple.MallocStackLogging (1.0 - 1)  /System/Library/PrivateFrameworks/MallocStackLogging.framework/Versions/A/MallocStackLogging
    1071        0x1b415a000 -        0x1b416cfff  libmis.dylib (274.140.2)  /usr/lib/libmis.dylib
    1072        0x1b418a000 -        0x1b42befff  com.apple.CoreHandwriting (161 - 1.2)  /System/Library/PrivateFrameworks/CoreHandwriting.framework/Versions/A/CoreHandwriting
    1073        0x1b42bf000 -        0x1b44c5fff  com.apple.imageKit (3.0 - 1100)  /System/Library/Frameworks/Quartz.framework/Versions/A/Frameworks/ImageKit.framework/Versions/A/ImageKit
    1074        0x1b44c6000 -        0x1b45d0fff  com.apple.PencilKit (1.0 - 1)  /System/Library/Frameworks/PencilKit.framework/Versions/A/PencilKit
    1075        0x1b45d1000 -        0x1b45e2fff  com.apple.sidecar-ui (1.0 - 231)  /System/Library/PrivateFrameworks/SidecarUI.framework/Versions/A/SidecarUI
    1076        0x1b4c36000 -        0x1b4c8ffff  com.apple.ImageCaptureCore (1711.5.2 - 1711.5.2)  /System/Library/Frameworks/ImageCaptureCore.framework/Versions/A/ImageCaptureCore
    1077        0x1b4c90000 -        0x1b4cb5fff  com.apple.quartzfilters (1.10.0 - 98)  /System/Library/Frameworks/Quartz.framework/Versions/A/Frameworks/QuartzFilters.framework/Versions/A/QuartzFilters
    1078        0x1b4f03000 -        0x1b5075fff  com.apple.MediaPlayer (1.0 - 1.0)  /System/Library/Frameworks/MediaPlayer.framework/Versions/A/MediaPlayer
    1079        0x1b5076000 -        0x1b533afff  com.apple.iTunesCloud (1.0 - 1)  /System/Library/PrivateFrameworks/iTunesCloud.framework/Versions/A/iTunesCloud
    1080        0x1b538e000 -        0x1b54aafff  com.apple.AnnotationKit (1.0 - 383.6)  /System/Library/PrivateFrameworks/AnnotationKit.framework/Versions/A/AnnotationKit
    1081        0x1b54ab000 -        0x1b5963fff  com.apple.QuartzComposer (5.1 - 383)  /System/Library/Frameworks/Quartz.framework/Versions/A/Frameworks/QuartzComposer.framework/Versions/A/QuartzComposer
    1082        0x1b5964000 -        0x1b5a44fff  com.apple.PDFKit (1.0 - 950.40.3)  /System/Library/Frameworks/PDFKit.framework/Versions/A/PDFKit
    1083        0x1b784e000 -        0x1b7851fff  com.apple.quartzframework (1.5 - 25)  /System/Library/Frameworks/Quartz.framework/Versions/A/Quartz
    1084        0x1b7b4d000 -        0x1b7b66fff  libCGInterfaces.dylib (544.4)  /System/Library/Frameworks/Accelerate.framework/Versions/A/Frameworks/vImage.framework/Versions/A/Libraries/libCGInterfaces.dylib
    1085        0x1b921f000 -        0x1b9e0afff  libfaceCore.dylib (4.3.1)  /System/Library/Frameworks/Vision.framework/libfaceCore.dylib
    1086        0x1b9e0b000 -        0x1b9f06fff  com.apple.TextRecognition (1.0 - 157)  /System/Library/PrivateFrameworks/TextRecognition.framework/Versions/A/TextRecognition
    1087        0x1b9f07000 -        0x1b9f1efff  com.apple.Futhark (1.0 - 1)  /System/Library/PrivateFrameworks/Futhark.framework/Versions/A/Futhark
    1088        0x1b9fa3000 -        0x1ba1c2fff  com.apple.RawCamera.bundle (9.10.0 - 1450.3)  /System/Library/CoreServices/RawCamera.bundle/Contents/MacOS/RawCamera
    1089        0x1baa6b000 -        0x1baa6ffff  com.apple.DAAPKit (1.0 - 1)  /System/Library/PrivateFrameworks/DAAPKit.framework/Versions/A/DAAPKit
    1090        0x1bc38f000 -        0x1bc392fff  libpmenergy.dylib (227.140.1)  /usr/lib/libpmenergy.dylib
    1091        0x1be01f000 -        0x1be05afff  com.apple.osanalytics.OSAnalytics (1.0 - 1)  /System/Library/PrivateFrameworks/OSAnalytics.framework/Versions/A/OSAnalytics
    1092        0x1be8a4000 -        0x1be8bffff  com.apple.network.statistics.framework (1.2 - 1)  /System/Library/PrivateFrameworks/NetworkStatistics.framework/Versions/A/NetworkStatistics
    1093        0x1c7939000 -        0x1c79d7fff  com.apple.Symbolication (12.5 - 64544.70.1)  /System/Library/PrivateFrameworks/Symbolication.framework/Versions/A/Symbolication
    1094        0x1c7bd5000 -        0x1c7bd8fff  libpmsample.dylib (227.140.1)  /usr/lib/libpmsample.dylib
    1095        0x1ca0fa000 -        0x1ca134fff  com.apple.ReplayKit (1.0 - 1)  /System/Library/Frameworks/ReplayKit.framework/Versions/A/ReplayKit
    1096        0x1cb77a000 -        0x1cb77dfff  com.apple.ForceFeedback (1.0.6 - 1.0.6)  /System/Library/Frameworks/ForceFeedback.framework/Versions/A/ForceFeedback
    1097        0x1d375a000 -        0x1d3769fff  libSimplifiedChineseConverter.dylib (90)  /System/Library/CoreServices/Encodings/libSimplifiedChineseConverter.dylib
    1098        0x1d7b8e000 -        0x1d7b92fff  libmetal_timestamp.dylib (31001.192.1)  /System/Library/PrivateFrameworks/GPUCompiler.framework/Versions/31001/Libraries/libmetal_timestamp.dylib
    1099        0x1d9de0000 -        0x1d9de6fff  libCoreFSCache.dylib (200.11)  /System/Library/Frameworks/OpenGL.framework/Versions/A/Libraries/libCoreFSCache.dylib
    1100        0x1d9de7000 -        0x1d9decfff  libCoreVMClient.dylib (200.11)  /System/Library/Frameworks/OpenGL.framework/Versions/A/Libraries/libCoreVMClient.dylib
    1101        0x1d9ded000 -        0x1d9dfcfff  com.apple.opengl (18.5.9 - 18.5.9)  /System/Library/Frameworks/OpenGL.framework/Versions/A/OpenGL
    1102        0x1d9dfd000 -        0x1d9dfffff  libCVMSPluginSupport.dylib (18.5.9)  /System/Library/Frameworks/OpenGL.framework/Versions/A/Libraries/libCVMSPluginSupport.dylib
    1103        0x1d9e00000 -        0x1d9e08fff  libGFXShared.dylib (18.5.9)  /System/Library/Frameworks/OpenGL.framework/Versions/A/Libraries/libGFXShared.dylib
    1104        0x1d9e09000 -        0x1d9e41fff  libGLImage.dylib (18.5.9)  /System/Library/Frameworks/OpenGL.framework/Versions/A/Libraries/libGLImage.dylib
    1105        0x1d9e42000 -        0x1d9e7afff  libGLU.dylib (18.5.9)  /System/Library/Frameworks/OpenGL.framework/Versions/A/Libraries/libGLU.dylib
    1106        0x1d9e7b000 -        0x1d9fe7fff  libGLProgrammability.dylib (18.5.9)  /System/Library/Frameworks/OpenGL.framework/Versions/A/Libraries/libGLProgrammability.dylib
    1107        0x1d9fe8000 -        0x1d9ff2fff  libGL.dylib (18.5.9)  /System/Library/Frameworks/OpenGL.framework/Versions/A/Libraries/libGL.dylib
    1108        0x1d9ff3000 -        0x1da15dfff  GLEngine (18.5.9)  /System/Library/Frameworks/OpenGL.framework/Versions/A/Resources/GLEngine.bundle/GLEngine
    1109        0x1da15e000 -        0x1da182fff  GLRendererFloat (18.5.9)  /System/Library/Frameworks/OpenGL.framework/Versions/A/Resources/GLRendererFloat.bundle/GLRendererFloat
    1110        0x1da183000 -        0x1da1e2fff  com.apple.opencl (4.6 - 4.6)  /System/Library/Frameworks/OpenCL.framework/Versions/A/OpenCL
    1111        0x1dac61000 -        0x1dac68fff  com.apple.agl (3.3.4 - AGL-3.3.3)  /System/Library/Frameworks/AGL.framework/Versions/A/AGL
    1112        0x1dac69000 -        0x1dad4ffff  com.apple.audio.AVFAudio (1.0 - 477.88)  /System/Library/Frameworks/AVFAudio.framework/Versions/A/AVFAudio
    1113        0x1dd231000 -        0x1dd23cfff  com.apple.CMImaging (1.0 - 82.6)  /System/Library/PrivateFrameworks/CMImaging.framework/Versions/A/CMImaging
    1114        0x1e343c000 -        0x1e3447fff  com.apple.SymptomAnalytics (1.0 - 1431.140.1)  /System/Library/PrivateFrameworks/Symptoms.framework/Frameworks/SymptomAnalytics.framework/Versions/A/SymptomAnalytics
    1115        0x1e3661000 -        0x1e367afff  com.apple.SymptomPresentationFeed (1.0 - 1431.140.1)  /System/Library/PrivateFrameworks/Symptoms.framework/Frameworks/SymptomPresentationFeed.framework/Versions/A/SymptomPresentationFeed
    1116        0x1eb256000 -        0x1eb25dfff  libRosetta.dylib (203.58)  /usr/lib/libRosetta.dylib
    1117        0x29446c000 -        0x29447bfff +numpy_formathandler.cpython-39-darwin.so (0)  /Applications/ChimeraX-1.6.1.app/Contents/Library/Frameworks/Python.framework/Versions/3.9/lib/python3.9/site-packages/OpenGL_accelerate/numpy_formathandler.cpython-39-darwin.so
    1118        0x29475c000 -        0x294763fff +nones_formathandler.cpython-39-darwin.so (0)  /Applications/ChimeraX-1.6.1.app/Contents/Library/Frameworks/Python.framework/Versions/3.9/lib/python3.9/site-packages/OpenGL_accelerate/nones_formathandler.cpython-39-darwin.so
    1119 
    1120 External Modification Summary:
    1121   Calls made by other processes targeting this process:
    1122     task_for_pid: 0
    1123     thread_create: 0
    1124     thread_set_state: 0
    1125   Calls made by this process:
    1126     task_for_pid: 0
    1127     thread_create: 0
    1128     thread_set_state: 0
    1129   Calls made by all processes on this machine:
    1130     task_for_pid: 1
    1131     thread_create: 0
    1132     thread_set_state: 0
    1133 
    1134 VM Region Summary:
    1135 ReadOnly portion of Libraries: Total=1.1G resident=0K(0%) swapped_out_or_unallocated=1.1G(100%)
    1136 Writable regions: Total=90.7G written=0K(0%) resident=0K(0%) swapped_out=0K(0%) unallocated=90.7G(100%)
    1137  
    1138                                 VIRTUAL   REGION
    1139 REGION TYPE                        SIZE    COUNT (non-coalesced)
    1140 ===========                     =======  =======
    1141 Accelerate framework               128K        1
    1142 Activity Tracing                   256K        1
    1143 CG backing stores                 5088K        6
    1144 CG image                           192K        8
    1145 CoreAnimation                      192K       12
    1146 CoreGraphics                        32K        2
    1147 CoreUI image data                 2496K       18
    1148 Foundation                          16K        1
    1149 Kernel Alloc Once                   32K        1
    1150 MALLOC                            88.2G     1487
    1151 MALLOC guard page                  192K       10
    1152 MALLOC_MEDIUM (reserved)         808.0M        8         reserved VM address space (unallocated)
    1153 Mach message                        64K        3
    1154 OpenGL GLSL                        384K        4
    1155 STACK GUARD                       56.5M       34
    1156 Stack                            152.8M       34
    1157 VM_ALLOCATE                        1.4G     5497
    1158 VM_ALLOCATE (reserved)           160.0M        2         reserved VM address space (unallocated)
    1159 __AUTH                            1018K      259
    1160 __AUTH_CONST                      15.0M      450
    1161 __DATA                            18.4M      588
    1162 __DATA_CONST                      25.5M      591
    1163 __DATA_DIRTY                      1799K      208
    1164 __FONT_DATA                          4K        1
    1165 __GLSLBUILTINS                    5176K        1
    1166 __LINKEDIT                       518.7M      150
    1167 __OBJC_CONST                      3269K      250
    1168 __OBJC_RO                         75.1M        1
    1169 __OBJC_RW                         2576K        1
    1170 __TEXT                           580.5M      612
    1171 __UNICODE                          588K        1
    1172 mapped file                      590.3M       63
    1173 shared memory                     3104K       20
    1174 ===========                     =======  =======
    1175 TOTAL                             92.6G    10325
    1176 TOTAL, minus reserved VM space    91.6G    10325
    1177 
    1178 
    1179 
    1180 Log:
    1181 Startup Messages 
    1182 --- 
    1183 warning | Replacing fetcher for 'pdb_nmr' and format NMRSTAR from NMRSTAR
    1184 bundle with that from NMRSTAR bundle 
    1185  
    1186 UCSF ChimeraX version: 1.6.1 (2023-05-09) 
    1187 © 2016-2023 Regents of the University of California. All rights reserved. 
    1188 How to cite UCSF ChimeraX 
    1189 
    1190 > open
    1191 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/chimera_movie.py
    1192 
    1193 Total number of pdb files: 505 
    1194 
    1195 > open
    1196 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/0.pdb
    1197 
    1198 Summary of feedback from opening
    1199 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/0.pdb 
    1200 --- 
    1201 warnings | Ignored bad PDB record found on line 1 
    1202 REMARK GENERATED BY TRJCONV 
    1203  
    1204 Ignored bad PDB record found on line 3 
    1205 REMARK THIS IS A SIMULATION BOX 
    1206  
    1207 0.pdb title: 
    1208 Title t= 0.00000 step= 0 [more info...] 
    1209  
    1210 Chain information for 0.pdb #1 
    1211 --- 
    1212 Chain | Description 
    1213 A B | No description available 
    1214  
    1215 Non-standard residues in 0.pdb #1 
    1216 --- 
    1217 HSD — (HSD) 
    1218 POT — (POT) 
    1219  
    1220 
    1221 > open
    1222 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/0.2.pdb
    1223 
    1224 Summary of feedback from opening
    1225 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/0.2.pdb 
    1226 --- 
    1227 warnings | Ignored bad PDB record found on line 1 
    1228 REMARK GENERATED BY TRJCONV 
    1229  
    1230 Ignored bad PDB record found on line 3 
    1231 REMARK THIS IS A SIMULATION BOX 
    1232  
    1233 0.2.pdb title: 
    1234 Title t= 200.00000 step= 100000 [more info...] 
    1235  
    1236 Chain information for 0.2.pdb #2 
    1237 --- 
    1238 Chain | Description 
    1239 A B | No description available 
    1240  
    1241 Non-standard residues in 0.2.pdb #2 
    1242 --- 
    1243 HSD — (HSD) 
    1244 POT — (POT) 
    1245  
    1246 
    1247 > open
    1248 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/0.4.pdb
    1249 
    1250 Summary of feedback from opening
    1251 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/0.4.pdb 
    1252 --- 
    1253 warnings | Ignored bad PDB record found on line 1 
    1254 REMARK GENERATED BY TRJCONV 
    1255  
    1256 Ignored bad PDB record found on line 3 
    1257 REMARK THIS IS A SIMULATION BOX 
    1258  
    1259 0.4.pdb title: 
    1260 Title t= 400.00000 step= 200000 [more info...] 
    1261  
    1262 Chain information for 0.4.pdb #3 
    1263 --- 
    1264 Chain | Description 
    1265 A B | No description available 
    1266  
    1267 Non-standard residues in 0.4.pdb #3 
    1268 --- 
    1269 HSD — (HSD) 
    1270 POT — (POT) 
    1271  
    1272 
    1273 > open
    1274 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/0.6.pdb
    1275 
    1276 Summary of feedback from opening
    1277 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/0.6.pdb 
    1278 --- 
    1279 warnings | Ignored bad PDB record found on line 1 
    1280 REMARK GENERATED BY TRJCONV 
    1281  
    1282 Ignored bad PDB record found on line 3 
    1283 REMARK THIS IS A SIMULATION BOX 
    1284  
    1285 0.6.pdb title: 
    1286 Title t= 600.00000 step= 300000 [more info...] 
    1287  
    1288 Chain information for 0.6.pdb #4 
    1289 --- 
    1290 Chain | Description 
    1291 A B | No description available 
    1292  
    1293 Non-standard residues in 0.6.pdb #4 
    1294 --- 
    1295 HSD — (HSD) 
    1296 POT — (POT) 
    1297  
    1298 
    1299 > open
    1300 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/0.8.pdb
    1301 
    1302 Summary of feedback from opening
    1303 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/0.8.pdb 
    1304 --- 
    1305 warnings | Ignored bad PDB record found on line 1 
    1306 REMARK GENERATED BY TRJCONV 
    1307  
    1308 Ignored bad PDB record found on line 3 
    1309 REMARK THIS IS A SIMULATION BOX 
    1310  
    1311 0.8.pdb title: 
    1312 Title t= 800.00000 step= 400000 [more info...] 
    1313  
    1314 Chain information for 0.8.pdb #5 
    1315 --- 
    1316 Chain | Description 
    1317 A B | No description available 
    1318  
    1319 Non-standard residues in 0.8.pdb #5 
    1320 --- 
    1321 HSD — (HSD) 
    1322 POT — (POT) 
    1323  
    1324 
    1325 > open
    1326 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/1.0.pdb
    1327 
    1328 Summary of feedback from opening
    1329 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/1.0.pdb 
    1330 --- 
    1331 warnings | Ignored bad PDB record found on line 1 
    1332 REMARK GENERATED BY TRJCONV 
    1333  
    1334 Ignored bad PDB record found on line 3 
    1335 REMARK THIS IS A SIMULATION BOX 
    1336  
    1337 1.0.pdb title: 
    1338 Title t= 1000.00000 step= 500000 [more info...] 
    1339  
    1340 Chain information for 1.0.pdb #6 
    1341 --- 
    1342 Chain | Description 
    1343 A B | No description available 
    1344  
    1345 Non-standard residues in 1.0.pdb #6 
    1346 --- 
    1347 HSD — (HSD) 
    1348 POT — (POT) 
    1349  
    1350 
    1351 > open
    1352 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/1.2.pdb
    1353 
    1354 Summary of feedback from opening
    1355 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/1.2.pdb 
    1356 --- 
    1357 warnings | Ignored bad PDB record found on line 1 
    1358 REMARK GENERATED BY TRJCONV 
    1359  
    1360 Ignored bad PDB record found on line 3 
    1361 REMARK THIS IS A SIMULATION BOX 
    1362  
    1363 1.2.pdb title: 
    1364 Title t= 1200.00000 step= 600000 [more info...] 
    1365  
    1366 Chain information for 1.2.pdb #7 
    1367 --- 
    1368 Chain | Description 
    1369 A B | No description available 
    1370  
    1371 Non-standard residues in 1.2.pdb #7 
    1372 --- 
    1373 HSD — (HSD) 
    1374 POT — (POT) 
    1375  
    1376 
    1377 > open
    1378 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/1.4.pdb
    1379 
    1380 Summary of feedback from opening
    1381 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/1.4.pdb 
    1382 --- 
    1383 warnings | Ignored bad PDB record found on line 1 
    1384 REMARK GENERATED BY TRJCONV 
    1385  
    1386 Ignored bad PDB record found on line 3 
    1387 REMARK THIS IS A SIMULATION BOX 
    1388  
    1389 1.4.pdb title: 
    1390 Title t= 1400.00000 step= 700000 [more info...] 
    1391  
    1392 Chain information for 1.4.pdb #8 
    1393 --- 
    1394 Chain | Description 
    1395 A B | No description available 
    1396  
    1397 Non-standard residues in 1.4.pdb #8 
    1398 --- 
    1399 HSD — (HSD) 
    1400 POT — (POT) 
    1401  
    1402 
    1403 > open
    1404 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/1.6.pdb
    1405 
    1406 Summary of feedback from opening
    1407 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/1.6.pdb 
    1408 --- 
    1409 warnings | Ignored bad PDB record found on line 1 
    1410 REMARK GENERATED BY TRJCONV 
    1411  
    1412 Ignored bad PDB record found on line 3 
    1413 REMARK THIS IS A SIMULATION BOX 
    1414  
    1415 1.6.pdb title: 
    1416 Title t= 1600.00000 step= 800000 [more info...] 
    1417  
    1418 Chain information for 1.6.pdb #9 
    1419 --- 
    1420 Chain | Description 
    1421 A B | No description available 
    1422  
    1423 Non-standard residues in 1.6.pdb #9 
    1424 --- 
    1425 HSD — (HSD) 
    1426 POT — (POT) 
    1427  
    1428 
    1429 > open
    1430 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/1.8.pdb
    1431 
    1432 Summary of feedback from opening
    1433 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/1.8.pdb 
    1434 --- 
    1435 warnings | Ignored bad PDB record found on line 1 
    1436 REMARK GENERATED BY TRJCONV 
    1437  
    1438 Ignored bad PDB record found on line 3 
    1439 REMARK THIS IS A SIMULATION BOX 
    1440  
    1441 1.8.pdb title: 
    1442 Title t= 1800.00000 step= 900000 [more info...] 
    1443  
    1444 Chain information for 1.8.pdb #10 
    1445 --- 
    1446 Chain | Description 
    1447 A B | No description available 
    1448  
    1449 Non-standard residues in 1.8.pdb #10 
    1450 --- 
    1451 HSD — (HSD) 
    1452 POT — (POT) 
    1453  
    1454 
    1455 > open
    1456 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/2.0.pdb
    1457 
    1458 Summary of feedback from opening
    1459 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/2.0.pdb 
    1460 --- 
    1461 warnings | Ignored bad PDB record found on line 1 
    1462 REMARK GENERATED BY TRJCONV 
    1463  
    1464 Ignored bad PDB record found on line 3 
    1465 REMARK THIS IS A SIMULATION BOX 
    1466  
    1467 2.0.pdb title: 
    1468 Title t= 2000.00000 step= 1000000 [more info...] 
    1469  
    1470 Chain information for 2.0.pdb #11 
    1471 --- 
    1472 Chain | Description 
    1473 A B | No description available 
    1474  
    1475 Non-standard residues in 2.0.pdb #11 
    1476 --- 
    1477 HSD — (HSD) 
    1478 POT — (POT) 
    1479  
    1480 
    1481 > open
    1482 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/2.2.pdb
    1483 
    1484 Summary of feedback from opening
    1485 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/2.2.pdb 
    1486 --- 
    1487 warnings | Ignored bad PDB record found on line 1 
    1488 REMARK GENERATED BY TRJCONV 
    1489  
    1490 Ignored bad PDB record found on line 3 
    1491 REMARK THIS IS A SIMULATION BOX 
    1492  
    1493 2.2.pdb title: 
    1494 Title t= 2200.00000 step= 1100000 [more info...] 
    1495  
    1496 Chain information for 2.2.pdb #12 
    1497 --- 
    1498 Chain | Description 
    1499 A B | No description available 
    1500  
    1501 Non-standard residues in 2.2.pdb #12 
    1502 --- 
    1503 HSD — (HSD) 
    1504 POT — (POT) 
    1505  
    1506 
    1507 > open
    1508 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/2.4.pdb
    1509 
    1510 Summary of feedback from opening
    1511 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/2.4.pdb 
    1512 --- 
    1513 warnings | Ignored bad PDB record found on line 1 
    1514 REMARK GENERATED BY TRJCONV 
    1515  
    1516 Ignored bad PDB record found on line 3 
    1517 REMARK THIS IS A SIMULATION BOX 
    1518  
    1519 2.4.pdb title: 
    1520 Title t= 2400.00000 step= 1200000 [more info...] 
    1521  
    1522 Chain information for 2.4.pdb #13 
    1523 --- 
    1524 Chain | Description 
    1525 A B | No description available 
    1526  
    1527 Non-standard residues in 2.4.pdb #13 
    1528 --- 
    1529 HSD — (HSD) 
    1530 POT — (POT) 
    1531  
    1532 
    1533 > open
    1534 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/2.6.pdb
    1535 
    1536 Summary of feedback from opening
    1537 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/2.6.pdb 
    1538 --- 
    1539 warnings | Ignored bad PDB record found on line 1 
    1540 REMARK GENERATED BY TRJCONV 
    1541  
    1542 Ignored bad PDB record found on line 3 
    1543 REMARK THIS IS A SIMULATION BOX 
    1544  
    1545 2.6.pdb title: 
    1546 Title t= 2600.00000 step= 1300000 [more info...] 
    1547  
    1548 Chain information for 2.6.pdb #14 
    1549 --- 
    1550 Chain | Description 
    1551 A B | No description available 
    1552  
    1553 Non-standard residues in 2.6.pdb #14 
    1554 --- 
    1555 HSD — (HSD) 
    1556 POT — (POT) 
    1557  
    1558 
    1559 > open
    1560 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/2.8.pdb
    1561 
    1562 Summary of feedback from opening
    1563 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/2.8.pdb 
    1564 --- 
    1565 warnings | Ignored bad PDB record found on line 1 
    1566 REMARK GENERATED BY TRJCONV 
    1567  
    1568 Ignored bad PDB record found on line 3 
    1569 REMARK THIS IS A SIMULATION BOX 
    1570  
    1571 2.8.pdb title: 
    1572 Title t= 2800.00000 step= 1400000 [more info...] 
    1573  
    1574 Chain information for 2.8.pdb #15 
    1575 --- 
    1576 Chain | Description 
    1577 A B | No description available 
    1578  
    1579 Non-standard residues in 2.8.pdb #15 
    1580 --- 
    1581 HSD — (HSD) 
    1582 POT — (POT) 
    1583  
    1584 
    1585 > open
    1586 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/3.0.pdb
    1587 
    1588 Summary of feedback from opening
    1589 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/3.0.pdb 
    1590 --- 
    1591 warnings | Ignored bad PDB record found on line 1 
    1592 REMARK GENERATED BY TRJCONV 
    1593  
    1594 Ignored bad PDB record found on line 3 
    1595 REMARK THIS IS A SIMULATION BOX 
    1596  
    1597 3.0.pdb title: 
    1598 Title t= 3000.00000 step= 1500000 [more info...] 
    1599  
    1600 Chain information for 3.0.pdb #16 
    1601 --- 
    1602 Chain | Description 
    1603 A B | No description available 
    1604  
    1605 Non-standard residues in 3.0.pdb #16 
    1606 --- 
    1607 HSD — (HSD) 
    1608 POT — (POT) 
    1609  
    1610 
    1611 > open
    1612 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/3.2.pdb
    1613 
    1614 Summary of feedback from opening
    1615 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/3.2.pdb 
    1616 --- 
    1617 warnings | Ignored bad PDB record found on line 1 
    1618 REMARK GENERATED BY TRJCONV 
    1619  
    1620 Ignored bad PDB record found on line 3 
    1621 REMARK THIS IS A SIMULATION BOX 
    1622  
    1623 3.2.pdb title: 
    1624 Title t= 3200.00000 step= 1600000 [more info...] 
    1625  
    1626 Chain information for 3.2.pdb #17 
    1627 --- 
    1628 Chain | Description 
    1629 A B | No description available 
    1630  
    1631 Non-standard residues in 3.2.pdb #17 
    1632 --- 
    1633 HSD — (HSD) 
    1634 POT — (POT) 
    1635  
    1636 
    1637 > open
    1638 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/3.4.pdb
    1639 
    1640 Summary of feedback from opening
    1641 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/3.4.pdb 
    1642 --- 
    1643 warnings | Ignored bad PDB record found on line 1 
    1644 REMARK GENERATED BY TRJCONV 
    1645  
    1646 Ignored bad PDB record found on line 3 
    1647 REMARK THIS IS A SIMULATION BOX 
    1648  
    1649 3.4.pdb title: 
    1650 Title t= 3400.00000 step= 1700000 [more info...] 
    1651  
    1652 Chain information for 3.4.pdb #18 
    1653 --- 
    1654 Chain | Description 
    1655 A B | No description available 
    1656  
    1657 Non-standard residues in 3.4.pdb #18 
    1658 --- 
    1659 HSD — (HSD) 
    1660 POT — (POT) 
    1661  
    1662 
    1663 > open
    1664 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/3.6.pdb
    1665 
    1666 Summary of feedback from opening
    1667 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/3.6.pdb 
    1668 --- 
    1669 warnings | Ignored bad PDB record found on line 1 
    1670 REMARK GENERATED BY TRJCONV 
    1671  
    1672 Ignored bad PDB record found on line 3 
    1673 REMARK THIS IS A SIMULATION BOX 
    1674  
    1675 3.6.pdb title: 
    1676 Title t= 3600.00000 step= 1800000 [more info...] 
    1677  
    1678 Chain information for 3.6.pdb #19 
    1679 --- 
    1680 Chain | Description 
    1681 A B | No description available 
    1682  
    1683 Non-standard residues in 3.6.pdb #19 
    1684 --- 
    1685 HSD — (HSD) 
    1686 POT — (POT) 
    1687  
    1688 
    1689 > open
    1690 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/3.8.pdb
    1691 
    1692 Summary of feedback from opening
    1693 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/3.8.pdb 
    1694 --- 
    1695 warnings | Ignored bad PDB record found on line 1 
    1696 REMARK GENERATED BY TRJCONV 
    1697  
    1698 Ignored bad PDB record found on line 3 
    1699 REMARK THIS IS A SIMULATION BOX 
    1700  
    1701 3.8.pdb title: 
    1702 Title t= 3800.00000 step= 1900000 [more info...] 
    1703  
    1704 Chain information for 3.8.pdb #20 
    1705 --- 
    1706 Chain | Description 
    1707 A B | No description available 
    1708  
    1709 Non-standard residues in 3.8.pdb #20 
    1710 --- 
    1711 HSD — (HSD) 
    1712 POT — (POT) 
    1713  
    1714 
    1715 > open
    1716 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/4.0.pdb
    1717 
    1718 Summary of feedback from opening
    1719 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/4.0.pdb 
    1720 --- 
    1721 warnings | Ignored bad PDB record found on line 1 
    1722 REMARK GENERATED BY TRJCONV 
    1723  
    1724 Ignored bad PDB record found on line 3 
    1725 REMARK THIS IS A SIMULATION BOX 
    1726  
    1727 4.0.pdb title: 
    1728 Title t= 4000.00000 step= 2000000 [more info...] 
    1729  
    1730 Chain information for 4.0.pdb #21 
    1731 --- 
    1732 Chain | Description 
    1733 A B | No description available 
    1734  
    1735 Non-standard residues in 4.0.pdb #21 
    1736 --- 
    1737 HSD — (HSD) 
    1738 POT — (POT) 
    1739  
    1740 
    1741 > open
    1742 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/4.2.pdb
    1743 
    1744 Summary of feedback from opening
    1745 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/4.2.pdb 
    1746 --- 
    1747 warnings | Ignored bad PDB record found on line 1 
    1748 REMARK GENERATED BY TRJCONV 
    1749  
    1750 Ignored bad PDB record found on line 3 
    1751 REMARK THIS IS A SIMULATION BOX 
    1752  
    1753 4.2.pdb title: 
    1754 Title t= 4200.00000 step= 2100000 [more info...] 
    1755  
    1756 Chain information for 4.2.pdb #22 
    1757 --- 
    1758 Chain | Description 
    1759 A B | No description available 
    1760  
    1761 Non-standard residues in 4.2.pdb #22 
    1762 --- 
    1763 HSD — (HSD) 
    1764 POT — (POT) 
    1765  
    1766 
    1767 > open
    1768 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/4.4.pdb
    1769 
    1770 Summary of feedback from opening
    1771 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/4.4.pdb 
    1772 --- 
    1773 warnings | Ignored bad PDB record found on line 1 
    1774 REMARK GENERATED BY TRJCONV 
    1775  
    1776 Ignored bad PDB record found on line 3 
    1777 REMARK THIS IS A SIMULATION BOX 
    1778  
    1779 4.4.pdb title: 
    1780 Title t= 4400.00000 step= 2200000 [more info...] 
    1781  
    1782 Chain information for 4.4.pdb #23 
    1783 --- 
    1784 Chain | Description 
    1785 A B | No description available 
    1786  
    1787 Non-standard residues in 4.4.pdb #23 
    1788 --- 
    1789 HSD — (HSD) 
    1790 POT — (POT) 
    1791  
    1792 
    1793 > open
    1794 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/4.6.pdb
    1795 
    1796 Summary of feedback from opening
    1797 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/4.6.pdb 
    1798 --- 
    1799 warnings | Ignored bad PDB record found on line 1 
    1800 REMARK GENERATED BY TRJCONV 
    1801  
    1802 Ignored bad PDB record found on line 3 
    1803 REMARK THIS IS A SIMULATION BOX 
    1804  
    1805 4.6.pdb title: 
    1806 Title t= 4600.00000 step= 2300000 [more info...] 
    1807  
    1808 Chain information for 4.6.pdb #24 
    1809 --- 
    1810 Chain | Description 
    1811 A B | No description available 
    1812  
    1813 Non-standard residues in 4.6.pdb #24 
    1814 --- 
    1815 HSD — (HSD) 
    1816 POT — (POT) 
    1817  
    1818 
    1819 > open
    1820 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/4.8.pdb
    1821 
    1822 Summary of feedback from opening
    1823 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/4.8.pdb 
    1824 --- 
    1825 warnings | Ignored bad PDB record found on line 1 
    1826 REMARK GENERATED BY TRJCONV 
    1827  
    1828 Ignored bad PDB record found on line 3 
    1829 REMARK THIS IS A SIMULATION BOX 
    1830  
    1831 4.8.pdb title: 
    1832 Title t= 4800.00000 step= 2400000 [more info...] 
    1833  
    1834 Chain information for 4.8.pdb #25 
    1835 --- 
    1836 Chain | Description 
    1837 A B | No description available 
    1838  
    1839 Non-standard residues in 4.8.pdb #25 
    1840 --- 
    1841 HSD — (HSD) 
    1842 POT — (POT) 
    1843  
    1844 
    1845 > open
    1846 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/5.0.pdb
    1847 
    1848 Summary of feedback from opening
    1849 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/5.0.pdb 
    1850 --- 
    1851 warnings | Ignored bad PDB record found on line 1 
    1852 REMARK GENERATED BY TRJCONV 
    1853  
    1854 Ignored bad PDB record found on line 3 
    1855 REMARK THIS IS A SIMULATION BOX 
    1856  
    1857 5.0.pdb title: 
    1858 Title t= 5000.00000 step= 2500000 [more info...] 
    1859  
    1860 Chain information for 5.0.pdb #26 
    1861 --- 
    1862 Chain | Description 
    1863 A B | No description available 
    1864  
    1865 Non-standard residues in 5.0.pdb #26 
    1866 --- 
    1867 HSD — (HSD) 
    1868 POT — (POT) 
    1869  
    1870 
    1871 > open
    1872 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/5.2.pdb
    1873 
    1874 Summary of feedback from opening
    1875 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/5.2.pdb 
    1876 --- 
    1877 warnings | Ignored bad PDB record found on line 1 
    1878 REMARK GENERATED BY TRJCONV 
    1879  
    1880 Ignored bad PDB record found on line 3 
    1881 REMARK THIS IS A SIMULATION BOX 
    1882  
    1883 5.2.pdb title: 
    1884 Title t= 5200.00000 step= 2600000 [more info...] 
    1885  
    1886 Chain information for 5.2.pdb #27 
    1887 --- 
    1888 Chain | Description 
    1889 A B | No description available 
    1890  
    1891 Non-standard residues in 5.2.pdb #27 
    1892 --- 
    1893 HSD — (HSD) 
    1894 POT — (POT) 
    1895  
    1896 
    1897 > open
    1898 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/5.4.pdb
    1899 
    1900 Summary of feedback from opening
    1901 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/5.4.pdb 
    1902 --- 
    1903 warnings | Ignored bad PDB record found on line 1 
    1904 REMARK GENERATED BY TRJCONV 
    1905  
    1906 Ignored bad PDB record found on line 3 
    1907 REMARK THIS IS A SIMULATION BOX 
    1908  
    1909 5.4.pdb title: 
    1910 Title t= 5400.00000 step= 2700000 [more info...] 
    1911  
    1912 Chain information for 5.4.pdb #28 
    1913 --- 
    1914 Chain | Description 
    1915 A B | No description available 
    1916  
    1917 Non-standard residues in 5.4.pdb #28 
    1918 --- 
    1919 HSD — (HSD) 
    1920 POT — (POT) 
    1921  
    1922 
    1923 > open
    1924 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/5.6.pdb
    1925 
    1926 Summary of feedback from opening
    1927 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/5.6.pdb 
    1928 --- 
    1929 warnings | Ignored bad PDB record found on line 1 
    1930 REMARK GENERATED BY TRJCONV 
    1931  
    1932 Ignored bad PDB record found on line 3 
    1933 REMARK THIS IS A SIMULATION BOX 
    1934  
    1935 5.6.pdb title: 
    1936 Title t= 5600.00000 step= 2800000 [more info...] 
    1937  
    1938 Chain information for 5.6.pdb #29 
    1939 --- 
    1940 Chain | Description 
    1941 A B | No description available 
    1942  
    1943 Non-standard residues in 5.6.pdb #29 
    1944 --- 
    1945 HSD — (HSD) 
    1946 POT — (POT) 
    1947  
    1948 
    1949 > open
    1950 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/5.8.pdb
    1951 
    1952 Summary of feedback from opening
    1953 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/5.8.pdb 
    1954 --- 
    1955 warnings | Ignored bad PDB record found on line 1 
    1956 REMARK GENERATED BY TRJCONV 
    1957  
    1958 Ignored bad PDB record found on line 3 
    1959 REMARK THIS IS A SIMULATION BOX 
    1960  
    1961 5.8.pdb title: 
    1962 Title t= 5800.00000 step= 2900000 [more info...] 
    1963  
    1964 Chain information for 5.8.pdb #30 
    1965 --- 
    1966 Chain | Description 
    1967 A B | No description available 
    1968  
    1969 Non-standard residues in 5.8.pdb #30 
    1970 --- 
    1971 HSD — (HSD) 
    1972 POT — (POT) 
    1973  
    1974 
    1975 > open
    1976 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/6.0.pdb
    1977 
    1978 Summary of feedback from opening
    1979 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/6.0.pdb 
    1980 --- 
    1981 warnings | Ignored bad PDB record found on line 1 
    1982 REMARK GENERATED BY TRJCONV 
    1983  
    1984 Ignored bad PDB record found on line 3 
    1985 REMARK THIS IS A SIMULATION BOX 
    1986  
    1987 6.0.pdb title: 
    1988 Title t= 6000.00000 step= 3000000 [more info...] 
    1989  
    1990 Chain information for 6.0.pdb #31 
    1991 --- 
    1992 Chain | Description 
    1993 A B | No description available 
    1994  
    1995 Non-standard residues in 6.0.pdb #31 
    1996 --- 
    1997 HSD — (HSD) 
    1998 POT — (POT) 
    1999  
    2000 
    2001 > open
    2002 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/6.2.pdb
    2003 
    2004 Summary of feedback from opening
    2005 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/6.2.pdb 
    2006 --- 
    2007 warnings | Ignored bad PDB record found on line 1 
    2008 REMARK GENERATED BY TRJCONV 
    2009  
    2010 Ignored bad PDB record found on line 3 
    2011 REMARK THIS IS A SIMULATION BOX 
    2012  
    2013 6.2.pdb title: 
    2014 Title t= 6200.00000 step= 3100000 [more info...] 
    2015  
    2016 Chain information for 6.2.pdb #32 
    2017 --- 
    2018 Chain | Description 
    2019 A B | No description available 
    2020  
    2021 Non-standard residues in 6.2.pdb #32 
    2022 --- 
    2023 HSD — (HSD) 
    2024 POT — (POT) 
    2025  
    2026 
    2027 > open
    2028 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/6.4.pdb
    2029 
    2030 Summary of feedback from opening
    2031 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/6.4.pdb 
    2032 --- 
    2033 warnings | Ignored bad PDB record found on line 1 
    2034 REMARK GENERATED BY TRJCONV 
    2035  
    2036 Ignored bad PDB record found on line 3 
    2037 REMARK THIS IS A SIMULATION BOX 
    2038  
    2039 6.4.pdb title: 
    2040 Title t= 6400.00000 step= 3200000 [more info...] 
    2041  
    2042 Chain information for 6.4.pdb #33 
    2043 --- 
    2044 Chain | Description 
    2045 A B | No description available 
    2046  
    2047 Non-standard residues in 6.4.pdb #33 
    2048 --- 
    2049 HSD — (HSD) 
    2050 POT — (POT) 
    2051  
    2052 
    2053 > open
    2054 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/6.6.pdb
    2055 
    2056 Summary of feedback from opening
    2057 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/6.6.pdb 
    2058 --- 
    2059 warnings | Ignored bad PDB record found on line 1 
    2060 REMARK GENERATED BY TRJCONV 
    2061  
    2062 Ignored bad PDB record found on line 3 
    2063 REMARK THIS IS A SIMULATION BOX 
    2064  
    2065 6.6.pdb title: 
    2066 Title t= 6600.00000 step= 3300000 [more info...] 
    2067  
    2068 Chain information for 6.6.pdb #34 
    2069 --- 
    2070 Chain | Description 
    2071 A B | No description available 
    2072  
    2073 Non-standard residues in 6.6.pdb #34 
    2074 --- 
    2075 HSD — (HSD) 
    2076 POT — (POT) 
    2077  
    2078 
    2079 > open
    2080 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/6.8.pdb
    2081 
    2082 Summary of feedback from opening
    2083 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/6.8.pdb 
    2084 --- 
    2085 warnings | Ignored bad PDB record found on line 1 
    2086 REMARK GENERATED BY TRJCONV 
    2087  
    2088 Ignored bad PDB record found on line 3 
    2089 REMARK THIS IS A SIMULATION BOX 
    2090  
    2091 6.8.pdb title: 
    2092 Title t= 6800.00000 step= 3400000 [more info...] 
    2093  
    2094 Chain information for 6.8.pdb #35 
    2095 --- 
    2096 Chain | Description 
    2097 A B | No description available 
    2098  
    2099 Non-standard residues in 6.8.pdb #35 
    2100 --- 
    2101 HSD — (HSD) 
    2102 POT — (POT) 
    2103  
    2104 
    2105 > open
    2106 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/7.0.pdb
    2107 
    2108 Summary of feedback from opening
    2109 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/7.0.pdb 
    2110 --- 
    2111 warnings | Ignored bad PDB record found on line 1 
    2112 REMARK GENERATED BY TRJCONV 
    2113  
    2114 Ignored bad PDB record found on line 3 
    2115 REMARK THIS IS A SIMULATION BOX 
    2116  
    2117 7.0.pdb title: 
    2118 Title t= 7000.00000 step= 3500000 [more info...] 
    2119  
    2120 Chain information for 7.0.pdb #36 
    2121 --- 
    2122 Chain | Description 
    2123 A B | No description available 
    2124  
    2125 Non-standard residues in 7.0.pdb #36 
    2126 --- 
    2127 HSD — (HSD) 
    2128 POT — (POT) 
    2129  
    2130 
    2131 > open
    2132 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/7.2.pdb
    2133 
    2134 Summary of feedback from opening
    2135 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/7.2.pdb 
    2136 --- 
    2137 warnings | Ignored bad PDB record found on line 1 
    2138 REMARK GENERATED BY TRJCONV 
    2139  
    2140 Ignored bad PDB record found on line 3 
    2141 REMARK THIS IS A SIMULATION BOX 
    2142  
    2143 7.2.pdb title: 
    2144 Title t= 7200.00000 step= 3600000 [more info...] 
    2145  
    2146 Chain information for 7.2.pdb #37 
    2147 --- 
    2148 Chain | Description 
    2149 A B | No description available 
    2150  
    2151 Non-standard residues in 7.2.pdb #37 
    2152 --- 
    2153 HSD — (HSD) 
    2154 POT — (POT) 
    2155  
    2156 
    2157 > open
    2158 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/7.4.pdb
    2159 
    2160 Summary of feedback from opening
    2161 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/7.4.pdb 
    2162 --- 
    2163 warnings | Ignored bad PDB record found on line 1 
    2164 REMARK GENERATED BY TRJCONV 
    2165  
    2166 Ignored bad PDB record found on line 3 
    2167 REMARK THIS IS A SIMULATION BOX 
    2168  
    2169 7.4.pdb title: 
    2170 Title t= 7400.00000 step= 3700000 [more info...] 
    2171  
    2172 Chain information for 7.4.pdb #38 
    2173 --- 
    2174 Chain | Description 
    2175 A B | No description available 
    2176  
    2177 Non-standard residues in 7.4.pdb #38 
    2178 --- 
    2179 HSD — (HSD) 
    2180 POT — (POT) 
    2181  
    2182 
    2183 > open
    2184 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/7.6.pdb
    2185 
    2186 Summary of feedback from opening
    2187 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/7.6.pdb 
    2188 --- 
    2189 warnings | Ignored bad PDB record found on line 1 
    2190 REMARK GENERATED BY TRJCONV 
    2191  
    2192 Ignored bad PDB record found on line 3 
    2193 REMARK THIS IS A SIMULATION BOX 
    2194  
    2195 7.6.pdb title: 
    2196 Title t= 7600.00000 step= 3800000 [more info...] 
    2197  
    2198 Chain information for 7.6.pdb #39 
    2199 --- 
    2200 Chain | Description 
    2201 A B | No description available 
    2202  
    2203 Non-standard residues in 7.6.pdb #39 
    2204 --- 
    2205 HSD — (HSD) 
    2206 POT — (POT) 
    2207  
    2208 
    2209 > open
    2210 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/7.8.pdb
    2211 
    2212 Summary of feedback from opening
    2213 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/7.8.pdb 
    2214 --- 
    2215 warnings | Ignored bad PDB record found on line 1 
    2216 REMARK GENERATED BY TRJCONV 
    2217  
    2218 Ignored bad PDB record found on line 3 
    2219 REMARK THIS IS A SIMULATION BOX 
    2220  
    2221 7.8.pdb title: 
    2222 Title t= 7800.00000 step= 3900000 [more info...] 
    2223  
    2224 Chain information for 7.8.pdb #40 
    2225 --- 
    2226 Chain | Description 
    2227 A B | No description available 
    2228  
    2229 Non-standard residues in 7.8.pdb #40 
    2230 --- 
    2231 HSD — (HSD) 
    2232 POT — (POT) 
    2233  
    2234 
    2235 > open
    2236 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/8.0.pdb
    2237 
    2238 Summary of feedback from opening
    2239 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/8.0.pdb 
    2240 --- 
    2241 warnings | Ignored bad PDB record found on line 1 
    2242 REMARK GENERATED BY TRJCONV 
    2243  
    2244 Ignored bad PDB record found on line 3 
    2245 REMARK THIS IS A SIMULATION BOX 
    2246  
    2247 8.0.pdb title: 
    2248 Title t= 8000.00000 step= 4000000 [more info...] 
    2249  
    2250 Chain information for 8.0.pdb #41 
    2251 --- 
    2252 Chain | Description 
    2253 A B | No description available 
    2254  
    2255 Non-standard residues in 8.0.pdb #41 
    2256 --- 
    2257 HSD — (HSD) 
    2258 POT — (POT) 
    2259  
    2260 
    2261 > open
    2262 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/8.2.pdb
    2263 
    2264 Summary of feedback from opening
    2265 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/8.2.pdb 
    2266 --- 
    2267 warnings | Ignored bad PDB record found on line 1 
    2268 REMARK GENERATED BY TRJCONV 
    2269  
    2270 Ignored bad PDB record found on line 3 
    2271 REMARK THIS IS A SIMULATION BOX 
    2272  
    2273 8.2.pdb title: 
    2274 Title t= 8200.00000 step= 4100000 [more info...] 
    2275  
    2276 Chain information for 8.2.pdb #42 
    2277 --- 
    2278 Chain | Description 
    2279 A B | No description available 
    2280  
    2281 Non-standard residues in 8.2.pdb #42 
    2282 --- 
    2283 HSD — (HSD) 
    2284 POT — (POT) 
    2285  
    2286 
    2287 > open
    2288 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/8.4.pdb
    2289 
    2290 Summary of feedback from opening
    2291 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/8.4.pdb 
    2292 --- 
    2293 warnings | Ignored bad PDB record found on line 1 
    2294 REMARK GENERATED BY TRJCONV 
    2295  
    2296 Ignored bad PDB record found on line 3 
    2297 REMARK THIS IS A SIMULATION BOX 
    2298  
    2299 8.4.pdb title: 
    2300 Title t= 8400.00000 step= 4200000 [more info...] 
    2301  
    2302 Chain information for 8.4.pdb #43 
    2303 --- 
    2304 Chain | Description 
    2305 A B | No description available 
    2306  
    2307 Non-standard residues in 8.4.pdb #43 
    2308 --- 
    2309 HSD — (HSD) 
    2310 POT — (POT) 
    2311  
    2312 
    2313 > open
    2314 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/8.6.pdb
    2315 
    2316 Summary of feedback from opening
    2317 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/8.6.pdb 
    2318 --- 
    2319 warnings | Ignored bad PDB record found on line 1 
    2320 REMARK GENERATED BY TRJCONV 
    2321  
    2322 Ignored bad PDB record found on line 3 
    2323 REMARK THIS IS A SIMULATION BOX 
    2324  
    2325 8.6.pdb title: 
    2326 Title t= 8600.00000 step= 4300000 [more info...] 
    2327  
    2328 Chain information for 8.6.pdb #44 
    2329 --- 
    2330 Chain | Description 
    2331 A B | No description available 
    2332  
    2333 Non-standard residues in 8.6.pdb #44 
    2334 --- 
    2335 HSD — (HSD) 
    2336 POT — (POT) 
    2337  
    2338 
    2339 > open
    2340 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/8.8.pdb
    2341 
    2342 Summary of feedback from opening
    2343 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/8.8.pdb 
    2344 --- 
    2345 warnings | Ignored bad PDB record found on line 1 
    2346 REMARK GENERATED BY TRJCONV 
    2347  
    2348 Ignored bad PDB record found on line 3 
    2349 REMARK THIS IS A SIMULATION BOX 
    2350  
    2351 8.8.pdb title: 
    2352 Title t= 8800.00000 step= 4400000 [more info...] 
    2353  
    2354 Chain information for 8.8.pdb #45 
    2355 --- 
    2356 Chain | Description 
    2357 A B | No description available 
    2358  
    2359 Non-standard residues in 8.8.pdb #45 
    2360 --- 
    2361 HSD — (HSD) 
    2362 POT — (POT) 
    2363  
    2364 
    2365 > open
    2366 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/9.0.pdb
    2367 
    2368 Summary of feedback from opening
    2369 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/9.0.pdb 
    2370 --- 
    2371 warnings | Ignored bad PDB record found on line 1 
    2372 REMARK GENERATED BY TRJCONV 
    2373  
    2374 Ignored bad PDB record found on line 3 
    2375 REMARK THIS IS A SIMULATION BOX 
    2376  
    2377 9.0.pdb title: 
    2378 Title t= 9000.00000 step= 4500000 [more info...] 
    2379  
    2380 Chain information for 9.0.pdb #46 
    2381 --- 
    2382 Chain | Description 
    2383 A B | No description available 
    2384  
    2385 Non-standard residues in 9.0.pdb #46 
    2386 --- 
    2387 HSD — (HSD) 
    2388 POT — (POT) 
    2389  
    2390 
    2391 > open
    2392 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/9.2.pdb
    2393 
    2394 Summary of feedback from opening
    2395 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/9.2.pdb 
    2396 --- 
    2397 warnings | Ignored bad PDB record found on line 1 
    2398 REMARK GENERATED BY TRJCONV 
    2399  
    2400 Ignored bad PDB record found on line 3 
    2401 REMARK THIS IS A SIMULATION BOX 
    2402  
    2403 9.2.pdb title: 
    2404 Title t= 9200.00000 step= 4600000 [more info...] 
    2405  
    2406 Chain information for 9.2.pdb #47 
    2407 --- 
    2408 Chain | Description 
    2409 A B | No description available 
    2410  
    2411 Non-standard residues in 9.2.pdb #47 
    2412 --- 
    2413 HSD — (HSD) 
    2414 POT — (POT) 
    2415  
    2416 
    2417 > open
    2418 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/9.4.pdb
    2419 
    2420 Summary of feedback from opening
    2421 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/9.4.pdb 
    2422 --- 
    2423 warnings | Ignored bad PDB record found on line 1 
    2424 REMARK GENERATED BY TRJCONV 
    2425  
    2426 Ignored bad PDB record found on line 3 
    2427 REMARK THIS IS A SIMULATION BOX 
    2428  
    2429 9.4.pdb title: 
    2430 Title t= 9400.00000 step= 4700000 [more info...] 
    2431  
    2432 Chain information for 9.4.pdb #48 
    2433 --- 
    2434 Chain | Description 
    2435 A B | No description available 
    2436  
    2437 Non-standard residues in 9.4.pdb #48 
    2438 --- 
    2439 HSD — (HSD) 
    2440 POT — (POT) 
    2441  
    2442 
    2443 > open
    2444 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/9.6.pdb
    2445 
    2446 Summary of feedback from opening
    2447 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/9.6.pdb 
    2448 --- 
    2449 warnings | Ignored bad PDB record found on line 1 
    2450 REMARK GENERATED BY TRJCONV 
    2451  
    2452 Ignored bad PDB record found on line 3 
    2453 REMARK THIS IS A SIMULATION BOX 
    2454  
    2455 9.6.pdb title: 
    2456 Title t= 9600.00000 step= 4800000 [more info...] 
    2457  
    2458 Chain information for 9.6.pdb #49 
    2459 --- 
    2460 Chain | Description 
    2461 A B | No description available 
    2462  
    2463 Non-standard residues in 9.6.pdb #49 
    2464 --- 
    2465 HSD — (HSD) 
    2466 POT — (POT) 
    2467  
    2468 
    2469 > open
    2470 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/9.8.pdb
    2471 
    2472 Summary of feedback from opening
    2473 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/9.8.pdb 
    2474 --- 
    2475 warnings | Ignored bad PDB record found on line 1 
    2476 REMARK GENERATED BY TRJCONV 
    2477  
    2478 Ignored bad PDB record found on line 3 
    2479 REMARK THIS IS A SIMULATION BOX 
    2480  
    2481 9.8.pdb title: 
    2482 Title t= 9800.00000 step= 4900000 [more info...] 
    2483  
    2484 Chain information for 9.8.pdb #50 
    2485 --- 
    2486 Chain | Description 
    2487 A B | No description available 
    2488  
    2489 Non-standard residues in 9.8.pdb #50 
    2490 --- 
    2491 HSD — (HSD) 
    2492 POT — (POT) 
    2493  
    2494 
    2495 > open
    2496 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/10.0.pdb
    2497 
    2498 Summary of feedback from opening
    2499 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/10.0.pdb 
    2500 --- 
    2501 warnings | Ignored bad PDB record found on line 1 
    2502 REMARK GENERATED BY TRJCONV 
    2503  
    2504 Ignored bad PDB record found on line 3 
    2505 REMARK THIS IS A SIMULATION BOX 
    2506  
    2507 10.0.pdb title: 
    2508 Title t= 10000.00000 step= 5000000 [more info...] 
    2509  
    2510 Chain information for 10.0.pdb #51 
    2511 --- 
    2512 Chain | Description 
    2513 A B | No description available 
    2514  
    2515 Non-standard residues in 10.0.pdb #51 
    2516 --- 
    2517 HSD — (HSD) 
    2518 POT — (POT) 
    2519  
    2520 
    2521 > open
    2522 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/10.2.pdb
    2523 
    2524 Summary of feedback from opening
    2525 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/10.2.pdb 
    2526 --- 
    2527 warnings | Ignored bad PDB record found on line 1 
    2528 REMARK GENERATED BY TRJCONV 
    2529  
    2530 Ignored bad PDB record found on line 3 
    2531 REMARK THIS IS A SIMULATION BOX 
    2532  
    2533 10.2.pdb title: 
    2534 Title t= 10200.00000 step= 5100000 [more info...] 
    2535  
    2536 Chain information for 10.2.pdb #52 
    2537 --- 
    2538 Chain | Description 
    2539 A B | No description available 
    2540  
    2541 Non-standard residues in 10.2.pdb #52 
    2542 --- 
    2543 HSD — (HSD) 
    2544 POT — (POT) 
    2545  
    2546 
    2547 > open
    2548 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/10.4.pdb
    2549 
    2550 Summary of feedback from opening
    2551 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/10.4.pdb 
    2552 --- 
    2553 warnings | Ignored bad PDB record found on line 1 
    2554 REMARK GENERATED BY TRJCONV 
    2555  
    2556 Ignored bad PDB record found on line 3 
    2557 REMARK THIS IS A SIMULATION BOX 
    2558  
    2559 10.4.pdb title: 
    2560 Title t= 10400.00000 step= 5200000 [more info...] 
    2561  
    2562 Chain information for 10.4.pdb #53 
    2563 --- 
    2564 Chain | Description 
    2565 A B | No description available 
    2566  
    2567 Non-standard residues in 10.4.pdb #53 
    2568 --- 
    2569 HSD — (HSD) 
    2570 POT — (POT) 
    2571  
    2572 
    2573 > open
    2574 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/10.6.pdb
    2575 
    2576 Summary of feedback from opening
    2577 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/10.6.pdb 
    2578 --- 
    2579 warnings | Ignored bad PDB record found on line 1 
    2580 REMARK GENERATED BY TRJCONV 
    2581  
    2582 Ignored bad PDB record found on line 3 
    2583 REMARK THIS IS A SIMULATION BOX 
    2584  
    2585 10.6.pdb title: 
    2586 Title t= 10600.00000 step= 5300000 [more info...] 
    2587  
    2588 Chain information for 10.6.pdb #54 
    2589 --- 
    2590 Chain | Description 
    2591 A B | No description available 
    2592  
    2593 Non-standard residues in 10.6.pdb #54 
    2594 --- 
    2595 HSD — (HSD) 
    2596 POT — (POT) 
    2597  
    2598 
    2599 > open
    2600 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/10.8.pdb
    2601 
    2602 Summary of feedback from opening
    2603 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/10.8.pdb 
    2604 --- 
    2605 warnings | Ignored bad PDB record found on line 1 
    2606 REMARK GENERATED BY TRJCONV 
    2607  
    2608 Ignored bad PDB record found on line 3 
    2609 REMARK THIS IS A SIMULATION BOX 
    2610  
    2611 10.8.pdb title: 
    2612 Title t= 10800.00000 step= 5400000 [more info...] 
    2613  
    2614 Chain information for 10.8.pdb #55 
    2615 --- 
    2616 Chain | Description 
    2617 A B | No description available 
    2618  
    2619 Non-standard residues in 10.8.pdb #55 
    2620 --- 
    2621 HSD — (HSD) 
    2622 POT — (POT) 
    2623  
    2624 
    2625 > open
    2626 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/11.0.pdb
    2627 
    2628 Summary of feedback from opening
    2629 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/11.0.pdb 
    2630 --- 
    2631 warnings | Ignored bad PDB record found on line 1 
    2632 REMARK GENERATED BY TRJCONV 
    2633  
    2634 Ignored bad PDB record found on line 3 
    2635 REMARK THIS IS A SIMULATION BOX 
    2636  
    2637 11.0.pdb title: 
    2638 Title t= 11000.00000 step= 5500000 [more info...] 
    2639  
    2640 Chain information for 11.0.pdb #56 
    2641 --- 
    2642 Chain | Description 
    2643 A B | No description available 
    2644  
    2645 Non-standard residues in 11.0.pdb #56 
    2646 --- 
    2647 HSD — (HSD) 
    2648 POT — (POT) 
    2649  
    2650 
    2651 > open
    2652 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/11.2.pdb
    2653 
    2654 Summary of feedback from opening
    2655 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/11.2.pdb 
    2656 --- 
    2657 warnings | Ignored bad PDB record found on line 1 
    2658 REMARK GENERATED BY TRJCONV 
    2659  
    2660 Ignored bad PDB record found on line 3 
    2661 REMARK THIS IS A SIMULATION BOX 
    2662  
    2663 11.2.pdb title: 
    2664 Title t= 11200.00000 step= 5600000 [more info...] 
    2665  
    2666 Chain information for 11.2.pdb #57 
    2667 --- 
    2668 Chain | Description 
    2669 A B | No description available 
    2670  
    2671 Non-standard residues in 11.2.pdb #57 
    2672 --- 
    2673 HSD — (HSD) 
    2674 POT — (POT) 
    2675  
    2676 
    2677 > open
    2678 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/11.4.pdb
    2679 
    2680 Summary of feedback from opening
    2681 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/11.4.pdb 
    2682 --- 
    2683 warnings | Ignored bad PDB record found on line 1 
    2684 REMARK GENERATED BY TRJCONV 
    2685  
    2686 Ignored bad PDB record found on line 3 
    2687 REMARK THIS IS A SIMULATION BOX 
    2688  
    2689 11.4.pdb title: 
    2690 Title t= 11400.00000 step= 5700000 [more info...] 
    2691  
    2692 Chain information for 11.4.pdb #58 
    2693 --- 
    2694 Chain | Description 
    2695 A B | No description available 
    2696  
    2697 Non-standard residues in 11.4.pdb #58 
    2698 --- 
    2699 HSD — (HSD) 
    2700 POT — (POT) 
    2701  
    2702 
    2703 > open
    2704 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/11.6.pdb
    2705 
    2706 Summary of feedback from opening
    2707 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/11.6.pdb 
    2708 --- 
    2709 warnings | Ignored bad PDB record found on line 1 
    2710 REMARK GENERATED BY TRJCONV 
    2711  
    2712 Ignored bad PDB record found on line 3 
    2713 REMARK THIS IS A SIMULATION BOX 
    2714  
    2715 11.6.pdb title: 
    2716 Title t= 11600.00000 step= 5800000 [more info...] 
    2717  
    2718 Chain information for 11.6.pdb #59 
    2719 --- 
    2720 Chain | Description 
    2721 A B | No description available 
    2722  
    2723 Non-standard residues in 11.6.pdb #59 
    2724 --- 
    2725 HSD — (HSD) 
    2726 POT — (POT) 
    2727  
    2728 
    2729 > open
    2730 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/11.8.pdb
    2731 
    2732 Summary of feedback from opening
    2733 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/11.8.pdb 
    2734 --- 
    2735 warnings | Ignored bad PDB record found on line 1 
    2736 REMARK GENERATED BY TRJCONV 
    2737  
    2738 Ignored bad PDB record found on line 3 
    2739 REMARK THIS IS A SIMULATION BOX 
    2740  
    2741 11.8.pdb title: 
    2742 Title t= 11800.00000 step= 5900000 [more info...] 
    2743  
    2744 Chain information for 11.8.pdb #60 
    2745 --- 
    2746 Chain | Description 
    2747 A B | No description available 
    2748  
    2749 Non-standard residues in 11.8.pdb #60 
    2750 --- 
    2751 HSD — (HSD) 
    2752 POT — (POT) 
    2753  
    2754 
    2755 > open
    2756 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/12.0.pdb
    2757 
    2758 Summary of feedback from opening
    2759 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/12.0.pdb 
    2760 --- 
    2761 warnings | Ignored bad PDB record found on line 1 
    2762 REMARK GENERATED BY TRJCONV 
    2763  
    2764 Ignored bad PDB record found on line 3 
    2765 REMARK THIS IS A SIMULATION BOX 
    2766  
    2767 12.0.pdb title: 
    2768 Title t= 12000.00000 step= 6000000 [more info...] 
    2769  
    2770 Chain information for 12.0.pdb #61 
    2771 --- 
    2772 Chain | Description 
    2773 A B | No description available 
    2774  
    2775 Non-standard residues in 12.0.pdb #61 
    2776 --- 
    2777 HSD — (HSD) 
    2778 POT — (POT) 
    2779  
    2780 
    2781 > open
    2782 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/12.2.pdb
    2783 
    2784 Summary of feedback from opening
    2785 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/12.2.pdb 
    2786 --- 
    2787 warnings | Ignored bad PDB record found on line 1 
    2788 REMARK GENERATED BY TRJCONV 
    2789  
    2790 Ignored bad PDB record found on line 3 
    2791 REMARK THIS IS A SIMULATION BOX 
    2792  
    2793 12.2.pdb title: 
    2794 Title t= 12200.00000 step= 6100000 [more info...] 
    2795  
    2796 Chain information for 12.2.pdb #62 
    2797 --- 
    2798 Chain | Description 
    2799 A B | No description available 
    2800  
    2801 Non-standard residues in 12.2.pdb #62 
    2802 --- 
    2803 HSD — (HSD) 
    2804 POT — (POT) 
    2805  
    2806 
    2807 > open
    2808 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/12.4.pdb
    2809 
    2810 Summary of feedback from opening
    2811 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/12.4.pdb 
    2812 --- 
    2813 warnings | Ignored bad PDB record found on line 1 
    2814 REMARK GENERATED BY TRJCONV 
    2815  
    2816 Ignored bad PDB record found on line 3 
    2817 REMARK THIS IS A SIMULATION BOX 
    2818  
    2819 12.4.pdb title: 
    2820 Title t= 12400.00000 step= 6200000 [more info...] 
    2821  
    2822 Chain information for 12.4.pdb #63 
    2823 --- 
    2824 Chain | Description 
    2825 A B | No description available 
    2826  
    2827 Non-standard residues in 12.4.pdb #63 
    2828 --- 
    2829 HSD — (HSD) 
    2830 POT — (POT) 
    2831  
    2832 
    2833 > open
    2834 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/12.6.pdb
    2835 
    2836 Summary of feedback from opening
    2837 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/12.6.pdb 
    2838 --- 
    2839 warnings | Ignored bad PDB record found on line 1 
    2840 REMARK GENERATED BY TRJCONV 
    2841  
    2842 Ignored bad PDB record found on line 3 
    2843 REMARK THIS IS A SIMULATION BOX 
    2844  
    2845 12.6.pdb title: 
    2846 Title t= 12600.00000 step= 6300000 [more info...] 
    2847  
    2848 Chain information for 12.6.pdb #64 
    2849 --- 
    2850 Chain | Description 
    2851 A B | No description available 
    2852  
    2853 Non-standard residues in 12.6.pdb #64 
    2854 --- 
    2855 HSD — (HSD) 
    2856 POT — (POT) 
    2857  
    2858 
    2859 > open
    2860 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/12.8.pdb
    2861 
    2862 Summary of feedback from opening
    2863 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/12.8.pdb 
    2864 --- 
    2865 warnings | Ignored bad PDB record found on line 1 
    2866 REMARK GENERATED BY TRJCONV 
    2867  
    2868 Ignored bad PDB record found on line 3 
    2869 REMARK THIS IS A SIMULATION BOX 
    2870  
    2871 12.8.pdb title: 
    2872 Title t= 12800.00000 step= 6400000 [more info...] 
    2873  
    2874 Chain information for 12.8.pdb #65 
    2875 --- 
    2876 Chain | Description 
    2877 A B | No description available 
    2878  
    2879 Non-standard residues in 12.8.pdb #65 
    2880 --- 
    2881 HSD — (HSD) 
    2882 POT — (POT) 
    2883  
    2884 
    2885 > open
    2886 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/13.0.pdb
    2887 
    2888 Summary of feedback from opening
    2889 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/13.0.pdb 
    2890 --- 
    2891 warnings | Ignored bad PDB record found on line 1 
    2892 REMARK GENERATED BY TRJCONV 
    2893  
    2894 Ignored bad PDB record found on line 3 
    2895 REMARK THIS IS A SIMULATION BOX 
    2896  
    2897 13.0.pdb title: 
    2898 Title t= 13000.00000 step= 6500000 [more info...] 
    2899  
    2900 Chain information for 13.0.pdb #66 
    2901 --- 
    2902 Chain | Description 
    2903 A B | No description available 
    2904  
    2905 Non-standard residues in 13.0.pdb #66 
    2906 --- 
    2907 HSD — (HSD) 
    2908 POT — (POT) 
    2909  
    2910 
    2911 > open
    2912 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/13.2.pdb
    2913 
    2914 Summary of feedback from opening
    2915 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/13.2.pdb 
    2916 --- 
    2917 warnings | Ignored bad PDB record found on line 1 
    2918 REMARK GENERATED BY TRJCONV 
    2919  
    2920 Ignored bad PDB record found on line 3 
    2921 REMARK THIS IS A SIMULATION BOX 
    2922  
    2923 13.2.pdb title: 
    2924 Title t= 13200.00000 step= 6600000 [more info...] 
    2925  
    2926 Chain information for 13.2.pdb #67 
    2927 --- 
    2928 Chain | Description 
    2929 A B | No description available 
    2930  
    2931 Non-standard residues in 13.2.pdb #67 
    2932 --- 
    2933 HSD — (HSD) 
    2934 POT — (POT) 
    2935  
    2936 
    2937 > open
    2938 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/13.4.pdb
    2939 
    2940 Summary of feedback from opening
    2941 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/13.4.pdb 
    2942 --- 
    2943 warnings | Ignored bad PDB record found on line 1 
    2944 REMARK GENERATED BY TRJCONV 
    2945  
    2946 Ignored bad PDB record found on line 3 
    2947 REMARK THIS IS A SIMULATION BOX 
    2948  
    2949 13.4.pdb title: 
    2950 Title t= 13400.00000 step= 6700000 [more info...] 
    2951  
    2952 Chain information for 13.4.pdb #68 
    2953 --- 
    2954 Chain | Description 
    2955 A B | No description available 
    2956  
    2957 Non-standard residues in 13.4.pdb #68 
    2958 --- 
    2959 HSD — (HSD) 
    2960 POT — (POT) 
    2961  
    2962 
    2963 > open
    2964 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/13.6.pdb
    2965 
    2966 Summary of feedback from opening
    2967 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/13.6.pdb 
    2968 --- 
    2969 warnings | Ignored bad PDB record found on line 1 
    2970 REMARK GENERATED BY TRJCONV 
    2971  
    2972 Ignored bad PDB record found on line 3 
    2973 REMARK THIS IS A SIMULATION BOX 
    2974  
    2975 13.6.pdb title: 
    2976 Title t= 13600.00000 step= 6800000 [more info...] 
    2977  
    2978 Chain information for 13.6.pdb #69 
    2979 --- 
    2980 Chain | Description 
    2981 A B | No description available 
    2982  
    2983 Non-standard residues in 13.6.pdb #69 
    2984 --- 
    2985 HSD — (HSD) 
    2986 POT — (POT) 
    2987  
    2988 
    2989 > open
    2990 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/13.8.pdb
    2991 
    2992 Summary of feedback from opening
    2993 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/13.8.pdb 
    2994 --- 
    2995 warnings | Ignored bad PDB record found on line 1 
    2996 REMARK GENERATED BY TRJCONV 
    2997  
    2998 Ignored bad PDB record found on line 3 
    2999 REMARK THIS IS A SIMULATION BOX 
    3000  
    3001 13.8.pdb title: 
    3002 Title t= 13800.00000 step= 6900000 [more info...] 
    3003  
    3004 Chain information for 13.8.pdb #70 
    3005 --- 
    3006 Chain | Description 
    3007 A B | No description available 
    3008  
    3009 Non-standard residues in 13.8.pdb #70 
    3010 --- 
    3011 HSD — (HSD) 
    3012 POT — (POT) 
    3013  
    3014 
    3015 > open
    3016 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/14.0.pdb
    3017 
    3018 Summary of feedback from opening
    3019 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/14.0.pdb 
    3020 --- 
    3021 warnings | Ignored bad PDB record found on line 1 
    3022 REMARK GENERATED BY TRJCONV 
    3023  
    3024 Ignored bad PDB record found on line 3 
    3025 REMARK THIS IS A SIMULATION BOX 
    3026  
    3027 14.0.pdb title: 
    3028 Title t= 14000.00000 step= 7000000 [more info...] 
    3029  
    3030 Chain information for 14.0.pdb #71 
    3031 --- 
    3032 Chain | Description 
    3033 A B | No description available 
    3034  
    3035 Non-standard residues in 14.0.pdb #71 
    3036 --- 
    3037 HSD — (HSD) 
    3038 POT — (POT) 
    3039  
    3040 
    3041 > open
    3042 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/14.2.pdb
    3043 
    3044 Summary of feedback from opening
    3045 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/14.2.pdb 
    3046 --- 
    3047 warnings | Ignored bad PDB record found on line 1 
    3048 REMARK GENERATED BY TRJCONV 
    3049  
    3050 Ignored bad PDB record found on line 3 
    3051 REMARK THIS IS A SIMULATION BOX 
    3052  
    3053 14.2.pdb title: 
    3054 Title t= 14200.00000 step= 7100000 [more info...] 
    3055  
    3056 Chain information for 14.2.pdb #72 
    3057 --- 
    3058 Chain | Description 
    3059 A B | No description available 
    3060  
    3061 Non-standard residues in 14.2.pdb #72 
    3062 --- 
    3063 HSD — (HSD) 
    3064 POT — (POT) 
    3065  
    3066 
    3067 > open
    3068 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/14.4.pdb
    3069 
    3070 Summary of feedback from opening
    3071 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/14.4.pdb 
    3072 --- 
    3073 warnings | Ignored bad PDB record found on line 1 
    3074 REMARK GENERATED BY TRJCONV 
    3075  
    3076 Ignored bad PDB record found on line 3 
    3077 REMARK THIS IS A SIMULATION BOX 
    3078  
    3079 14.4.pdb title: 
    3080 Title t= 14400.00000 step= 7200000 [more info...] 
    3081  
    3082 Chain information for 14.4.pdb #73 
    3083 --- 
    3084 Chain | Description 
    3085 A B | No description available 
    3086  
    3087 Non-standard residues in 14.4.pdb #73 
    3088 --- 
    3089 HSD — (HSD) 
    3090 POT — (POT) 
    3091  
    3092 
    3093 > open
    3094 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/14.6.pdb
    3095 
    3096 Summary of feedback from opening
    3097 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/14.6.pdb 
    3098 --- 
    3099 warnings | Ignored bad PDB record found on line 1 
    3100 REMARK GENERATED BY TRJCONV 
    3101  
    3102 Ignored bad PDB record found on line 3 
    3103 REMARK THIS IS A SIMULATION BOX 
    3104  
    3105 14.6.pdb title: 
    3106 Title t= 14600.00000 step= 7300000 [more info...] 
    3107  
    3108 Chain information for 14.6.pdb #74 
    3109 --- 
    3110 Chain | Description 
    3111 A B | No description available 
    3112  
    3113 Non-standard residues in 14.6.pdb #74 
    3114 --- 
    3115 HSD — (HSD) 
    3116 POT — (POT) 
    3117  
    3118 
    3119 > open
    3120 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/14.8.pdb
    3121 
    3122 Summary of feedback from opening
    3123 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/14.8.pdb 
    3124 --- 
    3125 warnings | Ignored bad PDB record found on line 1 
    3126 REMARK GENERATED BY TRJCONV 
    3127  
    3128 Ignored bad PDB record found on line 3 
    3129 REMARK THIS IS A SIMULATION BOX 
    3130  
    3131 14.8.pdb title: 
    3132 Title t= 14800.00000 step= 7400000 [more info...] 
    3133  
    3134 Chain information for 14.8.pdb #75 
    3135 --- 
    3136 Chain | Description 
    3137 A B | No description available 
    3138  
    3139 Non-standard residues in 14.8.pdb #75 
    3140 --- 
    3141 HSD — (HSD) 
    3142 POT — (POT) 
    3143  
    3144 
    3145 > open
    3146 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/15.0.pdb
    3147 
    3148 Summary of feedback from opening
    3149 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/15.0.pdb 
    3150 --- 
    3151 warnings | Ignored bad PDB record found on line 1 
    3152 REMARK GENERATED BY TRJCONV 
    3153  
    3154 Ignored bad PDB record found on line 3 
    3155 REMARK THIS IS A SIMULATION BOX 
    3156  
    3157 15.0.pdb title: 
    3158 Title t= 15000.00000 step= 7500000 [more info...] 
    3159  
    3160 Chain information for 15.0.pdb #76 
    3161 --- 
    3162 Chain | Description 
    3163 A B | No description available 
    3164  
    3165 Non-standard residues in 15.0.pdb #76 
    3166 --- 
    3167 HSD — (HSD) 
    3168 POT — (POT) 
    3169  
    3170 
    3171 > open
    3172 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/15.2.pdb
    3173 
    3174 Summary of feedback from opening
    3175 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/15.2.pdb 
    3176 --- 
    3177 warnings | Ignored bad PDB record found on line 1 
    3178 REMARK GENERATED BY TRJCONV 
    3179  
    3180 Ignored bad PDB record found on line 3 
    3181 REMARK THIS IS A SIMULATION BOX 
    3182  
    3183 15.2.pdb title: 
    3184 Title t= 15200.00000 step= 7600000 [more info...] 
    3185  
    3186 Chain information for 15.2.pdb #77 
    3187 --- 
    3188 Chain | Description 
    3189 A B | No description available 
    3190  
    3191 Non-standard residues in 15.2.pdb #77 
    3192 --- 
    3193 HSD — (HSD) 
    3194 POT — (POT) 
    3195  
    3196 
    3197 > open
    3198 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/15.4.pdb
    3199 
    3200 Summary of feedback from opening
    3201 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/15.4.pdb 
    3202 --- 
    3203 warnings | Ignored bad PDB record found on line 1 
    3204 REMARK GENERATED BY TRJCONV 
    3205  
    3206 Ignored bad PDB record found on line 3 
    3207 REMARK THIS IS A SIMULATION BOX 
    3208  
    3209 15.4.pdb title: 
    3210 Title t= 15400.00000 step= 7700000 [more info...] 
    3211  
    3212 Chain information for 15.4.pdb #78 
    3213 --- 
    3214 Chain | Description 
    3215 A B | No description available 
    3216  
    3217 Non-standard residues in 15.4.pdb #78 
    3218 --- 
    3219 HSD — (HSD) 
    3220 POT — (POT) 
    3221  
    3222 
    3223 > open
    3224 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/15.6.pdb
    3225 
    3226 Summary of feedback from opening
    3227 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/15.6.pdb 
    3228 --- 
    3229 warnings | Ignored bad PDB record found on line 1 
    3230 REMARK GENERATED BY TRJCONV 
    3231  
    3232 Ignored bad PDB record found on line 3 
    3233 REMARK THIS IS A SIMULATION BOX 
    3234  
    3235 15.6.pdb title: 
    3236 Title t= 15600.00000 step= 7800000 [more info...] 
    3237  
    3238 Chain information for 15.6.pdb #79 
    3239 --- 
    3240 Chain | Description 
    3241 A B | No description available 
    3242  
    3243 Non-standard residues in 15.6.pdb #79 
    3244 --- 
    3245 HSD — (HSD) 
    3246 POT — (POT) 
    3247  
    3248 
    3249 > open
    3250 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/15.8.pdb
    3251 
    3252 Summary of feedback from opening
    3253 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/15.8.pdb 
    3254 --- 
    3255 warnings | Ignored bad PDB record found on line 1 
    3256 REMARK GENERATED BY TRJCONV 
    3257  
    3258 Ignored bad PDB record found on line 3 
    3259 REMARK THIS IS A SIMULATION BOX 
    3260  
    3261 15.8.pdb title: 
    3262 Title t= 15800.00000 step= 7900000 [more info...] 
    3263  
    3264 Chain information for 15.8.pdb #80 
    3265 --- 
    3266 Chain | Description 
    3267 A B | No description available 
    3268  
    3269 Non-standard residues in 15.8.pdb #80 
    3270 --- 
    3271 HSD — (HSD) 
    3272 POT — (POT) 
    3273  
    3274 
    3275 > open
    3276 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/16.0.pdb
    3277 
    3278 Summary of feedback from opening
    3279 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/16.0.pdb 
    3280 --- 
    3281 warnings | Ignored bad PDB record found on line 1 
    3282 REMARK GENERATED BY TRJCONV 
    3283  
    3284 Ignored bad PDB record found on line 3 
    3285 REMARK THIS IS A SIMULATION BOX 
    3286  
    3287 16.0.pdb title: 
    3288 Title t= 16000.00000 step= 8000000 [more info...] 
    3289  
    3290 Chain information for 16.0.pdb #81 
    3291 --- 
    3292 Chain | Description 
    3293 A B | No description available 
    3294  
    3295 Non-standard residues in 16.0.pdb #81 
    3296 --- 
    3297 HSD — (HSD) 
    3298 POT — (POT) 
    3299  
    3300 
    3301 > open
    3302 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/16.2.pdb
    3303 
    3304 Summary of feedback from opening
    3305 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/16.2.pdb 
    3306 --- 
    3307 warnings | Ignored bad PDB record found on line 1 
    3308 REMARK GENERATED BY TRJCONV 
    3309  
    3310 Ignored bad PDB record found on line 3 
    3311 REMARK THIS IS A SIMULATION BOX 
    3312  
    3313 16.2.pdb title: 
    3314 Title t= 16200.00000 step= 8100000 [more info...] 
    3315  
    3316 Chain information for 16.2.pdb #82 
    3317 --- 
    3318 Chain | Description 
    3319 A B | No description available 
    3320  
    3321 Non-standard residues in 16.2.pdb #82 
    3322 --- 
    3323 HSD — (HSD) 
    3324 POT — (POT) 
    3325  
    3326 
    3327 > open
    3328 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/16.4.pdb
    3329 
    3330 Summary of feedback from opening
    3331 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/16.4.pdb 
    3332 --- 
    3333 warnings | Ignored bad PDB record found on line 1 
    3334 REMARK GENERATED BY TRJCONV 
    3335  
    3336 Ignored bad PDB record found on line 3 
    3337 REMARK THIS IS A SIMULATION BOX 
    3338  
    3339 16.4.pdb title: 
    3340 Title t= 16400.00000 step= 8200000 [more info...] 
    3341  
    3342 Chain information for 16.4.pdb #83 
    3343 --- 
    3344 Chain | Description 
    3345 A B | No description available 
    3346  
    3347 Non-standard residues in 16.4.pdb #83 
    3348 --- 
    3349 HSD — (HSD) 
    3350 POT — (POT) 
    3351  
    3352 
    3353 > open
    3354 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/16.6.pdb
    3355 
    3356 Summary of feedback from opening
    3357 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/16.6.pdb 
    3358 --- 
    3359 warnings | Ignored bad PDB record found on line 1 
    3360 REMARK GENERATED BY TRJCONV 
    3361  
    3362 Ignored bad PDB record found on line 3 
    3363 REMARK THIS IS A SIMULATION BOX 
    3364  
    3365 16.6.pdb title: 
    3366 Title t= 16600.00000 step= 8300000 [more info...] 
    3367  
    3368 Chain information for 16.6.pdb #84 
    3369 --- 
    3370 Chain | Description 
    3371 A B | No description available 
    3372  
    3373 Non-standard residues in 16.6.pdb #84 
    3374 --- 
    3375 HSD — (HSD) 
    3376 POT — (POT) 
    3377  
    3378 
    3379 > open
    3380 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/16.8.pdb
    3381 
    3382 Summary of feedback from opening
    3383 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/16.8.pdb 
    3384 --- 
    3385 warnings | Ignored bad PDB record found on line 1 
    3386 REMARK GENERATED BY TRJCONV 
    3387  
    3388 Ignored bad PDB record found on line 3 
    3389 REMARK THIS IS A SIMULATION BOX 
    3390  
    3391 16.8.pdb title: 
    3392 Title t= 16800.00000 step= 8400000 [more info...] 
    3393  
    3394 Chain information for 16.8.pdb #85 
    3395 --- 
    3396 Chain | Description 
    3397 A B | No description available 
    3398  
    3399 Non-standard residues in 16.8.pdb #85 
    3400 --- 
    3401 HSD — (HSD) 
    3402 POT — (POT) 
    3403  
    3404 
    3405 > open
    3406 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/17.0.pdb
    3407 
    3408 Summary of feedback from opening
    3409 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/17.0.pdb 
    3410 --- 
    3411 warnings | Ignored bad PDB record found on line 1 
    3412 REMARK GENERATED BY TRJCONV 
    3413  
    3414 Ignored bad PDB record found on line 3 
    3415 REMARK THIS IS A SIMULATION BOX 
    3416  
    3417 17.0.pdb title: 
    3418 Title t= 17000.00000 step= 8500000 [more info...] 
    3419  
    3420 Chain information for 17.0.pdb #86 
    3421 --- 
    3422 Chain | Description 
    3423 A B | No description available 
    3424  
    3425 Non-standard residues in 17.0.pdb #86 
    3426 --- 
    3427 HSD — (HSD) 
    3428 POT — (POT) 
    3429  
    3430 
    3431 > open
    3432 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/17.2.pdb
    3433 
    3434 Summary of feedback from opening
    3435 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/17.2.pdb 
    3436 --- 
    3437 warnings | Ignored bad PDB record found on line 1 
    3438 REMARK GENERATED BY TRJCONV 
    3439  
    3440 Ignored bad PDB record found on line 3 
    3441 REMARK THIS IS A SIMULATION BOX 
    3442  
    3443 17.2.pdb title: 
    3444 Title t= 17200.00000 step= 8600000 [more info...] 
    3445  
    3446 Chain information for 17.2.pdb #87 
    3447 --- 
    3448 Chain | Description 
    3449 A B | No description available 
    3450  
    3451 Non-standard residues in 17.2.pdb #87 
    3452 --- 
    3453 HSD — (HSD) 
    3454 POT — (POT) 
    3455  
    3456 
    3457 > open
    3458 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/17.4.pdb
    3459 
    3460 Summary of feedback from opening
    3461 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/17.4.pdb 
    3462 --- 
    3463 warnings | Ignored bad PDB record found on line 1 
    3464 REMARK GENERATED BY TRJCONV 
    3465  
    3466 Ignored bad PDB record found on line 3 
    3467 REMARK THIS IS A SIMULATION BOX 
    3468  
    3469 17.4.pdb title: 
    3470 Title t= 17400.00000 step= 8700000 [more info...] 
    3471  
    3472 Chain information for 17.4.pdb #88 
    3473 --- 
    3474 Chain | Description 
    3475 A B | No description available 
    3476  
    3477 Non-standard residues in 17.4.pdb #88 
    3478 --- 
    3479 HSD — (HSD) 
    3480 POT — (POT) 
    3481  
    3482 
    3483 > open
    3484 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/17.6.pdb
    3485 
    3486 Summary of feedback from opening
    3487 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/17.6.pdb 
    3488 --- 
    3489 warnings | Ignored bad PDB record found on line 1 
    3490 REMARK GENERATED BY TRJCONV 
    3491  
    3492 Ignored bad PDB record found on line 3 
    3493 REMARK THIS IS A SIMULATION BOX 
    3494  
    3495 17.6.pdb title: 
    3496 Title t= 17600.00000 step= 8800000 [more info...] 
    3497  
    3498 Chain information for 17.6.pdb #89 
    3499 --- 
    3500 Chain | Description 
    3501 A B | No description available 
    3502  
    3503 Non-standard residues in 17.6.pdb #89 
    3504 --- 
    3505 HSD — (HSD) 
    3506 POT — (POT) 
    3507  
    3508 
    3509 > open
    3510 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/17.8.pdb
    3511 
    3512 Summary of feedback from opening
    3513 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/17.8.pdb 
    3514 --- 
    3515 warnings | Ignored bad PDB record found on line 1 
    3516 REMARK GENERATED BY TRJCONV 
    3517  
    3518 Ignored bad PDB record found on line 3 
    3519 REMARK THIS IS A SIMULATION BOX 
    3520  
    3521 17.8.pdb title: 
    3522 Title t= 17800.00000 step= 8900000 [more info...] 
    3523  
    3524 Chain information for 17.8.pdb #90 
    3525 --- 
    3526 Chain | Description 
    3527 A B | No description available 
    3528  
    3529 Non-standard residues in 17.8.pdb #90 
    3530 --- 
    3531 HSD — (HSD) 
    3532 POT — (POT) 
    3533  
    3534 
    3535 > open
    3536 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/18.0.pdb
    3537 
    3538 Summary of feedback from opening
    3539 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/18.0.pdb 
    3540 --- 
    3541 warnings | Ignored bad PDB record found on line 1 
    3542 REMARK GENERATED BY TRJCONV 
    3543  
    3544 Ignored bad PDB record found on line 3 
    3545 REMARK THIS IS A SIMULATION BOX 
    3546  
    3547 18.0.pdb title: 
    3548 Title t= 18000.00000 step= 9000000 [more info...] 
    3549  
    3550 Chain information for 18.0.pdb #91 
    3551 --- 
    3552 Chain | Description 
    3553 A B | No description available 
    3554  
    3555 Non-standard residues in 18.0.pdb #91 
    3556 --- 
    3557 HSD — (HSD) 
    3558 POT — (POT) 
    3559  
    3560 
    3561 > open
    3562 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/18.2.pdb
    3563 
    3564 Summary of feedback from opening
    3565 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/18.2.pdb 
    3566 --- 
    3567 warnings | Ignored bad PDB record found on line 1 
    3568 REMARK GENERATED BY TRJCONV 
    3569  
    3570 Ignored bad PDB record found on line 3 
    3571 REMARK THIS IS A SIMULATION BOX 
    3572  
    3573 18.2.pdb title: 
    3574 Title t= 18200.00000 step= 9100000 [more info...] 
    3575  
    3576 Chain information for 18.2.pdb #92 
    3577 --- 
    3578 Chain | Description 
    3579 A B | No description available 
    3580  
    3581 Non-standard residues in 18.2.pdb #92 
    3582 --- 
    3583 HSD — (HSD) 
    3584 POT — (POT) 
    3585  
    3586 
    3587 > open
    3588 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/18.4.pdb
    3589 
    3590 Summary of feedback from opening
    3591 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/18.4.pdb 
    3592 --- 
    3593 warnings | Ignored bad PDB record found on line 1 
    3594 REMARK GENERATED BY TRJCONV 
    3595  
    3596 Ignored bad PDB record found on line 3 
    3597 REMARK THIS IS A SIMULATION BOX 
    3598  
    3599 18.4.pdb title: 
    3600 Title t= 18400.00000 step= 9200000 [more info...] 
    3601  
    3602 Chain information for 18.4.pdb #93 
    3603 --- 
    3604 Chain | Description 
    3605 A B | No description available 
    3606  
    3607 Non-standard residues in 18.4.pdb #93 
    3608 --- 
    3609 HSD — (HSD) 
    3610 POT — (POT) 
    3611  
    3612 
    3613 > open
    3614 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/18.6.pdb
    3615 
    3616 Summary of feedback from opening
    3617 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/18.6.pdb 
    3618 --- 
    3619 warnings | Ignored bad PDB record found on line 1 
    3620 REMARK GENERATED BY TRJCONV 
    3621  
    3622 Ignored bad PDB record found on line 3 
    3623 REMARK THIS IS A SIMULATION BOX 
    3624  
    3625 18.6.pdb title: 
    3626 Title t= 18600.00000 step= 9300000 [more info...] 
    3627  
    3628 Chain information for 18.6.pdb #94 
    3629 --- 
    3630 Chain | Description 
    3631 A B | No description available 
    3632  
    3633 Non-standard residues in 18.6.pdb #94 
    3634 --- 
    3635 HSD — (HSD) 
    3636 POT — (POT) 
    3637  
    3638 
    3639 > open
    3640 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/18.8.pdb
    3641 
    3642 Summary of feedback from opening
    3643 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/18.8.pdb 
    3644 --- 
    3645 warnings | Ignored bad PDB record found on line 1 
    3646 REMARK GENERATED BY TRJCONV 
    3647  
    3648 Ignored bad PDB record found on line 3 
    3649 REMARK THIS IS A SIMULATION BOX 
    3650  
    3651 18.8.pdb title: 
    3652 Title t= 18800.00000 step= 9400000 [more info...] 
    3653  
    3654 Chain information for 18.8.pdb #95 
    3655 --- 
    3656 Chain | Description 
    3657 A B | No description available 
    3658  
    3659 Non-standard residues in 18.8.pdb #95 
    3660 --- 
    3661 HSD — (HSD) 
    3662 POT — (POT) 
    3663  
    3664 
    3665 > open
    3666 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/19.0.pdb
    3667 
    3668 Summary of feedback from opening
    3669 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/19.0.pdb 
    3670 --- 
    3671 warnings | Ignored bad PDB record found on line 1 
    3672 REMARK GENERATED BY TRJCONV 
    3673  
    3674 Ignored bad PDB record found on line 3 
    3675 REMARK THIS IS A SIMULATION BOX 
    3676  
    3677 19.0.pdb title: 
    3678 Title t= 19000.00000 step= 9500000 [more info...] 
    3679  
    3680 Chain information for 19.0.pdb #96 
    3681 --- 
    3682 Chain | Description 
    3683 A B | No description available 
    3684  
    3685 Non-standard residues in 19.0.pdb #96 
    3686 --- 
    3687 HSD — (HSD) 
    3688 POT — (POT) 
    3689  
    3690 
    3691 > open
    3692 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/19.2.pdb
    3693 
    3694 Summary of feedback from opening
    3695 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/19.2.pdb 
    3696 --- 
    3697 warnings | Ignored bad PDB record found on line 1 
    3698 REMARK GENERATED BY TRJCONV 
    3699  
    3700 Ignored bad PDB record found on line 3 
    3701 REMARK THIS IS A SIMULATION BOX 
    3702  
    3703 19.2.pdb title: 
    3704 Title t= 19200.00000 step= 9600000 [more info...] 
    3705  
    3706 Chain information for 19.2.pdb #97 
    3707 --- 
    3708 Chain | Description 
    3709 A B | No description available 
    3710  
    3711 Non-standard residues in 19.2.pdb #97 
    3712 --- 
    3713 HSD — (HSD) 
    3714 POT — (POT) 
    3715  
    3716 
    3717 > open
    3718 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/19.4.pdb
    3719 
    3720 Summary of feedback from opening
    3721 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/19.4.pdb 
    3722 --- 
    3723 warnings | Ignored bad PDB record found on line 1 
    3724 REMARK GENERATED BY TRJCONV 
    3725  
    3726 Ignored bad PDB record found on line 3 
    3727 REMARK THIS IS A SIMULATION BOX 
    3728  
    3729 19.4.pdb title: 
    3730 Title t= 19400.00000 step= 9700000 [more info...] 
    3731  
    3732 Chain information for 19.4.pdb #98 
    3733 --- 
    3734 Chain | Description 
    3735 A B | No description available 
    3736  
    3737 Non-standard residues in 19.4.pdb #98 
    3738 --- 
    3739 HSD — (HSD) 
    3740 POT — (POT) 
    3741  
    3742 
    3743 > open
    3744 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/19.6.pdb
    3745 
    3746 Summary of feedback from opening
    3747 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/19.6.pdb 
    3748 --- 
    3749 warnings | Ignored bad PDB record found on line 1 
    3750 REMARK GENERATED BY TRJCONV 
    3751  
    3752 Ignored bad PDB record found on line 3 
    3753 REMARK THIS IS A SIMULATION BOX 
    3754  
    3755 19.6.pdb title: 
    3756 Title t= 19600.00000 step= 9800000 [more info...] 
    3757  
    3758 Chain information for 19.6.pdb #99 
    3759 --- 
    3760 Chain | Description 
    3761 A B | No description available 
    3762  
    3763 Non-standard residues in 19.6.pdb #99 
    3764 --- 
    3765 HSD — (HSD) 
    3766 POT — (POT) 
    3767  
    3768 
    3769 > open
    3770 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/19.8.pdb
    3771 
    3772 Summary of feedback from opening
    3773 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/19.8.pdb 
    3774 --- 
    3775 warnings | Ignored bad PDB record found on line 1 
    3776 REMARK GENERATED BY TRJCONV 
    3777  
    3778 Ignored bad PDB record found on line 3 
    3779 REMARK THIS IS A SIMULATION BOX 
    3780  
    3781 19.8.pdb title: 
    3782 Title t= 19800.00000 step= 9900000 [more info...] 
    3783  
    3784 Chain information for 19.8.pdb #100 
    3785 --- 
    3786 Chain | Description 
    3787 A B | No description available 
    3788  
    3789 Non-standard residues in 19.8.pdb #100 
    3790 --- 
    3791 HSD — (HSD) 
    3792 POT — (POT) 
    3793  
    3794 
    3795 > open
    3796 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/20.0.pdb
    3797 
    3798 Summary of feedback from opening
    3799 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/20.0.pdb 
    3800 --- 
    3801 warnings | Ignored bad PDB record found on line 1 
    3802 REMARK GENERATED BY TRJCONV 
    3803  
    3804 Ignored bad PDB record found on line 3 
    3805 REMARK THIS IS A SIMULATION BOX 
    3806  
    3807 20.0.pdb title: 
    3808 Title t= 20000.00000 step= 10000000 [more info...] 
    3809  
    3810 Chain information for 20.0.pdb #101 
    3811 --- 
    3812 Chain | Description 
    3813 A B | No description available 
    3814  
    3815 Non-standard residues in 20.0.pdb #101 
    3816 --- 
    3817 HSD — (HSD) 
    3818 POT — (POT) 
    3819  
    3820 
    3821 > open
    3822 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/20.2.pdb
    3823 
    3824 Summary of feedback from opening
    3825 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/20.2.pdb 
    3826 --- 
    3827 warnings | Ignored bad PDB record found on line 1 
    3828 REMARK GENERATED BY TRJCONV 
    3829  
    3830 Ignored bad PDB record found on line 3 
    3831 REMARK THIS IS A SIMULATION BOX 
    3832  
    3833 20.2.pdb title: 
    3834 Title t= 20200.00000 step= 10100000 [more info...] 
    3835  
    3836 Chain information for 20.2.pdb #102 
    3837 --- 
    3838 Chain | Description 
    3839 A B | No description available 
    3840  
    3841 Non-standard residues in 20.2.pdb #102 
    3842 --- 
    3843 HSD — (HSD) 
    3844 POT — (POT) 
    3845  
    3846 
    3847 > open
    3848 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/20.4.pdb
    3849 
    3850 Summary of feedback from opening
    3851 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/20.4.pdb 
    3852 --- 
    3853 warnings | Ignored bad PDB record found on line 1 
    3854 REMARK GENERATED BY TRJCONV 
    3855  
    3856 Ignored bad PDB record found on line 3 
    3857 REMARK THIS IS A SIMULATION BOX 
    3858  
    3859 20.4.pdb title: 
    3860 Title t= 20400.00000 step= 10200000 [more info...] 
    3861  
    3862 Chain information for 20.4.pdb #103 
    3863 --- 
    3864 Chain | Description 
    3865 A B | No description available 
    3866  
    3867 Non-standard residues in 20.4.pdb #103 
    3868 --- 
    3869 HSD — (HSD) 
    3870 POT — (POT) 
    3871  
    3872 
    3873 > open
    3874 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/20.6.pdb
    3875 
    3876 Summary of feedback from opening
    3877 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/20.6.pdb 
    3878 --- 
    3879 warnings | Ignored bad PDB record found on line 1 
    3880 REMARK GENERATED BY TRJCONV 
    3881  
    3882 Ignored bad PDB record found on line 3 
    3883 REMARK THIS IS A SIMULATION BOX 
    3884  
    3885 20.6.pdb title: 
    3886 Title t= 20600.00000 step= 10300000 [more info...] 
    3887  
    3888 Chain information for 20.6.pdb #104 
    3889 --- 
    3890 Chain | Description 
    3891 A B | No description available 
    3892  
    3893 Non-standard residues in 20.6.pdb #104 
    3894 --- 
    3895 HSD — (HSD) 
    3896 POT — (POT) 
    3897  
    3898 
    3899 > open
    3900 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/20.8.pdb
    3901 
    3902 Summary of feedback from opening
    3903 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/20.8.pdb 
    3904 --- 
    3905 warnings | Ignored bad PDB record found on line 1 
    3906 REMARK GENERATED BY TRJCONV 
    3907  
    3908 Ignored bad PDB record found on line 3 
    3909 REMARK THIS IS A SIMULATION BOX 
    3910  
    3911 20.8.pdb title: 
    3912 Title t= 20800.00000 step= 10400000 [more info...] 
    3913  
    3914 Chain information for 20.8.pdb #105 
    3915 --- 
    3916 Chain | Description 
    3917 A B | No description available 
    3918  
    3919 Non-standard residues in 20.8.pdb #105 
    3920 --- 
    3921 HSD — (HSD) 
    3922 POT — (POT) 
    3923  
    3924 
    3925 > open
    3926 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/21.0.pdb
    3927 
    3928 Summary of feedback from opening
    3929 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/21.0.pdb 
    3930 --- 
    3931 warnings | Ignored bad PDB record found on line 1 
    3932 REMARK GENERATED BY TRJCONV 
    3933  
    3934 Ignored bad PDB record found on line 3 
    3935 REMARK THIS IS A SIMULATION BOX 
    3936  
    3937 21.0.pdb title: 
    3938 Title t= 21000.00000 step= 10500000 [more info...] 
    3939  
    3940 Chain information for 21.0.pdb #106 
    3941 --- 
    3942 Chain | Description 
    3943 A B | No description available 
    3944  
    3945 Non-standard residues in 21.0.pdb #106 
    3946 --- 
    3947 HSD — (HSD) 
    3948 POT — (POT) 
    3949  
    3950 
    3951 > open
    3952 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/21.2.pdb
    3953 
    3954 Summary of feedback from opening
    3955 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/21.2.pdb 
    3956 --- 
    3957 warnings | Ignored bad PDB record found on line 1 
    3958 REMARK GENERATED BY TRJCONV 
    3959  
    3960 Ignored bad PDB record found on line 3 
    3961 REMARK THIS IS A SIMULATION BOX 
    3962  
    3963 21.2.pdb title: 
    3964 Title t= 21200.00000 step= 10600000 [more info...] 
    3965  
    3966 Chain information for 21.2.pdb #107 
    3967 --- 
    3968 Chain | Description 
    3969 A B | No description available 
    3970  
    3971 Non-standard residues in 21.2.pdb #107 
    3972 --- 
    3973 HSD — (HSD) 
    3974 POT — (POT) 
    3975  
    3976 
    3977 > open
    3978 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/21.4.pdb
    3979 
    3980 Summary of feedback from opening
    3981 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/21.4.pdb 
    3982 --- 
    3983 warnings | Ignored bad PDB record found on line 1 
    3984 REMARK GENERATED BY TRJCONV 
    3985  
    3986 Ignored bad PDB record found on line 3 
    3987 REMARK THIS IS A SIMULATION BOX 
    3988  
    3989 21.4.pdb title: 
    3990 Title t= 21400.00000 step= 10700000 [more info...] 
    3991  
    3992 Chain information for 21.4.pdb #108 
    3993 --- 
    3994 Chain | Description 
    3995 A B | No description available 
    3996  
    3997 Non-standard residues in 21.4.pdb #108 
    3998 --- 
    3999 HSD — (HSD) 
    4000 POT — (POT) 
    4001  
    4002 
    4003 > open
    4004 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/21.6.pdb
    4005 
    4006 Summary of feedback from opening
    4007 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/21.6.pdb 
    4008 --- 
    4009 warnings | Ignored bad PDB record found on line 1 
    4010 REMARK GENERATED BY TRJCONV 
    4011  
    4012 Ignored bad PDB record found on line 3 
    4013 REMARK THIS IS A SIMULATION BOX 
    4014  
    4015 21.6.pdb title: 
    4016 Title t= 21600.00000 step= 10800000 [more info...] 
    4017  
    4018 Chain information for 21.6.pdb #109 
    4019 --- 
    4020 Chain | Description 
    4021 A B | No description available 
    4022  
    4023 Non-standard residues in 21.6.pdb #109 
    4024 --- 
    4025 HSD — (HSD) 
    4026 POT — (POT) 
    4027  
    4028 
    4029 > open
    4030 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/21.8.pdb
    4031 
    4032 Summary of feedback from opening
    4033 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/21.8.pdb 
    4034 --- 
    4035 warnings | Ignored bad PDB record found on line 1 
    4036 REMARK GENERATED BY TRJCONV 
    4037  
    4038 Ignored bad PDB record found on line 3 
    4039 REMARK THIS IS A SIMULATION BOX 
    4040  
    4041 21.8.pdb title: 
    4042 Title t= 21800.00000 step= 10900000 [more info...] 
    4043  
    4044 Chain information for 21.8.pdb #110 
    4045 --- 
    4046 Chain | Description 
    4047 A B | No description available 
    4048  
    4049 Non-standard residues in 21.8.pdb #110 
    4050 --- 
    4051 HSD — (HSD) 
    4052 POT — (POT) 
    4053  
    4054 
    4055 > open
    4056 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/22.0.pdb
    4057 
    4058 Summary of feedback from opening
    4059 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/22.0.pdb 
    4060 --- 
    4061 warnings | Ignored bad PDB record found on line 1 
    4062 REMARK GENERATED BY TRJCONV 
    4063  
    4064 Ignored bad PDB record found on line 3 
    4065 REMARK THIS IS A SIMULATION BOX 
    4066  
    4067 22.0.pdb title: 
    4068 Title t= 22000.00000 step= 11000000 [more info...] 
    4069  
    4070 Chain information for 22.0.pdb #111 
    4071 --- 
    4072 Chain | Description 
    4073 A B | No description available 
    4074  
    4075 Non-standard residues in 22.0.pdb #111 
    4076 --- 
    4077 HSD — (HSD) 
    4078 POT — (POT) 
    4079  
    4080 
    4081 > open
    4082 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/22.2.pdb
    4083 
    4084 Summary of feedback from opening
    4085 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/22.2.pdb 
    4086 --- 
    4087 warnings | Ignored bad PDB record found on line 1 
    4088 REMARK GENERATED BY TRJCONV 
    4089  
    4090 Ignored bad PDB record found on line 3 
    4091 REMARK THIS IS A SIMULATION BOX 
    4092  
    4093 22.2.pdb title: 
    4094 Title t= 22200.00000 step= 11100000 [more info...] 
    4095  
    4096 Chain information for 22.2.pdb #112 
    4097 --- 
    4098 Chain | Description 
    4099 A B | No description available 
    4100  
    4101 Non-standard residues in 22.2.pdb #112 
    4102 --- 
    4103 HSD — (HSD) 
    4104 POT — (POT) 
    4105  
    4106 
    4107 > open
    4108 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/22.4.pdb
    4109 
    4110 Summary of feedback from opening
    4111 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/22.4.pdb 
    4112 --- 
    4113 warnings | Ignored bad PDB record found on line 1 
    4114 REMARK GENERATED BY TRJCONV 
    4115  
    4116 Ignored bad PDB record found on line 3 
    4117 REMARK THIS IS A SIMULATION BOX 
    4118  
    4119 22.4.pdb title: 
    4120 Title t= 22400.00000 step= 11200000 [more info...] 
    4121  
    4122 Chain information for 22.4.pdb #113 
    4123 --- 
    4124 Chain | Description 
    4125 A B | No description available 
    4126  
    4127 Non-standard residues in 22.4.pdb #113 
    4128 --- 
    4129 HSD — (HSD) 
    4130 POT — (POT) 
    4131  
    4132 
    4133 > open
    4134 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/22.6.pdb
    4135 
    4136 Summary of feedback from opening
    4137 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/22.6.pdb 
    4138 --- 
    4139 warnings | Ignored bad PDB record found on line 1 
    4140 REMARK GENERATED BY TRJCONV 
    4141  
    4142 Ignored bad PDB record found on line 3 
    4143 REMARK THIS IS A SIMULATION BOX 
    4144  
    4145 22.6.pdb title: 
    4146 Title t= 22600.00000 step= 11300000 [more info...] 
    4147  
    4148 Chain information for 22.6.pdb #114 
    4149 --- 
    4150 Chain | Description 
    4151 A B | No description available 
    4152  
    4153 Non-standard residues in 22.6.pdb #114 
    4154 --- 
    4155 HSD — (HSD) 
    4156 POT — (POT) 
    4157  
    4158 
    4159 > open
    4160 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/22.8.pdb
    4161 
    4162 Summary of feedback from opening
    4163 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/22.8.pdb 
    4164 --- 
    4165 warnings | Ignored bad PDB record found on line 1 
    4166 REMARK GENERATED BY TRJCONV 
    4167  
    4168 Ignored bad PDB record found on line 3 
    4169 REMARK THIS IS A SIMULATION BOX 
    4170  
    4171 22.8.pdb title: 
    4172 Title t= 22800.00000 step= 11400000 [more info...] 
    4173  
    4174 Chain information for 22.8.pdb #115 
    4175 --- 
    4176 Chain | Description 
    4177 A B | No description available 
    4178  
    4179 Non-standard residues in 22.8.pdb #115 
    4180 --- 
    4181 HSD — (HSD) 
    4182 POT — (POT) 
    4183  
    4184 
    4185 > open
    4186 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/23.0.pdb
    4187 
    4188 Summary of feedback from opening
    4189 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/23.0.pdb 
    4190 --- 
    4191 warnings | Ignored bad PDB record found on line 1 
    4192 REMARK GENERATED BY TRJCONV 
    4193  
    4194 Ignored bad PDB record found on line 3 
    4195 REMARK THIS IS A SIMULATION BOX 
    4196  
    4197 23.0.pdb title: 
    4198 Title t= 23000.00000 step= 11500000 [more info...] 
    4199  
    4200 Chain information for 23.0.pdb #116 
    4201 --- 
    4202 Chain | Description 
    4203 A B | No description available 
    4204  
    4205 Non-standard residues in 23.0.pdb #116 
    4206 --- 
    4207 HSD — (HSD) 
    4208 POT — (POT) 
    4209  
    4210 
    4211 > open
    4212 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/23.2.pdb
    4213 
    4214 Summary of feedback from opening
    4215 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/23.2.pdb 
    4216 --- 
    4217 warnings | Ignored bad PDB record found on line 1 
    4218 REMARK GENERATED BY TRJCONV 
    4219  
    4220 Ignored bad PDB record found on line 3 
    4221 REMARK THIS IS A SIMULATION BOX 
    4222  
    4223 23.2.pdb title: 
    4224 Title t= 23200.00000 step= 11600000 [more info...] 
    4225  
    4226 Chain information for 23.2.pdb #117 
    4227 --- 
    4228 Chain | Description 
    4229 A B | No description available 
    4230  
    4231 Non-standard residues in 23.2.pdb #117 
    4232 --- 
    4233 HSD — (HSD) 
    4234 POT — (POT) 
    4235  
    4236 
    4237 > open
    4238 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/23.4.pdb
    4239 
    4240 Summary of feedback from opening
    4241 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/23.4.pdb 
    4242 --- 
    4243 warnings | Ignored bad PDB record found on line 1 
    4244 REMARK GENERATED BY TRJCONV 
    4245  
    4246 Ignored bad PDB record found on line 3 
    4247 REMARK THIS IS A SIMULATION BOX 
    4248  
    4249 23.4.pdb title: 
    4250 Title t= 23400.00000 step= 11700000 [more info...] 
    4251  
    4252 Chain information for 23.4.pdb #118 
    4253 --- 
    4254 Chain | Description 
    4255 A B | No description available 
    4256  
    4257 Non-standard residues in 23.4.pdb #118 
    4258 --- 
    4259 HSD — (HSD) 
    4260 POT — (POT) 
    4261  
    4262 
    4263 > open
    4264 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/23.6.pdb
    4265 
    4266 Summary of feedback from opening
    4267 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/23.6.pdb 
    4268 --- 
    4269 warnings | Ignored bad PDB record found on line 1 
    4270 REMARK GENERATED BY TRJCONV 
    4271  
    4272 Ignored bad PDB record found on line 3 
    4273 REMARK THIS IS A SIMULATION BOX 
    4274  
    4275 23.6.pdb title: 
    4276 Title t= 23600.00000 step= 11800000 [more info...] 
    4277  
    4278 Chain information for 23.6.pdb #119 
    4279 --- 
    4280 Chain | Description 
    4281 A B | No description available 
    4282  
    4283 Non-standard residues in 23.6.pdb #119 
    4284 --- 
    4285 HSD — (HSD) 
    4286 POT — (POT) 
    4287  
    4288 
    4289 > open
    4290 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/23.8.pdb
    4291 
    4292 Summary of feedback from opening
    4293 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/23.8.pdb 
    4294 --- 
    4295 warnings | Ignored bad PDB record found on line 1 
    4296 REMARK GENERATED BY TRJCONV 
    4297  
    4298 Ignored bad PDB record found on line 3 
    4299 REMARK THIS IS A SIMULATION BOX 
    4300  
    4301 23.8.pdb title: 
    4302 Title t= 23800.00000 step= 11900000 [more info...] 
    4303  
    4304 Chain information for 23.8.pdb #120 
    4305 --- 
    4306 Chain | Description 
    4307 A B | No description available 
    4308  
    4309 Non-standard residues in 23.8.pdb #120 
    4310 --- 
    4311 HSD — (HSD) 
    4312 POT — (POT) 
    4313  
    4314 
    4315 > open
    4316 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/24.0.pdb
    4317 
    4318 Summary of feedback from opening
    4319 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/24.0.pdb 
    4320 --- 
    4321 warnings | Ignored bad PDB record found on line 1 
    4322 REMARK GENERATED BY TRJCONV 
    4323  
    4324 Ignored bad PDB record found on line 3 
    4325 REMARK THIS IS A SIMULATION BOX 
    4326  
    4327 24.0.pdb title: 
    4328 Title t= 24000.00000 step= 12000000 [more info...] 
    4329  
    4330 Chain information for 24.0.pdb #121 
    4331 --- 
    4332 Chain | Description 
    4333 A B | No description available 
    4334  
    4335 Non-standard residues in 24.0.pdb #121 
    4336 --- 
    4337 HSD — (HSD) 
    4338 POT — (POT) 
    4339  
    4340 
    4341 > open
    4342 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/24.2.pdb
    4343 
    4344 Summary of feedback from opening
    4345 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/24.2.pdb 
    4346 --- 
    4347 warnings | Ignored bad PDB record found on line 1 
    4348 REMARK GENERATED BY TRJCONV 
    4349  
    4350 Ignored bad PDB record found on line 3 
    4351 REMARK THIS IS A SIMULATION BOX 
    4352  
    4353 24.2.pdb title: 
    4354 Title t= 24200.00000 step= 12100000 [more info...] 
    4355  
    4356 Chain information for 24.2.pdb #122 
    4357 --- 
    4358 Chain | Description 
    4359 A B | No description available 
    4360  
    4361 Non-standard residues in 24.2.pdb #122 
    4362 --- 
    4363 HSD — (HSD) 
    4364 POT — (POT) 
    4365  
    4366 
    4367 > open
    4368 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/24.4.pdb
    4369 
    4370 Summary of feedback from opening
    4371 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/24.4.pdb 
    4372 --- 
    4373 warnings | Ignored bad PDB record found on line 1 
    4374 REMARK GENERATED BY TRJCONV 
    4375  
    4376 Ignored bad PDB record found on line 3 
    4377 REMARK THIS IS A SIMULATION BOX 
    4378  
    4379 24.4.pdb title: 
    4380 Title t= 24400.00000 step= 12200000 [more info...] 
    4381  
    4382 Chain information for 24.4.pdb #123 
    4383 --- 
    4384 Chain | Description 
    4385 A B | No description available 
    4386  
    4387 Non-standard residues in 24.4.pdb #123 
    4388 --- 
    4389 HSD — (HSD) 
    4390 POT — (POT) 
    4391  
    4392 
    4393 > open
    4394 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/24.6.pdb
    4395 
    4396 Summary of feedback from opening
    4397 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/24.6.pdb 
    4398 --- 
    4399 warnings | Ignored bad PDB record found on line 1 
    4400 REMARK GENERATED BY TRJCONV 
    4401  
    4402 Ignored bad PDB record found on line 3 
    4403 REMARK THIS IS A SIMULATION BOX 
    4404  
    4405 24.6.pdb title: 
    4406 Title t= 24600.00000 step= 12300000 [more info...] 
    4407  
    4408 Chain information for 24.6.pdb #124 
    4409 --- 
    4410 Chain | Description 
    4411 A B | No description available 
    4412  
    4413 Non-standard residues in 24.6.pdb #124 
    4414 --- 
    4415 HSD — (HSD) 
    4416 POT — (POT) 
    4417  
    4418 
    4419 > open
    4420 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/24.8.pdb
    4421 
    4422 Summary of feedback from opening
    4423 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/24.8.pdb 
    4424 --- 
    4425 warnings | Ignored bad PDB record found on line 1 
    4426 REMARK GENERATED BY TRJCONV 
    4427  
    4428 Ignored bad PDB record found on line 3 
    4429 REMARK THIS IS A SIMULATION BOX 
    4430  
    4431 24.8.pdb title: 
    4432 Title t= 24800.00000 step= 12400000 [more info...] 
    4433  
    4434 Chain information for 24.8.pdb #125 
    4435 --- 
    4436 Chain | Description 
    4437 A B | No description available 
    4438  
    4439 Non-standard residues in 24.8.pdb #125 
    4440 --- 
    4441 HSD — (HSD) 
    4442 POT — (POT) 
    4443  
    4444 
    4445 > open
    4446 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/25.0.pdb
    4447 
    4448 Summary of feedback from opening
    4449 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/25.0.pdb 
    4450 --- 
    4451 warnings | Ignored bad PDB record found on line 1 
    4452 REMARK GENERATED BY TRJCONV 
    4453  
    4454 Ignored bad PDB record found on line 3 
    4455 REMARK THIS IS A SIMULATION BOX 
    4456  
    4457 25.0.pdb title: 
    4458 Title t= 25000.00000 step= 12500000 [more info...] 
    4459  
    4460 Chain information for 25.0.pdb #126 
    4461 --- 
    4462 Chain | Description 
    4463 A B | No description available 
    4464  
    4465 Non-standard residues in 25.0.pdb #126 
    4466 --- 
    4467 HSD — (HSD) 
    4468 POT — (POT) 
    4469  
    4470 
    4471 > open
    4472 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/25.2.pdb
    4473 
    4474 Summary of feedback from opening
    4475 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/25.2.pdb 
    4476 --- 
    4477 warnings | Ignored bad PDB record found on line 1 
    4478 REMARK GENERATED BY TRJCONV 
    4479  
    4480 Ignored bad PDB record found on line 3 
    4481 REMARK THIS IS A SIMULATION BOX 
    4482  
    4483 25.2.pdb title: 
    4484 Title t= 25200.00000 step= 12600000 [more info...] 
    4485  
    4486 Chain information for 25.2.pdb #127 
    4487 --- 
    4488 Chain | Description 
    4489 A B | No description available 
    4490  
    4491 Non-standard residues in 25.2.pdb #127 
    4492 --- 
    4493 HSD — (HSD) 
    4494 POT — (POT) 
    4495  
    4496 
    4497 > open
    4498 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/25.4.pdb
    4499 
    4500 Summary of feedback from opening
    4501 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/25.4.pdb 
    4502 --- 
    4503 warnings | Ignored bad PDB record found on line 1 
    4504 REMARK GENERATED BY TRJCONV 
    4505  
    4506 Ignored bad PDB record found on line 3 
    4507 REMARK THIS IS A SIMULATION BOX 
    4508  
    4509 25.4.pdb title: 
    4510 Title t= 25400.00000 step= 12700000 [more info...] 
    4511  
    4512 Chain information for 25.4.pdb #128 
    4513 --- 
    4514 Chain | Description 
    4515 A B | No description available 
    4516  
    4517 Non-standard residues in 25.4.pdb #128 
    4518 --- 
    4519 HSD — (HSD) 
    4520 POT — (POT) 
    4521  
    4522 
    4523 > open
    4524 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/25.6.pdb
    4525 
    4526 Summary of feedback from opening
    4527 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/25.6.pdb 
    4528 --- 
    4529 warnings | Ignored bad PDB record found on line 1 
    4530 REMARK GENERATED BY TRJCONV 
    4531  
    4532 Ignored bad PDB record found on line 3 
    4533 REMARK THIS IS A SIMULATION BOX 
    4534  
    4535 25.6.pdb title: 
    4536 Title t= 25600.00000 step= 12800000 [more info...] 
    4537  
    4538 Chain information for 25.6.pdb #129 
    4539 --- 
    4540 Chain | Description 
    4541 A B | No description available 
    4542  
    4543 Non-standard residues in 25.6.pdb #129 
    4544 --- 
    4545 HSD — (HSD) 
    4546 POT — (POT) 
    4547  
    4548 
    4549 > open
    4550 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/25.8.pdb
    4551 
    4552 Summary of feedback from opening
    4553 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/25.8.pdb 
    4554 --- 
    4555 warnings | Ignored bad PDB record found on line 1 
    4556 REMARK GENERATED BY TRJCONV 
    4557  
    4558 Ignored bad PDB record found on line 3 
    4559 REMARK THIS IS A SIMULATION BOX 
    4560  
    4561 25.8.pdb title: 
    4562 Title t= 25800.00000 step= 12900000 [more info...] 
    4563  
    4564 Chain information for 25.8.pdb #130 
    4565 --- 
    4566 Chain | Description 
    4567 A B | No description available 
    4568  
    4569 Non-standard residues in 25.8.pdb #130 
    4570 --- 
    4571 HSD — (HSD) 
    4572 POT — (POT) 
    4573  
    4574 
    4575 > open
    4576 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/26.0.pdb
    4577 
    4578 Summary of feedback from opening
    4579 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/26.0.pdb 
    4580 --- 
    4581 warnings | Ignored bad PDB record found on line 1 
    4582 REMARK GENERATED BY TRJCONV 
    4583  
    4584 Ignored bad PDB record found on line 3 
    4585 REMARK THIS IS A SIMULATION BOX 
    4586  
    4587 26.0.pdb title: 
    4588 Title t= 26000.00000 step= 13000000 [more info...] 
    4589  
    4590 Chain information for 26.0.pdb #131 
    4591 --- 
    4592 Chain | Description 
    4593 A B | No description available 
    4594  
    4595 Non-standard residues in 26.0.pdb #131 
    4596 --- 
    4597 HSD — (HSD) 
    4598 POT — (POT) 
    4599  
    4600 
    4601 > open
    4602 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/26.2.pdb
    4603 
    4604 Summary of feedback from opening
    4605 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/26.2.pdb 
    4606 --- 
    4607 warnings | Ignored bad PDB record found on line 1 
    4608 REMARK GENERATED BY TRJCONV 
    4609  
    4610 Ignored bad PDB record found on line 3 
    4611 REMARK THIS IS A SIMULATION BOX 
    4612  
    4613 26.2.pdb title: 
    4614 Title t= 26200.00000 step= 13100000 [more info...] 
    4615  
    4616 Chain information for 26.2.pdb #132 
    4617 --- 
    4618 Chain | Description 
    4619 A B | No description available 
    4620  
    4621 Non-standard residues in 26.2.pdb #132 
    4622 --- 
    4623 HSD — (HSD) 
    4624 POT — (POT) 
    4625  
    4626 
    4627 > open
    4628 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/26.4.pdb
    4629 
    4630 Summary of feedback from opening
    4631 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/26.4.pdb 
    4632 --- 
    4633 warnings | Ignored bad PDB record found on line 1 
    4634 REMARK GENERATED BY TRJCONV 
    4635  
    4636 Ignored bad PDB record found on line 3 
    4637 REMARK THIS IS A SIMULATION BOX 
    4638  
    4639 26.4.pdb title: 
    4640 Title t= 26400.00000 step= 13200000 [more info...] 
    4641  
    4642 Chain information for 26.4.pdb #133 
    4643 --- 
    4644 Chain | Description 
    4645 A B | No description available 
    4646  
    4647 Non-standard residues in 26.4.pdb #133 
    4648 --- 
    4649 HSD — (HSD) 
    4650 POT — (POT) 
    4651  
    4652 
    4653 > open
    4654 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/26.6.pdb
    4655 
    4656 Summary of feedback from opening
    4657 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/26.6.pdb 
    4658 --- 
    4659 warnings | Ignored bad PDB record found on line 1 
    4660 REMARK GENERATED BY TRJCONV 
    4661  
    4662 Ignored bad PDB record found on line 3 
    4663 REMARK THIS IS A SIMULATION BOX 
    4664  
    4665 26.6.pdb title: 
    4666 Title t= 26600.00000 step= 13300000 [more info...] 
    4667  
    4668 Chain information for 26.6.pdb #134 
    4669 --- 
    4670 Chain | Description 
    4671 A B | No description available 
    4672  
    4673 Non-standard residues in 26.6.pdb #134 
    4674 --- 
    4675 HSD — (HSD) 
    4676 POT — (POT) 
    4677  
    4678 
    4679 > open
    4680 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/26.8.pdb
    4681 
    4682 Summary of feedback from opening
    4683 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/26.8.pdb 
    4684 --- 
    4685 warnings | Ignored bad PDB record found on line 1 
    4686 REMARK GENERATED BY TRJCONV 
    4687  
    4688 Ignored bad PDB record found on line 3 
    4689 REMARK THIS IS A SIMULATION BOX 
    4690  
    4691 26.8.pdb title: 
    4692 Title t= 26800.00000 step= 13400000 [more info...] 
    4693  
    4694 Chain information for 26.8.pdb #135 
    4695 --- 
    4696 Chain | Description 
    4697 A B | No description available 
    4698  
    4699 Non-standard residues in 26.8.pdb #135 
    4700 --- 
    4701 HSD — (HSD) 
    4702 POT — (POT) 
    4703  
    4704 
    4705 > open
    4706 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/27.0.pdb
    4707 
    4708 Summary of feedback from opening
    4709 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/27.0.pdb 
    4710 --- 
    4711 warnings | Ignored bad PDB record found on line 1 
    4712 REMARK GENERATED BY TRJCONV 
    4713  
    4714 Ignored bad PDB record found on line 3 
    4715 REMARK THIS IS A SIMULATION BOX 
    4716  
    4717 27.0.pdb title: 
    4718 Title t= 27000.00000 step= 13500000 [more info...] 
    4719  
    4720 Chain information for 27.0.pdb #136 
    4721 --- 
    4722 Chain | Description 
    4723 A B | No description available 
    4724  
    4725 Non-standard residues in 27.0.pdb #136 
    4726 --- 
    4727 HSD — (HSD) 
    4728 POT — (POT) 
    4729  
    4730 
    4731 > open
    4732 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/27.2.pdb
    4733 
    4734 Summary of feedback from opening
    4735 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/27.2.pdb 
    4736 --- 
    4737 warnings | Ignored bad PDB record found on line 1 
    4738 REMARK GENERATED BY TRJCONV 
    4739  
    4740 Ignored bad PDB record found on line 3 
    4741 REMARK THIS IS A SIMULATION BOX 
    4742  
    4743 27.2.pdb title: 
    4744 Title t= 27200.00000 step= 13600000 [more info...] 
    4745  
    4746 Chain information for 27.2.pdb #137 
    4747 --- 
    4748 Chain | Description 
    4749 A B | No description available 
    4750  
    4751 Non-standard residues in 27.2.pdb #137 
    4752 --- 
    4753 HSD — (HSD) 
    4754 POT — (POT) 
    4755  
    4756 
    4757 > open
    4758 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/27.4.pdb
    4759 
    4760 Summary of feedback from opening
    4761 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/27.4.pdb 
    4762 --- 
    4763 warnings | Ignored bad PDB record found on line 1 
    4764 REMARK GENERATED BY TRJCONV 
    4765  
    4766 Ignored bad PDB record found on line 3 
    4767 REMARK THIS IS A SIMULATION BOX 
    4768  
    4769 27.4.pdb title: 
    4770 Title t= 27400.00000 step= 13700000 [more info...] 
    4771  
    4772 Chain information for 27.4.pdb #138 
    4773 --- 
    4774 Chain | Description 
    4775 A B | No description available 
    4776  
    4777 Non-standard residues in 27.4.pdb #138 
    4778 --- 
    4779 HSD — (HSD) 
    4780 POT — (POT) 
    4781  
    4782 
    4783 > open
    4784 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/27.6.pdb
    4785 
    4786 Summary of feedback from opening
    4787 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/27.6.pdb 
    4788 --- 
    4789 warnings | Ignored bad PDB record found on line 1 
    4790 REMARK GENERATED BY TRJCONV 
    4791  
    4792 Ignored bad PDB record found on line 3 
    4793 REMARK THIS IS A SIMULATION BOX 
    4794  
    4795 27.6.pdb title: 
    4796 Title t= 27600.00000 step= 13800000 [more info...] 
    4797  
    4798 Chain information for 27.6.pdb #139 
    4799 --- 
    4800 Chain | Description 
    4801 A B | No description available 
    4802  
    4803 Non-standard residues in 27.6.pdb #139 
    4804 --- 
    4805 HSD — (HSD) 
    4806 POT — (POT) 
    4807  
    4808 
    4809 > open
    4810 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/27.8.pdb
    4811 
    4812 Summary of feedback from opening
    4813 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/27.8.pdb 
    4814 --- 
    4815 warnings | Ignored bad PDB record found on line 1 
    4816 REMARK GENERATED BY TRJCONV 
    4817  
    4818 Ignored bad PDB record found on line 3 
    4819 REMARK THIS IS A SIMULATION BOX 
    4820  
    4821 27.8.pdb title: 
    4822 Title t= 27800.00000 step= 13900000 [more info...] 
    4823  
    4824 Chain information for 27.8.pdb #140 
    4825 --- 
    4826 Chain | Description 
    4827 A B | No description available 
    4828  
    4829 Non-standard residues in 27.8.pdb #140 
    4830 --- 
    4831 HSD — (HSD) 
    4832 POT — (POT) 
    4833  
    4834 
    4835 > open
    4836 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/28.0.pdb
    4837 
    4838 Summary of feedback from opening
    4839 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/28.0.pdb 
    4840 --- 
    4841 warnings | Ignored bad PDB record found on line 1 
    4842 REMARK GENERATED BY TRJCONV 
    4843  
    4844 Ignored bad PDB record found on line 3 
    4845 REMARK THIS IS A SIMULATION BOX 
    4846  
    4847 28.0.pdb title: 
    4848 Title t= 28000.00000 step= 14000000 [more info...] 
    4849  
    4850 Chain information for 28.0.pdb #141 
    4851 --- 
    4852 Chain | Description 
    4853 A B | No description available 
    4854  
    4855 Non-standard residues in 28.0.pdb #141 
    4856 --- 
    4857 HSD — (HSD) 
    4858 POT — (POT) 
    4859  
    4860 
    4861 > open
    4862 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/28.2.pdb
    4863 
    4864 Summary of feedback from opening
    4865 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/28.2.pdb 
    4866 --- 
    4867 warnings | Ignored bad PDB record found on line 1 
    4868 REMARK GENERATED BY TRJCONV 
    4869  
    4870 Ignored bad PDB record found on line 3 
    4871 REMARK THIS IS A SIMULATION BOX 
    4872  
    4873 28.2.pdb title: 
    4874 Title t= 28200.00000 step= 14100000 [more info...] 
    4875  
    4876 Chain information for 28.2.pdb #142 
    4877 --- 
    4878 Chain | Description 
    4879 A B | No description available 
    4880  
    4881 Non-standard residues in 28.2.pdb #142 
    4882 --- 
    4883 HSD — (HSD) 
    4884 POT — (POT) 
    4885  
    4886 
    4887 > open
    4888 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/28.4.pdb
    4889 
    4890 Summary of feedback from opening
    4891 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/28.4.pdb 
    4892 --- 
    4893 warnings | Ignored bad PDB record found on line 1 
    4894 REMARK GENERATED BY TRJCONV 
    4895  
    4896 Ignored bad PDB record found on line 3 
    4897 REMARK THIS IS A SIMULATION BOX 
    4898  
    4899 28.4.pdb title: 
    4900 Title t= 28400.00000 step= 14200000 [more info...] 
    4901  
    4902 Chain information for 28.4.pdb #143 
    4903 --- 
    4904 Chain | Description 
    4905 A B | No description available 
    4906  
    4907 Non-standard residues in 28.4.pdb #143 
    4908 --- 
    4909 HSD — (HSD) 
    4910 POT — (POT) 
    4911  
    4912 
    4913 > open
    4914 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/28.6.pdb
    4915 
    4916 Summary of feedback from opening
    4917 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/28.6.pdb 
    4918 --- 
    4919 warnings | Ignored bad PDB record found on line 1 
    4920 REMARK GENERATED BY TRJCONV 
    4921  
    4922 Ignored bad PDB record found on line 3 
    4923 REMARK THIS IS A SIMULATION BOX 
    4924  
    4925 28.6.pdb title: 
    4926 Title t= 28600.00000 step= 14300000 [more info...] 
    4927  
    4928 Chain information for 28.6.pdb #144 
    4929 --- 
    4930 Chain | Description 
    4931 A B | No description available 
    4932  
    4933 Non-standard residues in 28.6.pdb #144 
    4934 --- 
    4935 HSD — (HSD) 
    4936 POT — (POT) 
    4937  
    4938 
    4939 > open
    4940 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/28.8.pdb
    4941 
    4942 Summary of feedback from opening
    4943 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/28.8.pdb 
    4944 --- 
    4945 warnings | Ignored bad PDB record found on line 1 
    4946 REMARK GENERATED BY TRJCONV 
    4947  
    4948 Ignored bad PDB record found on line 3 
    4949 REMARK THIS IS A SIMULATION BOX 
    4950  
    4951 28.8.pdb title: 
    4952 Title t= 28800.00000 step= 14400000 [more info...] 
    4953  
    4954 Chain information for 28.8.pdb #145 
    4955 --- 
    4956 Chain | Description 
    4957 A B | No description available 
    4958  
    4959 Non-standard residues in 28.8.pdb #145 
    4960 --- 
    4961 HSD — (HSD) 
    4962 POT — (POT) 
    4963  
    4964 
    4965 > open
    4966 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/29.0.pdb
    4967 
    4968 Summary of feedback from opening
    4969 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/29.0.pdb 
    4970 --- 
    4971 warnings | Ignored bad PDB record found on line 1 
    4972 REMARK GENERATED BY TRJCONV 
    4973  
    4974 Ignored bad PDB record found on line 3 
    4975 REMARK THIS IS A SIMULATION BOX 
    4976  
    4977 29.0.pdb title: 
    4978 Title t= 29000.00000 step= 14500000 [more info...] 
    4979  
    4980 Chain information for 29.0.pdb #146 
    4981 --- 
    4982 Chain | Description 
    4983 A B | No description available 
    4984  
    4985 Non-standard residues in 29.0.pdb #146 
    4986 --- 
    4987 HSD — (HSD) 
    4988 POT — (POT) 
    4989  
    4990 
    4991 > open
    4992 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/29.2.pdb
    4993 
    4994 Summary of feedback from opening
    4995 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/29.2.pdb 
    4996 --- 
    4997 warnings | Ignored bad PDB record found on line 1 
    4998 REMARK GENERATED BY TRJCONV 
    4999  
    5000 Ignored bad PDB record found on line 3 
    5001 REMARK THIS IS A SIMULATION BOX 
    5002  
    5003 29.2.pdb title: 
    5004 Title t= 29200.00000 step= 14600000 [more info...] 
    5005  
    5006 Chain information for 29.2.pdb #147 
    5007 --- 
    5008 Chain | Description 
    5009 A B | No description available 
    5010  
    5011 Non-standard residues in 29.2.pdb #147 
    5012 --- 
    5013 HSD — (HSD) 
    5014 POT — (POT) 
    5015  
    5016 
    5017 > open
    5018 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/29.4.pdb
    5019 
    5020 Summary of feedback from opening
    5021 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/29.4.pdb 
    5022 --- 
    5023 warnings | Ignored bad PDB record found on line 1 
    5024 REMARK GENERATED BY TRJCONV 
    5025  
    5026 Ignored bad PDB record found on line 3 
    5027 REMARK THIS IS A SIMULATION BOX 
    5028  
    5029 29.4.pdb title: 
    5030 Title t= 29400.00000 step= 14700000 [more info...] 
    5031  
    5032 Chain information for 29.4.pdb #148 
    5033 --- 
    5034 Chain | Description 
    5035 A B | No description available 
    5036  
    5037 Non-standard residues in 29.4.pdb #148 
    5038 --- 
    5039 HSD — (HSD) 
    5040 POT — (POT) 
    5041  
    5042 
    5043 > open
    5044 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/29.6.pdb
    5045 
    5046 Summary of feedback from opening
    5047 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/29.6.pdb 
    5048 --- 
    5049 warnings | Ignored bad PDB record found on line 1 
    5050 REMARK GENERATED BY TRJCONV 
    5051  
    5052 Ignored bad PDB record found on line 3 
    5053 REMARK THIS IS A SIMULATION BOX 
    5054  
    5055 29.6.pdb title: 
    5056 Title t= 29600.00000 step= 14800000 [more info...] 
    5057  
    5058 Chain information for 29.6.pdb #149 
    5059 --- 
    5060 Chain | Description 
    5061 A B | No description available 
    5062  
    5063 Non-standard residues in 29.6.pdb #149 
    5064 --- 
    5065 HSD — (HSD) 
    5066 POT — (POT) 
    5067  
    5068 
    5069 > open
    5070 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/29.8.pdb
    5071 
    5072 Summary of feedback from opening
    5073 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/29.8.pdb 
    5074 --- 
    5075 warnings | Ignored bad PDB record found on line 1 
    5076 REMARK GENERATED BY TRJCONV 
    5077  
    5078 Ignored bad PDB record found on line 3 
    5079 REMARK THIS IS A SIMULATION BOX 
    5080  
    5081 29.8.pdb title: 
    5082 Title t= 29800.00000 step= 14900000 [more info...] 
    5083  
    5084 Chain information for 29.8.pdb #150 
    5085 --- 
    5086 Chain | Description 
    5087 A B | No description available 
    5088  
    5089 Non-standard residues in 29.8.pdb #150 
    5090 --- 
    5091 HSD — (HSD) 
    5092 POT — (POT) 
    5093  
    5094 
    5095 > open
    5096 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/30.0.pdb
    5097 
    5098 Summary of feedback from opening
    5099 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/30.0.pdb 
    5100 --- 
    5101 warnings | Ignored bad PDB record found on line 1 
    5102 REMARK GENERATED BY TRJCONV 
    5103  
    5104 Ignored bad PDB record found on line 3 
    5105 REMARK THIS IS A SIMULATION BOX 
    5106  
    5107 30.0.pdb title: 
    5108 Title t= 30000.00000 step= 15000000 [more info...] 
    5109  
    5110 Chain information for 30.0.pdb #151 
    5111 --- 
    5112 Chain | Description 
    5113 A B | No description available 
    5114  
    5115 Non-standard residues in 30.0.pdb #151 
    5116 --- 
    5117 HSD — (HSD) 
    5118 POT — (POT) 
    5119  
    5120 
    5121 > open
    5122 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/30.2.pdb
    5123 
    5124 Summary of feedback from opening
    5125 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/30.2.pdb 
    5126 --- 
    5127 warnings | Ignored bad PDB record found on line 1 
    5128 REMARK GENERATED BY TRJCONV 
    5129  
    5130 Ignored bad PDB record found on line 3 
    5131 REMARK THIS IS A SIMULATION BOX 
    5132  
    5133 30.2.pdb title: 
    5134 Title t= 30200.00000 step= 15100000 [more info...] 
    5135  
    5136 Chain information for 30.2.pdb #152 
    5137 --- 
    5138 Chain | Description 
    5139 A B | No description available 
    5140  
    5141 Non-standard residues in 30.2.pdb #152 
    5142 --- 
    5143 HSD — (HSD) 
    5144 POT — (POT) 
    5145  
    5146 
    5147 > open
    5148 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/30.4.pdb
    5149 
    5150 Summary of feedback from opening
    5151 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/30.4.pdb 
    5152 --- 
    5153 warnings | Ignored bad PDB record found on line 1 
    5154 REMARK GENERATED BY TRJCONV 
    5155  
    5156 Ignored bad PDB record found on line 3 
    5157 REMARK THIS IS A SIMULATION BOX 
    5158  
    5159 30.4.pdb title: 
    5160 Title t= 30400.00000 step= 15200000 [more info...] 
    5161  
    5162 Chain information for 30.4.pdb #153 
    5163 --- 
    5164 Chain | Description 
    5165 A B | No description available 
    5166  
    5167 Non-standard residues in 30.4.pdb #153 
    5168 --- 
    5169 HSD — (HSD) 
    5170 POT — (POT) 
    5171  
    5172 
    5173 > open
    5174 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/30.6.pdb
    5175 
    5176 Summary of feedback from opening
    5177 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/30.6.pdb 
    5178 --- 
    5179 warnings | Ignored bad PDB record found on line 1 
    5180 REMARK GENERATED BY TRJCONV 
    5181  
    5182 Ignored bad PDB record found on line 3 
    5183 REMARK THIS IS A SIMULATION BOX 
    5184  
    5185 30.6.pdb title: 
    5186 Title t= 30600.00000 step= 15300000 [more info...] 
    5187  
    5188 Chain information for 30.6.pdb #154 
    5189 --- 
    5190 Chain | Description 
    5191 A B | No description available 
    5192  
    5193 Non-standard residues in 30.6.pdb #154 
    5194 --- 
    5195 HSD — (HSD) 
    5196 POT — (POT) 
    5197  
    5198 
    5199 > open
    5200 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/30.8.pdb
    5201 
    5202 Summary of feedback from opening
    5203 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/30.8.pdb 
    5204 --- 
    5205 warnings | Ignored bad PDB record found on line 1 
    5206 REMARK GENERATED BY TRJCONV 
    5207  
    5208 Ignored bad PDB record found on line 3 
    5209 REMARK THIS IS A SIMULATION BOX 
    5210  
    5211 30.8.pdb title: 
    5212 Title t= 30800.00000 step= 15400000 [more info...] 
    5213  
    5214 Chain information for 30.8.pdb #155 
    5215 --- 
    5216 Chain | Description 
    5217 A B | No description available 
    5218  
    5219 Non-standard residues in 30.8.pdb #155 
    5220 --- 
    5221 HSD — (HSD) 
    5222 POT — (POT) 
    5223  
    5224 
    5225 > open
    5226 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/31.0.pdb
    5227 
    5228 Summary of feedback from opening
    5229 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/31.0.pdb 
    5230 --- 
    5231 warnings | Ignored bad PDB record found on line 1 
    5232 REMARK GENERATED BY TRJCONV 
    5233  
    5234 Ignored bad PDB record found on line 3 
    5235 REMARK THIS IS A SIMULATION BOX 
    5236  
    5237 31.0.pdb title: 
    5238 Title t= 31000.00000 step= 15500000 [more info...] 
    5239  
    5240 Chain information for 31.0.pdb #156 
    5241 --- 
    5242 Chain | Description 
    5243 A B | No description available 
    5244  
    5245 Non-standard residues in 31.0.pdb #156 
    5246 --- 
    5247 HSD — (HSD) 
    5248 POT — (POT) 
    5249  
    5250 
    5251 > open
    5252 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/31.2.pdb
    5253 
    5254 Summary of feedback from opening
    5255 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/31.2.pdb 
    5256 --- 
    5257 warnings | Ignored bad PDB record found on line 1 
    5258 REMARK GENERATED BY TRJCONV 
    5259  
    5260 Ignored bad PDB record found on line 3 
    5261 REMARK THIS IS A SIMULATION BOX 
    5262  
    5263 31.2.pdb title: 
    5264 Title t= 31200.00000 step= 15600000 [more info...] 
    5265  
    5266 Chain information for 31.2.pdb #157 
    5267 --- 
    5268 Chain | Description 
    5269 A B | No description available 
    5270  
    5271 Non-standard residues in 31.2.pdb #157 
    5272 --- 
    5273 HSD — (HSD) 
    5274 POT — (POT) 
    5275  
    5276 
    5277 > open
    5278 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/31.4.pdb
    5279 
    5280 Summary of feedback from opening
    5281 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/31.4.pdb 
    5282 --- 
    5283 warnings | Ignored bad PDB record found on line 1 
    5284 REMARK GENERATED BY TRJCONV 
    5285  
    5286 Ignored bad PDB record found on line 3 
    5287 REMARK THIS IS A SIMULATION BOX 
    5288  
    5289 31.4.pdb title: 
    5290 Title t= 31400.00000 step= 15700000 [more info...] 
    5291  
    5292 Chain information for 31.4.pdb #158 
    5293 --- 
    5294 Chain | Description 
    5295 A B | No description available 
    5296  
    5297 Non-standard residues in 31.4.pdb #158 
    5298 --- 
    5299 HSD — (HSD) 
    5300 POT — (POT) 
    5301  
    5302 
    5303 > open
    5304 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/31.6.pdb
    5305 
    5306 Summary of feedback from opening
    5307 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/31.6.pdb 
    5308 --- 
    5309 warnings | Ignored bad PDB record found on line 1 
    5310 REMARK GENERATED BY TRJCONV 
    5311  
    5312 Ignored bad PDB record found on line 3 
    5313 REMARK THIS IS A SIMULATION BOX 
    5314  
    5315 31.6.pdb title: 
    5316 Title t= 31600.00000 step= 15800000 [more info...] 
    5317  
    5318 Chain information for 31.6.pdb #159 
    5319 --- 
    5320 Chain | Description 
    5321 A B | No description available 
    5322  
    5323 Non-standard residues in 31.6.pdb #159 
    5324 --- 
    5325 HSD — (HSD) 
    5326 POT — (POT) 
    5327  
    5328 
    5329 > open
    5330 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/31.8.pdb
    5331 
    5332 Summary of feedback from opening
    5333 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/31.8.pdb 
    5334 --- 
    5335 warnings | Ignored bad PDB record found on line 1 
    5336 REMARK GENERATED BY TRJCONV 
    5337  
    5338 Ignored bad PDB record found on line 3 
    5339 REMARK THIS IS A SIMULATION BOX 
    5340  
    5341 31.8.pdb title: 
    5342 Title t= 31800.00000 step= 15900000 [more info...] 
    5343  
    5344 Chain information for 31.8.pdb #160 
    5345 --- 
    5346 Chain | Description 
    5347 A B | No description available 
    5348  
    5349 Non-standard residues in 31.8.pdb #160 
    5350 --- 
    5351 HSD — (HSD) 
    5352 POT — (POT) 
    5353  
    5354 
    5355 > open
    5356 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/32.0.pdb
    5357 
    5358 Summary of feedback from opening
    5359 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/32.0.pdb 
    5360 --- 
    5361 warnings | Ignored bad PDB record found on line 1 
    5362 REMARK GENERATED BY TRJCONV 
    5363  
    5364 Ignored bad PDB record found on line 3 
    5365 REMARK THIS IS A SIMULATION BOX 
    5366  
    5367 32.0.pdb title: 
    5368 Title t= 32000.00000 step= 16000000 [more info...] 
    5369  
    5370 Chain information for 32.0.pdb #161 
    5371 --- 
    5372 Chain | Description 
    5373 A B | No description available 
    5374  
    5375 Non-standard residues in 32.0.pdb #161 
    5376 --- 
    5377 HSD — (HSD) 
    5378 POT — (POT) 
    5379  
    5380 
    5381 > open
    5382 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/32.2.pdb
    5383 
    5384 Summary of feedback from opening
    5385 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/32.2.pdb 
    5386 --- 
    5387 warnings | Ignored bad PDB record found on line 1 
    5388 REMARK GENERATED BY TRJCONV 
    5389  
    5390 Ignored bad PDB record found on line 3 
    5391 REMARK THIS IS A SIMULATION BOX 
    5392  
    5393 32.2.pdb title: 
    5394 Title t= 32200.00000 step= 16100000 [more info...] 
    5395  
    5396 Chain information for 32.2.pdb #162 
    5397 --- 
    5398 Chain | Description 
    5399 A B | No description available 
    5400  
    5401 Non-standard residues in 32.2.pdb #162 
    5402 --- 
    5403 HSD — (HSD) 
    5404 POT — (POT) 
    5405  
    5406 
    5407 > open
    5408 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/32.4.pdb
    5409 
    5410 Summary of feedback from opening
    5411 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/32.4.pdb 
    5412 --- 
    5413 warnings | Ignored bad PDB record found on line 1 
    5414 REMARK GENERATED BY TRJCONV 
    5415  
    5416 Ignored bad PDB record found on line 3 
    5417 REMARK THIS IS A SIMULATION BOX 
    5418  
    5419 32.4.pdb title: 
    5420 Title t= 32400.00000 step= 16200000 [more info...] 
    5421  
    5422 Chain information for 32.4.pdb #163 
    5423 --- 
    5424 Chain | Description 
    5425 A B | No description available 
    5426  
    5427 Non-standard residues in 32.4.pdb #163 
    5428 --- 
    5429 HSD — (HSD) 
    5430 POT — (POT) 
    5431  
    5432 
    5433 > open
    5434 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/32.6.pdb
    5435 
    5436 Summary of feedback from opening
    5437 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/32.6.pdb 
    5438 --- 
    5439 warnings | Ignored bad PDB record found on line 1 
    5440 REMARK GENERATED BY TRJCONV 
    5441  
    5442 Ignored bad PDB record found on line 3 
    5443 REMARK THIS IS A SIMULATION BOX 
    5444  
    5445 32.6.pdb title: 
    5446 Title t= 32600.00000 step= 16300000 [more info...] 
    5447  
    5448 Chain information for 32.6.pdb #164 
    5449 --- 
    5450 Chain | Description 
    5451 A B | No description available 
    5452  
    5453 Non-standard residues in 32.6.pdb #164 
    5454 --- 
    5455 HSD — (HSD) 
    5456 POT — (POT) 
    5457  
    5458 
    5459 > open
    5460 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/32.8.pdb
    5461 
    5462 Summary of feedback from opening
    5463 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/32.8.pdb 
    5464 --- 
    5465 warnings | Ignored bad PDB record found on line 1 
    5466 REMARK GENERATED BY TRJCONV 
    5467  
    5468 Ignored bad PDB record found on line 3 
    5469 REMARK THIS IS A SIMULATION BOX 
    5470  
    5471 32.8.pdb title: 
    5472 Title t= 32800.00000 step= 16400000 [more info...] 
    5473  
    5474 Chain information for 32.8.pdb #165 
    5475 --- 
    5476 Chain | Description 
    5477 A B | No description available 
    5478  
    5479 Non-standard residues in 32.8.pdb #165 
    5480 --- 
    5481 HSD — (HSD) 
    5482 POT — (POT) 
    5483  
    5484 
    5485 > open
    5486 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/33.0.pdb
    5487 
    5488 Summary of feedback from opening
    5489 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/33.0.pdb 
    5490 --- 
    5491 warnings | Ignored bad PDB record found on line 1 
    5492 REMARK GENERATED BY TRJCONV 
    5493  
    5494 Ignored bad PDB record found on line 3 
    5495 REMARK THIS IS A SIMULATION BOX 
    5496  
    5497 33.0.pdb title: 
    5498 Title t= 33000.00000 step= 16500000 [more info...] 
    5499  
    5500 Chain information for 33.0.pdb #166 
    5501 --- 
    5502 Chain | Description 
    5503 A B | No description available 
    5504  
    5505 Non-standard residues in 33.0.pdb #166 
    5506 --- 
    5507 HSD — (HSD) 
    5508 POT — (POT) 
    5509  
    5510 
    5511 > open
    5512 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/33.2.pdb
    5513 
    5514 Summary of feedback from opening
    5515 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/33.2.pdb 
    5516 --- 
    5517 warnings | Ignored bad PDB record found on line 1 
    5518 REMARK GENERATED BY TRJCONV 
    5519  
    5520 Ignored bad PDB record found on line 3 
    5521 REMARK THIS IS A SIMULATION BOX 
    5522  
    5523 33.2.pdb title: 
    5524 Title t= 33200.00000 step= 16600000 [more info...] 
    5525  
    5526 Chain information for 33.2.pdb #167 
    5527 --- 
    5528 Chain | Description 
    5529 A B | No description available 
    5530  
    5531 Non-standard residues in 33.2.pdb #167 
    5532 --- 
    5533 HSD — (HSD) 
    5534 POT — (POT) 
    5535  
    5536 
    5537 > open
    5538 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/33.4.pdb
    5539 
    5540 Summary of feedback from opening
    5541 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/33.4.pdb 
    5542 --- 
    5543 warnings | Ignored bad PDB record found on line 1 
    5544 REMARK GENERATED BY TRJCONV 
    5545  
    5546 Ignored bad PDB record found on line 3 
    5547 REMARK THIS IS A SIMULATION BOX 
    5548  
    5549 33.4.pdb title: 
    5550 Title t= 33400.00000 step= 16700000 [more info...] 
    5551  
    5552 Chain information for 33.4.pdb #168 
    5553 --- 
    5554 Chain | Description 
    5555 A B | No description available 
    5556  
    5557 Non-standard residues in 33.4.pdb #168 
    5558 --- 
    5559 HSD — (HSD) 
    5560 POT — (POT) 
    5561  
    5562 
    5563 > open
    5564 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/33.6.pdb
    5565 
    5566 Summary of feedback from opening
    5567 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/33.6.pdb 
    5568 --- 
    5569 warnings | Ignored bad PDB record found on line 1 
    5570 REMARK GENERATED BY TRJCONV 
    5571  
    5572 Ignored bad PDB record found on line 3 
    5573 REMARK THIS IS A SIMULATION BOX 
    5574  
    5575 33.6.pdb title: 
    5576 Title t= 33600.00000 step= 16800000 [more info...] 
    5577  
    5578 Chain information for 33.6.pdb #169 
    5579 --- 
    5580 Chain | Description 
    5581 A B | No description available 
    5582  
    5583 Non-standard residues in 33.6.pdb #169 
    5584 --- 
    5585 HSD — (HSD) 
    5586 POT — (POT) 
    5587  
    5588 
    5589 > open
    5590 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/33.8.pdb
    5591 
    5592 Summary of feedback from opening
    5593 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/33.8.pdb 
    5594 --- 
    5595 warnings | Ignored bad PDB record found on line 1 
    5596 REMARK GENERATED BY TRJCONV 
    5597  
    5598 Ignored bad PDB record found on line 3 
    5599 REMARK THIS IS A SIMULATION BOX 
    5600  
    5601 33.8.pdb title: 
    5602 Title t= 33800.00000 step= 16900000 [more info...] 
    5603  
    5604 Chain information for 33.8.pdb #170 
    5605 --- 
    5606 Chain | Description 
    5607 A B | No description available 
    5608  
    5609 Non-standard residues in 33.8.pdb #170 
    5610 --- 
    5611 HSD — (HSD) 
    5612 POT — (POT) 
    5613  
    5614 
    5615 > open
    5616 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/34.0.pdb
    5617 
    5618 Summary of feedback from opening
    5619 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/34.0.pdb 
    5620 --- 
    5621 warnings | Ignored bad PDB record found on line 1 
    5622 REMARK GENERATED BY TRJCONV 
    5623  
    5624 Ignored bad PDB record found on line 3 
    5625 REMARK THIS IS A SIMULATION BOX 
    5626  
    5627 34.0.pdb title: 
    5628 Title t= 34000.00000 step= 17000000 [more info...] 
    5629  
    5630 Chain information for 34.0.pdb #171 
    5631 --- 
    5632 Chain | Description 
    5633 A B | No description available 
    5634  
    5635 Non-standard residues in 34.0.pdb #171 
    5636 --- 
    5637 HSD — (HSD) 
    5638 POT — (POT) 
    5639  
    5640 
    5641 > open
    5642 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/34.2.pdb
    5643 
    5644 Summary of feedback from opening
    5645 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/34.2.pdb 
    5646 --- 
    5647 warnings | Ignored bad PDB record found on line 1 
    5648 REMARK GENERATED BY TRJCONV 
    5649  
    5650 Ignored bad PDB record found on line 3 
    5651 REMARK THIS IS A SIMULATION BOX 
    5652  
    5653 34.2.pdb title: 
    5654 Title t= 34200.00000 step= 17100000 [more info...] 
    5655  
    5656 Chain information for 34.2.pdb #172 
    5657 --- 
    5658 Chain | Description 
    5659 A B | No description available 
    5660  
    5661 Non-standard residues in 34.2.pdb #172 
    5662 --- 
    5663 HSD — (HSD) 
    5664 POT — (POT) 
    5665  
    5666 
    5667 > open
    5668 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/34.4.pdb
    5669 
    5670 Summary of feedback from opening
    5671 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/34.4.pdb 
    5672 --- 
    5673 warnings | Ignored bad PDB record found on line 1 
    5674 REMARK GENERATED BY TRJCONV 
    5675  
    5676 Ignored bad PDB record found on line 3 
    5677 REMARK THIS IS A SIMULATION BOX 
    5678  
    5679 34.4.pdb title: 
    5680 Title t= 34400.00000 step= 17200000 [more info...] 
    5681  
    5682 Chain information for 34.4.pdb #173 
    5683 --- 
    5684 Chain | Description 
    5685 A B | No description available 
    5686  
    5687 Non-standard residues in 34.4.pdb #173 
    5688 --- 
    5689 HSD — (HSD) 
    5690 POT — (POT) 
    5691  
    5692 
    5693 > open
    5694 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/34.6.pdb
    5695 
    5696 Summary of feedback from opening
    5697 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/34.6.pdb 
    5698 --- 
    5699 warnings | Ignored bad PDB record found on line 1 
    5700 REMARK GENERATED BY TRJCONV 
    5701  
    5702 Ignored bad PDB record found on line 3 
    5703 REMARK THIS IS A SIMULATION BOX 
    5704  
    5705 34.6.pdb title: 
    5706 Title t= 34600.00000 step= 17300000 [more info...] 
    5707  
    5708 Chain information for 34.6.pdb #174 
    5709 --- 
    5710 Chain | Description 
    5711 A B | No description available 
    5712  
    5713 Non-standard residues in 34.6.pdb #174 
    5714 --- 
    5715 HSD — (HSD) 
    5716 POT — (POT) 
    5717  
    5718 
    5719 > open
    5720 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/34.8.pdb
    5721 
    5722 Summary of feedback from opening
    5723 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/34.8.pdb 
    5724 --- 
    5725 warnings | Ignored bad PDB record found on line 1 
    5726 REMARK GENERATED BY TRJCONV 
    5727  
    5728 Ignored bad PDB record found on line 3 
    5729 REMARK THIS IS A SIMULATION BOX 
    5730  
    5731 34.8.pdb title: 
    5732 Title t= 34800.00000 step= 17400000 [more info...] 
    5733  
    5734 Chain information for 34.8.pdb #175 
    5735 --- 
    5736 Chain | Description 
    5737 A B | No description available 
    5738  
    5739 Non-standard residues in 34.8.pdb #175 
    5740 --- 
    5741 HSD — (HSD) 
    5742 POT — (POT) 
    5743  
    5744 
    5745 > open
    5746 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/35.0.pdb
    5747 
    5748 Summary of feedback from opening
    5749 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/35.0.pdb 
    5750 --- 
    5751 warnings | Ignored bad PDB record found on line 1 
    5752 REMARK GENERATED BY TRJCONV 
    5753  
    5754 Ignored bad PDB record found on line 3 
    5755 REMARK THIS IS A SIMULATION BOX 
    5756  
    5757 35.0.pdb title: 
    5758 Title t= 35000.00000 step= 17500000 [more info...] 
    5759  
    5760 Chain information for 35.0.pdb #176 
    5761 --- 
    5762 Chain | Description 
    5763 A B | No description available 
    5764  
    5765 Non-standard residues in 35.0.pdb #176 
    5766 --- 
    5767 HSD — (HSD) 
    5768 POT — (POT) 
    5769  
    5770 
    5771 > open
    5772 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/35.2.pdb
    5773 
    5774 Summary of feedback from opening
    5775 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/35.2.pdb 
    5776 --- 
    5777 warnings | Ignored bad PDB record found on line 1 
    5778 REMARK GENERATED BY TRJCONV 
    5779  
    5780 Ignored bad PDB record found on line 3 
    5781 REMARK THIS IS A SIMULATION BOX 
    5782  
    5783 35.2.pdb title: 
    5784 Title t= 35200.00000 step= 17600000 [more info...] 
    5785  
    5786 Chain information for 35.2.pdb #177 
    5787 --- 
    5788 Chain | Description 
    5789 A B | No description available 
    5790  
    5791 Non-standard residues in 35.2.pdb #177 
    5792 --- 
    5793 HSD — (HSD) 
    5794 POT — (POT) 
    5795  
    5796 
    5797 > open
    5798 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/35.4.pdb
    5799 
    5800 Summary of feedback from opening
    5801 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/35.4.pdb 
    5802 --- 
    5803 warnings | Ignored bad PDB record found on line 1 
    5804 REMARK GENERATED BY TRJCONV 
    5805  
    5806 Ignored bad PDB record found on line 3 
    5807 REMARK THIS IS A SIMULATION BOX 
    5808  
    5809 35.4.pdb title: 
    5810 Title t= 35400.00000 step= 17700000 [more info...] 
    5811  
    5812 Chain information for 35.4.pdb #178 
    5813 --- 
    5814 Chain | Description 
    5815 A B | No description available 
    5816  
    5817 Non-standard residues in 35.4.pdb #178 
    5818 --- 
    5819 HSD — (HSD) 
    5820 POT — (POT) 
    5821  
    5822 
    5823 > open
    5824 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/35.6.pdb
    5825 
    5826 Summary of feedback from opening
    5827 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/35.6.pdb 
    5828 --- 
    5829 warnings | Ignored bad PDB record found on line 1 
    5830 REMARK GENERATED BY TRJCONV 
    5831  
    5832 Ignored bad PDB record found on line 3 
    5833 REMARK THIS IS A SIMULATION BOX 
    5834  
    5835 35.6.pdb title: 
    5836 Title t= 35600.00000 step= 17800000 [more info...] 
    5837  
    5838 Chain information for 35.6.pdb #179 
    5839 --- 
    5840 Chain | Description 
    5841 A B | No description available 
    5842  
    5843 Non-standard residues in 35.6.pdb #179 
    5844 --- 
    5845 HSD — (HSD) 
    5846 POT — (POT) 
    5847  
    5848 
    5849 > open
    5850 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/35.8.pdb
    5851 
    5852 Summary of feedback from opening
    5853 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/35.8.pdb 
    5854 --- 
    5855 warnings | Ignored bad PDB record found on line 1 
    5856 REMARK GENERATED BY TRJCONV 
    5857  
    5858 Ignored bad PDB record found on line 3 
    5859 REMARK THIS IS A SIMULATION BOX 
    5860  
    5861 35.8.pdb title: 
    5862 Title t= 35800.00000 step= 17900000 [more info...] 
    5863  
    5864 Chain information for 35.8.pdb #180 
    5865 --- 
    5866 Chain | Description 
    5867 A B | No description available 
    5868  
    5869 Non-standard residues in 35.8.pdb #180 
    5870 --- 
    5871 HSD — (HSD) 
    5872 POT — (POT) 
    5873  
    5874 
    5875 > open
    5876 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/36.0.pdb
    5877 
    5878 Summary of feedback from opening
    5879 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/36.0.pdb 
    5880 --- 
    5881 warnings | Ignored bad PDB record found on line 1 
    5882 REMARK GENERATED BY TRJCONV 
    5883  
    5884 Ignored bad PDB record found on line 3 
    5885 REMARK THIS IS A SIMULATION BOX 
    5886  
    5887 36.0.pdb title: 
    5888 Title t= 36000.00000 step= 18000000 [more info...] 
    5889  
    5890 Chain information for 36.0.pdb #181 
    5891 --- 
    5892 Chain | Description 
    5893 A B | No description available 
    5894  
    5895 Non-standard residues in 36.0.pdb #181 
    5896 --- 
    5897 HSD — (HSD) 
    5898 POT — (POT) 
    5899  
    5900 
    5901 > open
    5902 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/36.2.pdb
    5903 
    5904 Summary of feedback from opening
    5905 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/36.2.pdb 
    5906 --- 
    5907 warnings | Ignored bad PDB record found on line 1 
    5908 REMARK GENERATED BY TRJCONV 
    5909  
    5910 Ignored bad PDB record found on line 3 
    5911 REMARK THIS IS A SIMULATION BOX 
    5912  
    5913 36.2.pdb title: 
    5914 Title t= 36200.00000 step= 18100000 [more info...] 
    5915  
    5916 Chain information for 36.2.pdb #182 
    5917 --- 
    5918 Chain | Description 
    5919 A B | No description available 
    5920  
    5921 Non-standard residues in 36.2.pdb #182 
    5922 --- 
    5923 HSD — (HSD) 
    5924 POT — (POT) 
    5925  
    5926 
    5927 > open
    5928 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/36.4.pdb
    5929 
    5930 Summary of feedback from opening
    5931 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/36.4.pdb 
    5932 --- 
    5933 warnings | Ignored bad PDB record found on line 1 
    5934 REMARK GENERATED BY TRJCONV 
    5935  
    5936 Ignored bad PDB record found on line 3 
    5937 REMARK THIS IS A SIMULATION BOX 
    5938  
    5939 36.4.pdb title: 
    5940 Title t= 36400.00000 step= 18200000 [more info...] 
    5941  
    5942 Chain information for 36.4.pdb #183 
    5943 --- 
    5944 Chain | Description 
    5945 A B | No description available 
    5946  
    5947 Non-standard residues in 36.4.pdb #183 
    5948 --- 
    5949 HSD — (HSD) 
    5950 POT — (POT) 
    5951  
    5952 
    5953 > open
    5954 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/36.6.pdb
    5955 
    5956 Summary of feedback from opening
    5957 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/36.6.pdb 
    5958 --- 
    5959 warnings | Ignored bad PDB record found on line 1 
    5960 REMARK GENERATED BY TRJCONV 
    5961  
    5962 Ignored bad PDB record found on line 3 
    5963 REMARK THIS IS A SIMULATION BOX 
    5964  
    5965 36.6.pdb title: 
    5966 Title t= 36600.00000 step= 18300000 [more info...] 
    5967  
    5968 Chain information for 36.6.pdb #184 
    5969 --- 
    5970 Chain | Description 
    5971 A B | No description available 
    5972  
    5973 Non-standard residues in 36.6.pdb #184 
    5974 --- 
    5975 HSD — (HSD) 
    5976 POT — (POT) 
    5977  
    5978 
    5979 > open
    5980 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/36.8.pdb
    5981 
    5982 Summary of feedback from opening
    5983 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/36.8.pdb 
    5984 --- 
    5985 warnings | Ignored bad PDB record found on line 1 
    5986 REMARK GENERATED BY TRJCONV 
    5987  
    5988 Ignored bad PDB record found on line 3 
    5989 REMARK THIS IS A SIMULATION BOX 
    5990  
    5991 36.8.pdb title: 
    5992 Title t= 36800.00000 step= 18400000 [more info...] 
    5993  
    5994 Chain information for 36.8.pdb #185 
    5995 --- 
    5996 Chain | Description 
    5997 A B | No description available 
    5998  
    5999 Non-standard residues in 36.8.pdb #185 
    6000 --- 
    6001 HSD — (HSD) 
    6002 POT — (POT) 
    6003  
    6004 
    6005 > open
    6006 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/37.0.pdb
    6007 
    6008 Summary of feedback from opening
    6009 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/37.0.pdb 
    6010 --- 
    6011 warnings | Ignored bad PDB record found on line 1 
    6012 REMARK GENERATED BY TRJCONV 
    6013  
    6014 Ignored bad PDB record found on line 3 
    6015 REMARK THIS IS A SIMULATION BOX 
    6016  
    6017 37.0.pdb title: 
    6018 Title t= 37000.00000 step= 18500000 [more info...] 
    6019  
    6020 Chain information for 37.0.pdb #186 
    6021 --- 
    6022 Chain | Description 
    6023 A B | No description available 
    6024  
    6025 Non-standard residues in 37.0.pdb #186 
    6026 --- 
    6027 HSD — (HSD) 
    6028 POT — (POT) 
    6029  
    6030 
    6031 > open
    6032 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/37.2.pdb
    6033 
    6034 Summary of feedback from opening
    6035 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/37.2.pdb 
    6036 --- 
    6037 warnings | Ignored bad PDB record found on line 1 
    6038 REMARK GENERATED BY TRJCONV 
    6039  
    6040 Ignored bad PDB record found on line 3 
    6041 REMARK THIS IS A SIMULATION BOX 
    6042  
    6043 37.2.pdb title: 
    6044 Title t= 37200.00000 step= 18600000 [more info...] 
    6045  
    6046 Chain information for 37.2.pdb #187 
    6047 --- 
    6048 Chain | Description 
    6049 A B | No description available 
    6050  
    6051 Non-standard residues in 37.2.pdb #187 
    6052 --- 
    6053 HSD — (HSD) 
    6054 POT — (POT) 
    6055  
    6056 
    6057 > open
    6058 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/37.4.pdb
    6059 
    6060 Summary of feedback from opening
    6061 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/37.4.pdb 
    6062 --- 
    6063 warnings | Ignored bad PDB record found on line 1 
    6064 REMARK GENERATED BY TRJCONV 
    6065  
    6066 Ignored bad PDB record found on line 3 
    6067 REMARK THIS IS A SIMULATION BOX 
    6068  
    6069 37.4.pdb title: 
    6070 Title t= 37400.00000 step= 18700000 [more info...] 
    6071  
    6072 Chain information for 37.4.pdb #188 
    6073 --- 
    6074 Chain | Description 
    6075 A B | No description available 
    6076  
    6077 Non-standard residues in 37.4.pdb #188 
    6078 --- 
    6079 HSD — (HSD) 
    6080 POT — (POT) 
    6081  
    6082 
    6083 > open
    6084 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/37.6.pdb
    6085 
    6086 Summary of feedback from opening
    6087 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/37.6.pdb 
    6088 --- 
    6089 warnings | Ignored bad PDB record found on line 1 
    6090 REMARK GENERATED BY TRJCONV 
    6091  
    6092 Ignored bad PDB record found on line 3 
    6093 REMARK THIS IS A SIMULATION BOX 
    6094  
    6095 37.6.pdb title: 
    6096 Title t= 37600.00000 step= 18800000 [more info...] 
    6097  
    6098 Chain information for 37.6.pdb #189 
    6099 --- 
    6100 Chain | Description 
    6101 A B | No description available 
    6102  
    6103 Non-standard residues in 37.6.pdb #189 
    6104 --- 
    6105 HSD — (HSD) 
    6106 POT — (POT) 
    6107  
    6108 
    6109 > open
    6110 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/37.8.pdb
    6111 
    6112 Summary of feedback from opening
    6113 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/37.8.pdb 
    6114 --- 
    6115 warnings | Ignored bad PDB record found on line 1 
    6116 REMARK GENERATED BY TRJCONV 
    6117  
    6118 Ignored bad PDB record found on line 3 
    6119 REMARK THIS IS A SIMULATION BOX 
    6120  
    6121 37.8.pdb title: 
    6122 Title t= 37800.00000 step= 18900000 [more info...] 
    6123  
    6124 Chain information for 37.8.pdb #190 
    6125 --- 
    6126 Chain | Description 
    6127 A B | No description available 
    6128  
    6129 Non-standard residues in 37.8.pdb #190 
    6130 --- 
    6131 HSD — (HSD) 
    6132 POT — (POT) 
    6133  
    6134 
    6135 > open
    6136 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/38.0.pdb
    6137 
    6138 Summary of feedback from opening
    6139 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/38.0.pdb 
    6140 --- 
    6141 warnings | Ignored bad PDB record found on line 1 
    6142 REMARK GENERATED BY TRJCONV 
    6143  
    6144 Ignored bad PDB record found on line 3 
    6145 REMARK THIS IS A SIMULATION BOX 
    6146  
    6147 38.0.pdb title: 
    6148 Title t= 38000.00000 step= 19000000 [more info...] 
    6149  
    6150 Chain information for 38.0.pdb #191 
    6151 --- 
    6152 Chain | Description 
    6153 A B | No description available 
    6154  
    6155 Non-standard residues in 38.0.pdb #191 
    6156 --- 
    6157 HSD — (HSD) 
    6158 POT — (POT) 
    6159  
    6160 
    6161 > open
    6162 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/38.2.pdb
    6163 
    6164 Summary of feedback from opening
    6165 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/38.2.pdb 
    6166 --- 
    6167 warnings | Ignored bad PDB record found on line 1 
    6168 REMARK GENERATED BY TRJCONV 
    6169  
    6170 Ignored bad PDB record found on line 3 
    6171 REMARK THIS IS A SIMULATION BOX 
    6172  
    6173 38.2.pdb title: 
    6174 Title t= 38200.00000 step= 19100000 [more info...] 
    6175  
    6176 Chain information for 38.2.pdb #192 
    6177 --- 
    6178 Chain | Description 
    6179 A B | No description available 
    6180  
    6181 Non-standard residues in 38.2.pdb #192 
    6182 --- 
    6183 HSD — (HSD) 
    6184 POT — (POT) 
    6185  
    6186 
    6187 > open
    6188 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/38.4.pdb
    6189 
    6190 Summary of feedback from opening
    6191 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/38.4.pdb 
    6192 --- 
    6193 warnings | Ignored bad PDB record found on line 1 
    6194 REMARK GENERATED BY TRJCONV 
    6195  
    6196 Ignored bad PDB record found on line 3 
    6197 REMARK THIS IS A SIMULATION BOX 
    6198  
    6199 38.4.pdb title: 
    6200 Title t= 38400.00000 step= 19200000 [more info...] 
    6201  
    6202 Chain information for 38.4.pdb #193 
    6203 --- 
    6204 Chain | Description 
    6205 A B | No description available 
    6206  
    6207 Non-standard residues in 38.4.pdb #193 
    6208 --- 
    6209 HSD — (HSD) 
    6210 POT — (POT) 
    6211  
    6212 
    6213 > open
    6214 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/38.6.pdb
    6215 
    6216 Summary of feedback from opening
    6217 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/38.6.pdb 
    6218 --- 
    6219 warnings | Ignored bad PDB record found on line 1 
    6220 REMARK GENERATED BY TRJCONV 
    6221  
    6222 Ignored bad PDB record found on line 3 
    6223 REMARK THIS IS A SIMULATION BOX 
    6224  
    6225 38.6.pdb title: 
    6226 Title t= 38600.00000 step= 19300000 [more info...] 
    6227  
    6228 Chain information for 38.6.pdb #194 
    6229 --- 
    6230 Chain | Description 
    6231 A B | No description available 
    6232  
    6233 Non-standard residues in 38.6.pdb #194 
    6234 --- 
    6235 HSD — (HSD) 
    6236 POT — (POT) 
    6237  
    6238 
    6239 > open
    6240 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/38.8.pdb
    6241 
    6242 Summary of feedback from opening
    6243 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/38.8.pdb 
    6244 --- 
    6245 warnings | Ignored bad PDB record found on line 1 
    6246 REMARK GENERATED BY TRJCONV 
    6247  
    6248 Ignored bad PDB record found on line 3 
    6249 REMARK THIS IS A SIMULATION BOX 
    6250  
    6251 38.8.pdb title: 
    6252 Title t= 38800.00000 step= 19400000 [more info...] 
    6253  
    6254 Chain information for 38.8.pdb #195 
    6255 --- 
    6256 Chain | Description 
    6257 A B | No description available 
    6258  
    6259 Non-standard residues in 38.8.pdb #195 
    6260 --- 
    6261 HSD — (HSD) 
    6262 POT — (POT) 
    6263  
    6264 
    6265 > open
    6266 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/39.0.pdb
    6267 
    6268 Summary of feedback from opening
    6269 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/39.0.pdb 
    6270 --- 
    6271 warnings | Ignored bad PDB record found on line 1 
    6272 REMARK GENERATED BY TRJCONV 
    6273  
    6274 Ignored bad PDB record found on line 3 
    6275 REMARK THIS IS A SIMULATION BOX 
    6276  
    6277 39.0.pdb title: 
    6278 Title t= 39000.00000 step= 19500000 [more info...] 
    6279  
    6280 Chain information for 39.0.pdb #196 
    6281 --- 
    6282 Chain | Description 
    6283 A B | No description available 
    6284  
    6285 Non-standard residues in 39.0.pdb #196 
    6286 --- 
    6287 HSD — (HSD) 
    6288 POT — (POT) 
    6289  
    6290 
    6291 > open
    6292 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/39.2.pdb
    6293 
    6294 Summary of feedback from opening
    6295 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/39.2.pdb 
    6296 --- 
    6297 warnings | Ignored bad PDB record found on line 1 
    6298 REMARK GENERATED BY TRJCONV 
    6299  
    6300 Ignored bad PDB record found on line 3 
    6301 REMARK THIS IS A SIMULATION BOX 
    6302  
    6303 39.2.pdb title: 
    6304 Title t= 39200.00000 step= 19600000 [more info...] 
    6305  
    6306 Chain information for 39.2.pdb #197 
    6307 --- 
    6308 Chain | Description 
    6309 A B | No description available 
    6310  
    6311 Non-standard residues in 39.2.pdb #197 
    6312 --- 
    6313 HSD — (HSD) 
    6314 POT — (POT) 
    6315  
    6316 
    6317 > open
    6318 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/39.4.pdb
    6319 
    6320 Summary of feedback from opening
    6321 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/39.4.pdb 
    6322 --- 
    6323 warnings | Ignored bad PDB record found on line 1 
    6324 REMARK GENERATED BY TRJCONV 
    6325  
    6326 Ignored bad PDB record found on line 3 
    6327 REMARK THIS IS A SIMULATION BOX 
    6328  
    6329 39.4.pdb title: 
    6330 Title t= 39400.00000 step= 19700000 [more info...] 
    6331  
    6332 Chain information for 39.4.pdb #198 
    6333 --- 
    6334 Chain | Description 
    6335 A B | No description available 
    6336  
    6337 Non-standard residues in 39.4.pdb #198 
    6338 --- 
    6339 HSD — (HSD) 
    6340 POT — (POT) 
    6341  
    6342 
    6343 > open
    6344 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/39.6.pdb
    6345 
    6346 Summary of feedback from opening
    6347 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/39.6.pdb 
    6348 --- 
    6349 warnings | Ignored bad PDB record found on line 1 
    6350 REMARK GENERATED BY TRJCONV 
    6351  
    6352 Ignored bad PDB record found on line 3 
    6353 REMARK THIS IS A SIMULATION BOX 
    6354  
    6355 39.6.pdb title: 
    6356 Title t= 39600.00000 step= 19800000 [more info...] 
    6357  
    6358 Chain information for 39.6.pdb #199 
    6359 --- 
    6360 Chain | Description 
    6361 A B | No description available 
    6362  
    6363 Non-standard residues in 39.6.pdb #199 
    6364 --- 
    6365 HSD — (HSD) 
    6366 POT — (POT) 
    6367  
    6368 
    6369 > open
    6370 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/39.8.pdb
    6371 
    6372 Summary of feedback from opening
    6373 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/39.8.pdb 
    6374 --- 
    6375 warnings | Ignored bad PDB record found on line 1 
    6376 REMARK GENERATED BY TRJCONV 
    6377  
    6378 Ignored bad PDB record found on line 3 
    6379 REMARK THIS IS A SIMULATION BOX 
    6380  
    6381 39.8.pdb title: 
    6382 Title t= 39800.00000 step= 19900000 [more info...] 
    6383  
    6384 Chain information for 39.8.pdb #200 
    6385 --- 
    6386 Chain | Description 
    6387 A B | No description available 
    6388  
    6389 Non-standard residues in 39.8.pdb #200 
    6390 --- 
    6391 HSD — (HSD) 
    6392 POT — (POT) 
    6393  
    6394 
    6395 > open
    6396 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/40.0.pdb
    6397 
    6398 Summary of feedback from opening
    6399 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/40.0.pdb 
    6400 --- 
    6401 warnings | Ignored bad PDB record found on line 1 
    6402 REMARK GENERATED BY TRJCONV 
    6403  
    6404 Ignored bad PDB record found on line 3 
    6405 REMARK THIS IS A SIMULATION BOX 
    6406  
    6407 40.0.pdb title: 
    6408 Title t= 40000.00000 step= 20000000 [more info...] 
    6409  
    6410 Chain information for 40.0.pdb #201 
    6411 --- 
    6412 Chain | Description 
    6413 A B | No description available 
    6414  
    6415 Non-standard residues in 40.0.pdb #201 
    6416 --- 
    6417 HSD — (HSD) 
    6418 POT — (POT) 
    6419  
    6420 
    6421 > open
    6422 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/40.2.pdb
    6423 
    6424 Summary of feedback from opening
    6425 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/40.2.pdb 
    6426 --- 
    6427 warnings | Ignored bad PDB record found on line 1 
    6428 REMARK GENERATED BY TRJCONV 
    6429  
    6430 Ignored bad PDB record found on line 3 
    6431 REMARK THIS IS A SIMULATION BOX 
    6432  
    6433 40.2.pdb title: 
    6434 Title t= 40200.00000 step= 20100000 [more info...] 
    6435  
    6436 Chain information for 40.2.pdb #202 
    6437 --- 
    6438 Chain | Description 
    6439 A B | No description available 
    6440  
    6441 Non-standard residues in 40.2.pdb #202 
    6442 --- 
    6443 HSD — (HSD) 
    6444 POT — (POT) 
    6445  
    6446 
    6447 > open
    6448 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/40.4.pdb
    6449 
    6450 Summary of feedback from opening
    6451 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/40.4.pdb 
    6452 --- 
    6453 warnings | Ignored bad PDB record found on line 1 
    6454 REMARK GENERATED BY TRJCONV 
    6455  
    6456 Ignored bad PDB record found on line 3 
    6457 REMARK THIS IS A SIMULATION BOX 
    6458  
    6459 40.4.pdb title: 
    6460 Title t= 40400.00000 step= 20200000 [more info...] 
    6461  
    6462 Chain information for 40.4.pdb #203 
    6463 --- 
    6464 Chain | Description 
    6465 A B | No description available 
    6466  
    6467 Non-standard residues in 40.4.pdb #203 
    6468 --- 
    6469 HSD — (HSD) 
    6470 POT — (POT) 
    6471  
    6472 
    6473 > open
    6474 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/40.6.pdb
    6475 
    6476 Summary of feedback from opening
    6477 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/40.6.pdb 
    6478 --- 
    6479 warnings | Ignored bad PDB record found on line 1 
    6480 REMARK GENERATED BY TRJCONV 
    6481  
    6482 Ignored bad PDB record found on line 3 
    6483 REMARK THIS IS A SIMULATION BOX 
    6484  
    6485 40.6.pdb title: 
    6486 Title t= 40600.00000 step= 20300000 [more info...] 
    6487  
    6488 Chain information for 40.6.pdb #204 
    6489 --- 
    6490 Chain | Description 
    6491 A B | No description available 
    6492  
    6493 Non-standard residues in 40.6.pdb #204 
    6494 --- 
    6495 HSD — (HSD) 
    6496 POT — (POT) 
    6497  
    6498 
    6499 > open
    6500 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/40.8.pdb
    6501 
    6502 Summary of feedback from opening
    6503 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/40.8.pdb 
    6504 --- 
    6505 warnings | Ignored bad PDB record found on line 1 
    6506 REMARK GENERATED BY TRJCONV 
    6507  
    6508 Ignored bad PDB record found on line 3 
    6509 REMARK THIS IS A SIMULATION BOX 
    6510  
    6511 40.8.pdb title: 
    6512 Title t= 40800.00000 step= 20400000 [more info...] 
    6513  
    6514 Chain information for 40.8.pdb #205 
    6515 --- 
    6516 Chain | Description 
    6517 A B | No description available 
    6518  
    6519 Non-standard residues in 40.8.pdb #205 
    6520 --- 
    6521 HSD — (HSD) 
    6522 POT — (POT) 
    6523  
    6524 
    6525 > open
    6526 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/41.0.pdb
    6527 
    6528 Summary of feedback from opening
    6529 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/41.0.pdb 
    6530 --- 
    6531 warnings | Ignored bad PDB record found on line 1 
    6532 REMARK GENERATED BY TRJCONV 
    6533  
    6534 Ignored bad PDB record found on line 3 
    6535 REMARK THIS IS A SIMULATION BOX 
    6536  
    6537 41.0.pdb title: 
    6538 Title t= 41000.00000 step= 20500000 [more info...] 
    6539  
    6540 Chain information for 41.0.pdb #206 
    6541 --- 
    6542 Chain | Description 
    6543 A B | No description available 
    6544  
    6545 Non-standard residues in 41.0.pdb #206 
    6546 --- 
    6547 HSD — (HSD) 
    6548 POT — (POT) 
    6549  
    6550 
    6551 > open
    6552 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/41.2.pdb
    6553 
    6554 Summary of feedback from opening
    6555 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/41.2.pdb 
    6556 --- 
    6557 warnings | Ignored bad PDB record found on line 1 
    6558 REMARK GENERATED BY TRJCONV 
    6559  
    6560 Ignored bad PDB record found on line 3 
    6561 REMARK THIS IS A SIMULATION BOX 
    6562  
    6563 41.2.pdb title: 
    6564 Title t= 41200.00000 step= 20600000 [more info...] 
    6565  
    6566 Chain information for 41.2.pdb #207 
    6567 --- 
    6568 Chain | Description 
    6569 A B | No description available 
    6570  
    6571 Non-standard residues in 41.2.pdb #207 
    6572 --- 
    6573 HSD — (HSD) 
    6574 POT — (POT) 
    6575  
    6576 
    6577 > open
    6578 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/41.4.pdb
    6579 
    6580 Summary of feedback from opening
    6581 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/41.4.pdb 
    6582 --- 
    6583 warnings | Ignored bad PDB record found on line 1 
    6584 REMARK GENERATED BY TRJCONV 
    6585  
    6586 Ignored bad PDB record found on line 3 
    6587 REMARK THIS IS A SIMULATION BOX 
    6588  
    6589 41.4.pdb title: 
    6590 Title t= 41400.00000 step= 20700000 [more info...] 
    6591  
    6592 Chain information for 41.4.pdb #208 
    6593 --- 
    6594 Chain | Description 
    6595 A B | No description available 
    6596  
    6597 Non-standard residues in 41.4.pdb #208 
    6598 --- 
    6599 HSD — (HSD) 
    6600 POT — (POT) 
    6601  
    6602 
    6603 > open
    6604 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/41.6.pdb
    6605 
    6606 Summary of feedback from opening
    6607 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/41.6.pdb 
    6608 --- 
    6609 warnings | Ignored bad PDB record found on line 1 
    6610 REMARK GENERATED BY TRJCONV 
    6611  
    6612 Ignored bad PDB record found on line 3 
    6613 REMARK THIS IS A SIMULATION BOX 
    6614  
    6615 41.6.pdb title: 
    6616 Title t= 41600.00000 step= 20800000 [more info...] 
    6617  
    6618 Chain information for 41.6.pdb #209 
    6619 --- 
    6620 Chain | Description 
    6621 A B | No description available 
    6622  
    6623 Non-standard residues in 41.6.pdb #209 
    6624 --- 
    6625 HSD — (HSD) 
    6626 POT — (POT) 
    6627  
    6628 
    6629 > open
    6630 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/41.8.pdb
    6631 
    6632 Summary of feedback from opening
    6633 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/41.8.pdb 
    6634 --- 
    6635 warnings | Ignored bad PDB record found on line 1 
    6636 REMARK GENERATED BY TRJCONV 
    6637  
    6638 Ignored bad PDB record found on line 3 
    6639 REMARK THIS IS A SIMULATION BOX 
    6640  
    6641 41.8.pdb title: 
    6642 Title t= 41800.00000 step= 20900000 [more info...] 
    6643  
    6644 Chain information for 41.8.pdb #210 
    6645 --- 
    6646 Chain | Description 
    6647 A B | No description available 
    6648  
    6649 Non-standard residues in 41.8.pdb #210 
    6650 --- 
    6651 HSD — (HSD) 
    6652 POT — (POT) 
    6653  
    6654 
    6655 > open
    6656 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/42.0.pdb
    6657 
    6658 Summary of feedback from opening
    6659 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/42.0.pdb 
    6660 --- 
    6661 warnings | Ignored bad PDB record found on line 1 
    6662 REMARK GENERATED BY TRJCONV 
    6663  
    6664 Ignored bad PDB record found on line 3 
    6665 REMARK THIS IS A SIMULATION BOX 
    6666  
    6667 42.0.pdb title: 
    6668 Title t= 42000.00000 step= 21000000 [more info...] 
    6669  
    6670 Chain information for 42.0.pdb #211 
    6671 --- 
    6672 Chain | Description 
    6673 A B | No description available 
    6674  
    6675 Non-standard residues in 42.0.pdb #211 
    6676 --- 
    6677 HSD — (HSD) 
    6678 POT — (POT) 
    6679  
    6680 
    6681 > open
    6682 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/42.2.pdb
    6683 
    6684 Summary of feedback from opening
    6685 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/42.2.pdb 
    6686 --- 
    6687 warnings | Ignored bad PDB record found on line 1 
    6688 REMARK GENERATED BY TRJCONV 
    6689  
    6690 Ignored bad PDB record found on line 3 
    6691 REMARK THIS IS A SIMULATION BOX 
    6692  
    6693 42.2.pdb title: 
    6694 Title t= 42200.00000 step= 21100000 [more info...] 
    6695  
    6696 Chain information for 42.2.pdb #212 
    6697 --- 
    6698 Chain | Description 
    6699 A B | No description available 
    6700  
    6701 Non-standard residues in 42.2.pdb #212 
    6702 --- 
    6703 HSD — (HSD) 
    6704 POT — (POT) 
    6705  
    6706 
    6707 > open
    6708 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/42.4.pdb
    6709 
    6710 Summary of feedback from opening
    6711 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/42.4.pdb 
    6712 --- 
    6713 warnings | Ignored bad PDB record found on line 1 
    6714 REMARK GENERATED BY TRJCONV 
    6715  
    6716 Ignored bad PDB record found on line 3 
    6717 REMARK THIS IS A SIMULATION BOX 
    6718  
    6719 42.4.pdb title: 
    6720 Title t= 42400.00000 step= 21200000 [more info...] 
    6721  
    6722 Chain information for 42.4.pdb #213 
    6723 --- 
    6724 Chain | Description 
    6725 A B | No description available 
    6726  
    6727 Non-standard residues in 42.4.pdb #213 
    6728 --- 
    6729 HSD — (HSD) 
    6730 POT — (POT) 
    6731  
    6732 
    6733 > open
    6734 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/42.6.pdb
    6735 
    6736 Summary of feedback from opening
    6737 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/42.6.pdb 
    6738 --- 
    6739 warnings | Ignored bad PDB record found on line 1 
    6740 REMARK GENERATED BY TRJCONV 
    6741  
    6742 Ignored bad PDB record found on line 3 
    6743 REMARK THIS IS A SIMULATION BOX 
    6744  
    6745 42.6.pdb title: 
    6746 Title t= 42600.00000 step= 21300000 [more info...] 
    6747  
    6748 Chain information for 42.6.pdb #214 
    6749 --- 
    6750 Chain | Description 
    6751 A B | No description available 
    6752  
    6753 Non-standard residues in 42.6.pdb #214 
    6754 --- 
    6755 HSD — (HSD) 
    6756 POT — (POT) 
    6757  
    6758 
    6759 > open
    6760 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/42.8.pdb
    6761 
    6762 Summary of feedback from opening
    6763 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/42.8.pdb 
    6764 --- 
    6765 warnings | Ignored bad PDB record found on line 1 
    6766 REMARK GENERATED BY TRJCONV 
    6767  
    6768 Ignored bad PDB record found on line 3 
    6769 REMARK THIS IS A SIMULATION BOX 
    6770  
    6771 42.8.pdb title: 
    6772 Title t= 42800.00000 step= 21400000 [more info...] 
    6773  
    6774 Chain information for 42.8.pdb #215 
    6775 --- 
    6776 Chain | Description 
    6777 A B | No description available 
    6778  
    6779 Non-standard residues in 42.8.pdb #215 
    6780 --- 
    6781 HSD — (HSD) 
    6782 POT — (POT) 
    6783  
    6784 
    6785 > open
    6786 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/43.0.pdb
    6787 
    6788 Summary of feedback from opening
    6789 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/43.0.pdb 
    6790 --- 
    6791 warnings | Ignored bad PDB record found on line 1 
    6792 REMARK GENERATED BY TRJCONV 
    6793  
    6794 Ignored bad PDB record found on line 3 
    6795 REMARK THIS IS A SIMULATION BOX 
    6796  
    6797 43.0.pdb title: 
    6798 Title t= 43000.00000 step= 21500000 [more info...] 
    6799  
    6800 Chain information for 43.0.pdb #216 
    6801 --- 
    6802 Chain | Description 
    6803 A B | No description available 
    6804  
    6805 Non-standard residues in 43.0.pdb #216 
    6806 --- 
    6807 HSD — (HSD) 
    6808 POT — (POT) 
    6809  
    6810 
    6811 > open
    6812 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/43.2.pdb
    6813 
    6814 Summary of feedback from opening
    6815 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/43.2.pdb 
    6816 --- 
    6817 warnings | Ignored bad PDB record found on line 1 
    6818 REMARK GENERATED BY TRJCONV 
    6819  
    6820 Ignored bad PDB record found on line 3 
    6821 REMARK THIS IS A SIMULATION BOX 
    6822  
    6823 43.2.pdb title: 
    6824 Title t= 43200.00000 step= 21600000 [more info...] 
    6825  
    6826 Chain information for 43.2.pdb #217 
    6827 --- 
    6828 Chain | Description 
    6829 A B | No description available 
    6830  
    6831 Non-standard residues in 43.2.pdb #217 
    6832 --- 
    6833 HSD — (HSD) 
    6834 POT — (POT) 
    6835  
    6836 
    6837 > open
    6838 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/43.4.pdb
    6839 
    6840 Summary of feedback from opening
    6841 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/43.4.pdb 
    6842 --- 
    6843 warnings | Ignored bad PDB record found on line 1 
    6844 REMARK GENERATED BY TRJCONV 
    6845  
    6846 Ignored bad PDB record found on line 3 
    6847 REMARK THIS IS A SIMULATION BOX 
    6848  
    6849 43.4.pdb title: 
    6850 Title t= 43400.00000 step= 21700000 [more info...] 
    6851  
    6852 Chain information for 43.4.pdb #218 
    6853 --- 
    6854 Chain | Description 
    6855 A B | No description available 
    6856  
    6857 Non-standard residues in 43.4.pdb #218 
    6858 --- 
    6859 HSD — (HSD) 
    6860 POT — (POT) 
    6861  
    6862 
    6863 > open
    6864 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/43.6.pdb
    6865 
    6866 Summary of feedback from opening
    6867 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/43.6.pdb 
    6868 --- 
    6869 warnings | Ignored bad PDB record found on line 1 
    6870 REMARK GENERATED BY TRJCONV 
    6871  
    6872 Ignored bad PDB record found on line 3 
    6873 REMARK THIS IS A SIMULATION BOX 
    6874  
    6875 43.6.pdb title: 
    6876 Title t= 43600.00000 step= 21800000 [more info...] 
    6877  
    6878 Chain information for 43.6.pdb #219 
    6879 --- 
    6880 Chain | Description 
    6881 A B | No description available 
    6882  
    6883 Non-standard residues in 43.6.pdb #219 
    6884 --- 
    6885 HSD — (HSD) 
    6886 POT — (POT) 
    6887  
    6888 
    6889 > open
    6890 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/43.8.pdb
    6891 
    6892 Summary of feedback from opening
    6893 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/43.8.pdb 
    6894 --- 
    6895 warnings | Ignored bad PDB record found on line 1 
    6896 REMARK GENERATED BY TRJCONV 
    6897  
    6898 Ignored bad PDB record found on line 3 
    6899 REMARK THIS IS A SIMULATION BOX 
    6900  
    6901 43.8.pdb title: 
    6902 Title t= 43800.00000 step= 21900000 [more info...] 
    6903  
    6904 Chain information for 43.8.pdb #220 
    6905 --- 
    6906 Chain | Description 
    6907 A B | No description available 
    6908  
    6909 Non-standard residues in 43.8.pdb #220 
    6910 --- 
    6911 HSD — (HSD) 
    6912 POT — (POT) 
    6913  
    6914 
    6915 > open
    6916 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/44.0.pdb
    6917 
    6918 Summary of feedback from opening
    6919 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/44.0.pdb 
    6920 --- 
    6921 warnings | Ignored bad PDB record found on line 1 
    6922 REMARK GENERATED BY TRJCONV 
    6923  
    6924 Ignored bad PDB record found on line 3 
    6925 REMARK THIS IS A SIMULATION BOX 
    6926  
    6927 44.0.pdb title: 
    6928 Title t= 44000.00000 step= 22000000 [more info...] 
    6929  
    6930 Chain information for 44.0.pdb #221 
    6931 --- 
    6932 Chain | Description 
    6933 A B | No description available 
    6934  
    6935 Non-standard residues in 44.0.pdb #221 
    6936 --- 
    6937 HSD — (HSD) 
    6938 POT — (POT) 
    6939  
    6940 
    6941 > open
    6942 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/44.2.pdb
    6943 
    6944 Summary of feedback from opening
    6945 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/44.2.pdb 
    6946 --- 
    6947 warnings | Ignored bad PDB record found on line 1 
    6948 REMARK GENERATED BY TRJCONV 
    6949  
    6950 Ignored bad PDB record found on line 3 
    6951 REMARK THIS IS A SIMULATION BOX 
    6952  
    6953 44.2.pdb title: 
    6954 Title t= 44200.00000 step= 22100000 [more info...] 
    6955  
    6956 Chain information for 44.2.pdb #222 
    6957 --- 
    6958 Chain | Description 
    6959 A B | No description available 
    6960  
    6961 Non-standard residues in 44.2.pdb #222 
    6962 --- 
    6963 HSD — (HSD) 
    6964 POT — (POT) 
    6965  
    6966 
    6967 > open
    6968 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/44.4.pdb
    6969 
    6970 Summary of feedback from opening
    6971 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/44.4.pdb 
    6972 --- 
    6973 warnings | Ignored bad PDB record found on line 1 
    6974 REMARK GENERATED BY TRJCONV 
    6975  
    6976 Ignored bad PDB record found on line 3 
    6977 REMARK THIS IS A SIMULATION BOX 
    6978  
    6979 44.4.pdb title: 
    6980 Title t= 44400.00000 step= 22200000 [more info...] 
    6981  
    6982 Chain information for 44.4.pdb #223 
    6983 --- 
    6984 Chain | Description 
    6985 A B | No description available 
    6986  
    6987 Non-standard residues in 44.4.pdb #223 
    6988 --- 
    6989 HSD — (HSD) 
    6990 POT — (POT) 
    6991  
    6992 
    6993 > open
    6994 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/44.6.pdb
    6995 
    6996 Summary of feedback from opening
    6997 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/44.6.pdb 
    6998 --- 
    6999 warnings | Ignored bad PDB record found on line 1 
    7000 REMARK GENERATED BY TRJCONV 
    7001  
    7002 Ignored bad PDB record found on line 3 
    7003 REMARK THIS IS A SIMULATION BOX 
    7004  
    7005 44.6.pdb title: 
    7006 Title t= 44600.00000 step= 22300000 [more info...] 
    7007  
    7008 Chain information for 44.6.pdb #224 
    7009 --- 
    7010 Chain | Description 
    7011 A B | No description available 
    7012  
    7013 Non-standard residues in 44.6.pdb #224 
    7014 --- 
    7015 HSD — (HSD) 
    7016 POT — (POT) 
    7017  
    7018 
    7019 > open
    7020 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/44.8.pdb
    7021 
    7022 Summary of feedback from opening
    7023 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/44.8.pdb 
    7024 --- 
    7025 warnings | Ignored bad PDB record found on line 1 
    7026 REMARK GENERATED BY TRJCONV 
    7027  
    7028 Ignored bad PDB record found on line 3 
    7029 REMARK THIS IS A SIMULATION BOX 
    7030  
    7031 44.8.pdb title: 
    7032 Title t= 44800.00000 step= 22400000 [more info...] 
    7033  
    7034 Chain information for 44.8.pdb #225 
    7035 --- 
    7036 Chain | Description 
    7037 A B | No description available 
    7038  
    7039 Non-standard residues in 44.8.pdb #225 
    7040 --- 
    7041 HSD — (HSD) 
    7042 POT — (POT) 
    7043  
    7044 
    7045 > open
    7046 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/45.0.pdb
    7047 
    7048 Summary of feedback from opening
    7049 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/45.0.pdb 
    7050 --- 
    7051 warnings | Ignored bad PDB record found on line 1 
    7052 REMARK GENERATED BY TRJCONV 
    7053  
    7054 Ignored bad PDB record found on line 3 
    7055 REMARK THIS IS A SIMULATION BOX 
    7056  
    7057 45.0.pdb title: 
    7058 Title t= 45000.00000 step= 22500000 [more info...] 
    7059  
    7060 Chain information for 45.0.pdb #226 
    7061 --- 
    7062 Chain | Description 
    7063 A B | No description available 
    7064  
    7065 Non-standard residues in 45.0.pdb #226 
    7066 --- 
    7067 HSD — (HSD) 
    7068 POT — (POT) 
    7069  
    7070 
    7071 > open
    7072 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/45.2.pdb
    7073 
    7074 Summary of feedback from opening
    7075 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/45.2.pdb 
    7076 --- 
    7077 warnings | Ignored bad PDB record found on line 1 
    7078 REMARK GENERATED BY TRJCONV 
    7079  
    7080 Ignored bad PDB record found on line 3 
    7081 REMARK THIS IS A SIMULATION BOX 
    7082  
    7083 45.2.pdb title: 
    7084 Title t= 45200.00000 step= 22600000 [more info...] 
    7085  
    7086 Chain information for 45.2.pdb #227 
    7087 --- 
    7088 Chain | Description 
    7089 A B | No description available 
    7090  
    7091 Non-standard residues in 45.2.pdb #227 
    7092 --- 
    7093 HSD — (HSD) 
    7094 POT — (POT) 
    7095  
    7096 
    7097 > open
    7098 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/45.4.pdb
    7099 
    7100 Summary of feedback from opening
    7101 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/45.4.pdb 
    7102 --- 
    7103 warnings | Ignored bad PDB record found on line 1 
    7104 REMARK GENERATED BY TRJCONV 
    7105  
    7106 Ignored bad PDB record found on line 3 
    7107 REMARK THIS IS A SIMULATION BOX 
    7108  
    7109 45.4.pdb title: 
    7110 Title t= 45400.00000 step= 22700000 [more info...] 
    7111  
    7112 Chain information for 45.4.pdb #228 
    7113 --- 
    7114 Chain | Description 
    7115 A B | No description available 
    7116  
    7117 Non-standard residues in 45.4.pdb #228 
    7118 --- 
    7119 HSD — (HSD) 
    7120 POT — (POT) 
    7121  
    7122 
    7123 > open
    7124 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/45.6.pdb
    7125 
    7126 Summary of feedback from opening
    7127 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/45.6.pdb 
    7128 --- 
    7129 warnings | Ignored bad PDB record found on line 1 
    7130 REMARK GENERATED BY TRJCONV 
    7131  
    7132 Ignored bad PDB record found on line 3 
    7133 REMARK THIS IS A SIMULATION BOX 
    7134  
    7135 45.6.pdb title: 
    7136 Title t= 45600.00000 step= 22800000 [more info...] 
    7137  
    7138 Chain information for 45.6.pdb #229 
    7139 --- 
    7140 Chain | Description 
    7141 A B | No description available 
    7142  
    7143 Non-standard residues in 45.6.pdb #229 
    7144 --- 
    7145 HSD — (HSD) 
    7146 POT — (POT) 
    7147  
    7148 
    7149 > open
    7150 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/45.8.pdb
    7151 
    7152 Summary of feedback from opening
    7153 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/45.8.pdb 
    7154 --- 
    7155 warnings | Ignored bad PDB record found on line 1 
    7156 REMARK GENERATED BY TRJCONV 
    7157  
    7158 Ignored bad PDB record found on line 3 
    7159 REMARK THIS IS A SIMULATION BOX 
    7160  
    7161 45.8.pdb title: 
    7162 Title t= 45800.00000 step= 22900000 [more info...] 
    7163  
    7164 Chain information for 45.8.pdb #230 
    7165 --- 
    7166 Chain | Description 
    7167 A B | No description available 
    7168  
    7169 Non-standard residues in 45.8.pdb #230 
    7170 --- 
    7171 HSD — (HSD) 
    7172 POT — (POT) 
    7173  
    7174 
    7175 > open
    7176 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/46.0.pdb
    7177 
    7178 Summary of feedback from opening
    7179 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/46.0.pdb 
    7180 --- 
    7181 warnings | Ignored bad PDB record found on line 1 
    7182 REMARK GENERATED BY TRJCONV 
    7183  
    7184 Ignored bad PDB record found on line 3 
    7185 REMARK THIS IS A SIMULATION BOX 
    7186  
    7187 46.0.pdb title: 
    7188 Title t= 46000.00000 step= 23000000 [more info...] 
    7189  
    7190 Chain information for 46.0.pdb #231 
    7191 --- 
    7192 Chain | Description 
    7193 A B | No description available 
    7194  
    7195 Non-standard residues in 46.0.pdb #231 
    7196 --- 
    7197 HSD — (HSD) 
    7198 POT — (POT) 
    7199  
    7200 
    7201 > open
    7202 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/46.2.pdb
    7203 
    7204 Summary of feedback from opening
    7205 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/46.2.pdb 
    7206 --- 
    7207 warnings | Ignored bad PDB record found on line 1 
    7208 REMARK GENERATED BY TRJCONV 
    7209  
    7210 Ignored bad PDB record found on line 3 
    7211 REMARK THIS IS A SIMULATION BOX 
    7212  
    7213 46.2.pdb title: 
    7214 Title t= 46200.00000 step= 23100000 [more info...] 
    7215  
    7216 Chain information for 46.2.pdb #232 
    7217 --- 
    7218 Chain | Description 
    7219 A B | No description available 
    7220  
    7221 Non-standard residues in 46.2.pdb #232 
    7222 --- 
    7223 HSD — (HSD) 
    7224 POT — (POT) 
    7225  
    7226 
    7227 > open
    7228 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/46.4.pdb
    7229 
    7230 Summary of feedback from opening
    7231 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/46.4.pdb 
    7232 --- 
    7233 warnings | Ignored bad PDB record found on line 1 
    7234 REMARK GENERATED BY TRJCONV 
    7235  
    7236 Ignored bad PDB record found on line 3 
    7237 REMARK THIS IS A SIMULATION BOX 
    7238  
    7239 46.4.pdb title: 
    7240 Title t= 46400.00000 step= 23200000 [more info...] 
    7241  
    7242 Chain information for 46.4.pdb #233 
    7243 --- 
    7244 Chain | Description 
    7245 A B | No description available 
    7246  
    7247 Non-standard residues in 46.4.pdb #233 
    7248 --- 
    7249 HSD — (HSD) 
    7250 POT — (POT) 
    7251  
    7252 
    7253 > open
    7254 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/46.6.pdb
    7255 
    7256 Summary of feedback from opening
    7257 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/46.6.pdb 
    7258 --- 
    7259 warnings | Ignored bad PDB record found on line 1 
    7260 REMARK GENERATED BY TRJCONV 
    7261  
    7262 Ignored bad PDB record found on line 3 
    7263 REMARK THIS IS A SIMULATION BOX 
    7264  
    7265 46.6.pdb title: 
    7266 Title t= 46600.00000 step= 23300000 [more info...] 
    7267  
    7268 Chain information for 46.6.pdb #234 
    7269 --- 
    7270 Chain | Description 
    7271 A B | No description available 
    7272  
    7273 Non-standard residues in 46.6.pdb #234 
    7274 --- 
    7275 HSD — (HSD) 
    7276 POT — (POT) 
    7277  
    7278 
    7279 > open
    7280 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/46.8.pdb
    7281 
    7282 Summary of feedback from opening
    7283 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/46.8.pdb 
    7284 --- 
    7285 warnings | Ignored bad PDB record found on line 1 
    7286 REMARK GENERATED BY TRJCONV 
    7287  
    7288 Ignored bad PDB record found on line 3 
    7289 REMARK THIS IS A SIMULATION BOX 
    7290  
    7291 46.8.pdb title: 
    7292 Title t= 46800.00000 step= 23400000 [more info...] 
    7293  
    7294 Chain information for 46.8.pdb #235 
    7295 --- 
    7296 Chain | Description 
    7297 A B | No description available 
    7298  
    7299 Non-standard residues in 46.8.pdb #235 
    7300 --- 
    7301 HSD — (HSD) 
    7302 POT — (POT) 
    7303  
    7304 
    7305 > open
    7306 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/47.0.pdb
    7307 
    7308 Summary of feedback from opening
    7309 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/47.0.pdb 
    7310 --- 
    7311 warnings | Ignored bad PDB record found on line 1 
    7312 REMARK GENERATED BY TRJCONV 
    7313  
    7314 Ignored bad PDB record found on line 3 
    7315 REMARK THIS IS A SIMULATION BOX 
    7316  
    7317 47.0.pdb title: 
    7318 Title t= 47000.00000 step= 23500000 [more info...] 
    7319  
    7320 Chain information for 47.0.pdb #236 
    7321 --- 
    7322 Chain | Description 
    7323 A B | No description available 
    7324  
    7325 Non-standard residues in 47.0.pdb #236 
    7326 --- 
    7327 HSD — (HSD) 
    7328 POT — (POT) 
    7329  
    7330 
    7331 > open
    7332 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/47.2.pdb
    7333 
    7334 Summary of feedback from opening
    7335 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/47.2.pdb 
    7336 --- 
    7337 warnings | Ignored bad PDB record found on line 1 
    7338 REMARK GENERATED BY TRJCONV 
    7339  
    7340 Ignored bad PDB record found on line 3 
    7341 REMARK THIS IS A SIMULATION BOX 
    7342  
    7343 47.2.pdb title: 
    7344 Title t= 47200.00000 step= 23600000 [more info...] 
    7345  
    7346 Chain information for 47.2.pdb #237 
    7347 --- 
    7348 Chain | Description 
    7349 A B | No description available 
    7350  
    7351 Non-standard residues in 47.2.pdb #237 
    7352 --- 
    7353 HSD — (HSD) 
    7354 POT — (POT) 
    7355  
    7356 
    7357 > open
    7358 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/47.4.pdb
    7359 
    7360 Summary of feedback from opening
    7361 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/47.4.pdb 
    7362 --- 
    7363 warnings | Ignored bad PDB record found on line 1 
    7364 REMARK GENERATED BY TRJCONV 
    7365  
    7366 Ignored bad PDB record found on line 3 
    7367 REMARK THIS IS A SIMULATION BOX 
    7368  
    7369 47.4.pdb title: 
    7370 Title t= 47400.00000 step= 23700000 [more info...] 
    7371  
    7372 Chain information for 47.4.pdb #238 
    7373 --- 
    7374 Chain | Description 
    7375 A B | No description available 
    7376  
    7377 Non-standard residues in 47.4.pdb #238 
    7378 --- 
    7379 HSD — (HSD) 
    7380 POT — (POT) 
    7381  
    7382 
    7383 > open
    7384 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/47.6.pdb
    7385 
    7386 Summary of feedback from opening
    7387 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/47.6.pdb 
    7388 --- 
    7389 warnings | Ignored bad PDB record found on line 1 
    7390 REMARK GENERATED BY TRJCONV 
    7391  
    7392 Ignored bad PDB record found on line 3 
    7393 REMARK THIS IS A SIMULATION BOX 
    7394  
    7395 47.6.pdb title: 
    7396 Title t= 47600.00000 step= 23800000 [more info...] 
    7397  
    7398 Chain information for 47.6.pdb #239 
    7399 --- 
    7400 Chain | Description 
    7401 A B | No description available 
    7402  
    7403 Non-standard residues in 47.6.pdb #239 
    7404 --- 
    7405 HSD — (HSD) 
    7406 POT — (POT) 
    7407  
    7408 
    7409 > open
    7410 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/47.8.pdb
    7411 
    7412 Summary of feedback from opening
    7413 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/47.8.pdb 
    7414 --- 
    7415 warnings | Ignored bad PDB record found on line 1 
    7416 REMARK GENERATED BY TRJCONV 
    7417  
    7418 Ignored bad PDB record found on line 3 
    7419 REMARK THIS IS A SIMULATION BOX 
    7420  
    7421 47.8.pdb title: 
    7422 Title t= 47800.00000 step= 23900000 [more info...] 
    7423  
    7424 Chain information for 47.8.pdb #240 
    7425 --- 
    7426 Chain | Description 
    7427 A B | No description available 
    7428  
    7429 Non-standard residues in 47.8.pdb #240 
    7430 --- 
    7431 HSD — (HSD) 
    7432 POT — (POT) 
    7433  
    7434 
    7435 > open
    7436 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/48.0.pdb
    7437 
    7438 Summary of feedback from opening
    7439 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/48.0.pdb 
    7440 --- 
    7441 warnings | Ignored bad PDB record found on line 1 
    7442 REMARK GENERATED BY TRJCONV 
    7443  
    7444 Ignored bad PDB record found on line 3 
    7445 REMARK THIS IS A SIMULATION BOX 
    7446  
    7447 48.0.pdb title: 
    7448 Title t= 48000.00000 step= 24000000 [more info...] 
    7449  
    7450 Chain information for 48.0.pdb #241 
    7451 --- 
    7452 Chain | Description 
    7453 A B | No description available 
    7454  
    7455 Non-standard residues in 48.0.pdb #241 
    7456 --- 
    7457 HSD — (HSD) 
    7458 POT — (POT) 
    7459  
    7460 
    7461 > open
    7462 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/48.2.pdb
    7463 
    7464 Summary of feedback from opening
    7465 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/48.2.pdb 
    7466 --- 
    7467 warnings | Ignored bad PDB record found on line 1 
    7468 REMARK GENERATED BY TRJCONV 
    7469  
    7470 Ignored bad PDB record found on line 3 
    7471 REMARK THIS IS A SIMULATION BOX 
    7472  
    7473 48.2.pdb title: 
    7474 Title t= 48200.00000 step= 24100000 [more info...] 
    7475  
    7476 Chain information for 48.2.pdb #242 
    7477 --- 
    7478 Chain | Description 
    7479 A B | No description available 
    7480  
    7481 Non-standard residues in 48.2.pdb #242 
    7482 --- 
    7483 HSD — (HSD) 
    7484 POT — (POT) 
    7485  
    7486 
    7487 > open
    7488 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/48.4.pdb
    7489 
    7490 Summary of feedback from opening
    7491 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/48.4.pdb 
    7492 --- 
    7493 warnings | Ignored bad PDB record found on line 1 
    7494 REMARK GENERATED BY TRJCONV 
    7495  
    7496 Ignored bad PDB record found on line 3 
    7497 REMARK THIS IS A SIMULATION BOX 
    7498  
    7499 48.4.pdb title: 
    7500 Title t= 48400.00000 step= 24200000 [more info...] 
    7501  
    7502 Chain information for 48.4.pdb #243 
    7503 --- 
    7504 Chain | Description 
    7505 A B | No description available 
    7506  
    7507 Non-standard residues in 48.4.pdb #243 
    7508 --- 
    7509 HSD — (HSD) 
    7510 POT — (POT) 
    7511  
    7512 
    7513 > open
    7514 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/48.6.pdb
    7515 
    7516 Summary of feedback from opening
    7517 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/48.6.pdb 
    7518 --- 
    7519 warnings | Ignored bad PDB record found on line 1 
    7520 REMARK GENERATED BY TRJCONV 
    7521  
    7522 Ignored bad PDB record found on line 3 
    7523 REMARK THIS IS A SIMULATION BOX 
    7524  
    7525 48.6.pdb title: 
    7526 Title t= 48600.00000 step= 24300000 [more info...] 
    7527  
    7528 Chain information for 48.6.pdb #244 
    7529 --- 
    7530 Chain | Description 
    7531 A B | No description available 
    7532  
    7533 Non-standard residues in 48.6.pdb #244 
    7534 --- 
    7535 HSD — (HSD) 
    7536 POT — (POT) 
    7537  
    7538 
    7539 > open
    7540 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/48.8.pdb
    7541 
    7542 Summary of feedback from opening
    7543 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/48.8.pdb 
    7544 --- 
    7545 warnings | Ignored bad PDB record found on line 1 
    7546 REMARK GENERATED BY TRJCONV 
    7547  
    7548 Ignored bad PDB record found on line 3 
    7549 REMARK THIS IS A SIMULATION BOX 
    7550  
    7551 48.8.pdb title: 
    7552 Title t= 48800.00000 step= 24400000 [more info...] 
    7553  
    7554 Chain information for 48.8.pdb #245 
    7555 --- 
    7556 Chain | Description 
    7557 A B | No description available 
    7558  
    7559 Non-standard residues in 48.8.pdb #245 
    7560 --- 
    7561 HSD — (HSD) 
    7562 POT — (POT) 
    7563  
    7564 
    7565 > open
    7566 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/49.0.pdb
    7567 
    7568 Summary of feedback from opening
    7569 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/49.0.pdb 
    7570 --- 
    7571 warnings | Ignored bad PDB record found on line 1 
    7572 REMARK GENERATED BY TRJCONV 
    7573  
    7574 Ignored bad PDB record found on line 3 
    7575 REMARK THIS IS A SIMULATION BOX 
    7576  
    7577 49.0.pdb title: 
    7578 Title t= 49000.00000 step= 24500000 [more info...] 
    7579  
    7580 Chain information for 49.0.pdb #246 
    7581 --- 
    7582 Chain | Description 
    7583 A B | No description available 
    7584  
    7585 Non-standard residues in 49.0.pdb #246 
    7586 --- 
    7587 HSD — (HSD) 
    7588 POT — (POT) 
    7589  
    7590 
    7591 > open
    7592 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/49.2.pdb
    7593 
    7594 Summary of feedback from opening
    7595 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/49.2.pdb 
    7596 --- 
    7597 warnings | Ignored bad PDB record found on line 1 
    7598 REMARK GENERATED BY TRJCONV 
    7599  
    7600 Ignored bad PDB record found on line 3 
    7601 REMARK THIS IS A SIMULATION BOX 
    7602  
    7603 49.2.pdb title: 
    7604 Title t= 49200.00000 step= 24600000 [more info...] 
    7605  
    7606 Chain information for 49.2.pdb #247 
    7607 --- 
    7608 Chain | Description 
    7609 A B | No description available 
    7610  
    7611 Non-standard residues in 49.2.pdb #247 
    7612 --- 
    7613 HSD — (HSD) 
    7614 POT — (POT) 
    7615  
    7616 
    7617 > open
    7618 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/49.4.pdb
    7619 
    7620 Summary of feedback from opening
    7621 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/49.4.pdb 
    7622 --- 
    7623 warnings | Ignored bad PDB record found on line 1 
    7624 REMARK GENERATED BY TRJCONV 
    7625  
    7626 Ignored bad PDB record found on line 3 
    7627 REMARK THIS IS A SIMULATION BOX 
    7628  
    7629 49.4.pdb title: 
    7630 Title t= 49400.00000 step= 24700000 [more info...] 
    7631  
    7632 Chain information for 49.4.pdb #248 
    7633 --- 
    7634 Chain | Description 
    7635 A B | No description available 
    7636  
    7637 Non-standard residues in 49.4.pdb #248 
    7638 --- 
    7639 HSD — (HSD) 
    7640 POT — (POT) 
    7641  
    7642 
    7643 > open
    7644 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/49.6.pdb
    7645 
    7646 Summary of feedback from opening
    7647 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/49.6.pdb 
    7648 --- 
    7649 warnings | Ignored bad PDB record found on line 1 
    7650 REMARK GENERATED BY TRJCONV 
    7651  
    7652 Ignored bad PDB record found on line 3 
    7653 REMARK THIS IS A SIMULATION BOX 
    7654  
    7655 49.6.pdb title: 
    7656 Title t= 49600.00000 step= 24800000 [more info...] 
    7657  
    7658 Chain information for 49.6.pdb #249 
    7659 --- 
    7660 Chain | Description 
    7661 A B | No description available 
    7662  
    7663 Non-standard residues in 49.6.pdb #249 
    7664 --- 
    7665 HSD — (HSD) 
    7666 POT — (POT) 
    7667  
    7668 
    7669 > open
    7670 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/49.8.pdb
    7671 
    7672 Summary of feedback from opening
    7673 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/49.8.pdb 
    7674 --- 
    7675 warnings | Ignored bad PDB record found on line 1 
    7676 REMARK GENERATED BY TRJCONV 
    7677  
    7678 Ignored bad PDB record found on line 3 
    7679 REMARK THIS IS A SIMULATION BOX 
    7680  
    7681 49.8.pdb title: 
    7682 Title t= 49800.00000 step= 24900000 [more info...] 
    7683  
    7684 Chain information for 49.8.pdb #250 
    7685 --- 
    7686 Chain | Description 
    7687 A B | No description available 
    7688  
    7689 Non-standard residues in 49.8.pdb #250 
    7690 --- 
    7691 HSD — (HSD) 
    7692 POT — (POT) 
    7693  
    7694 
    7695 > open
    7696 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/50.0.pdb
    7697 
    7698 Summary of feedback from opening
    7699 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/50.0.pdb 
    7700 --- 
    7701 warnings | Ignored bad PDB record found on line 1 
    7702 REMARK GENERATED BY TRJCONV 
    7703  
    7704 Ignored bad PDB record found on line 3 
    7705 REMARK THIS IS A SIMULATION BOX 
    7706  
    7707 50.0.pdb title: 
    7708 Title t= 50000.00000 step= 25000000 [more info...] 
    7709  
    7710 Chain information for 50.0.pdb #251 
    7711 --- 
    7712 Chain | Description 
    7713 A B | No description available 
    7714  
    7715 Non-standard residues in 50.0.pdb #251 
    7716 --- 
    7717 HSD — (HSD) 
    7718 POT — (POT) 
    7719  
    7720 
    7721 > open
    7722 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/50.2.pdb
    7723 
    7724 Summary of feedback from opening
    7725 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/50.2.pdb 
    7726 --- 
    7727 warnings | Ignored bad PDB record found on line 1 
    7728 REMARK GENERATED BY TRJCONV 
    7729  
    7730 Ignored bad PDB record found on line 3 
    7731 REMARK THIS IS A SIMULATION BOX 
    7732  
    7733 50.2.pdb title: 
    7734 Title t= 50200.00000 step= 25100000 [more info...] 
    7735  
    7736 Chain information for 50.2.pdb #252 
    7737 --- 
    7738 Chain | Description 
    7739 A B | No description available 
    7740  
    7741 Non-standard residues in 50.2.pdb #252 
    7742 --- 
    7743 HSD — (HSD) 
    7744 POT — (POT) 
    7745  
    7746 
    7747 > open
    7748 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/50.4.pdb
    7749 
    7750 Summary of feedback from opening
    7751 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/50.4.pdb 
    7752 --- 
    7753 warnings | Ignored bad PDB record found on line 1 
    7754 REMARK GENERATED BY TRJCONV 
    7755  
    7756 Ignored bad PDB record found on line 3 
    7757 REMARK THIS IS A SIMULATION BOX 
    7758  
    7759 50.4.pdb title: 
    7760 Title t= 50400.00000 step= 25200000 [more info...] 
    7761  
    7762 Chain information for 50.4.pdb #253 
    7763 --- 
    7764 Chain | Description 
    7765 A B | No description available 
    7766  
    7767 Non-standard residues in 50.4.pdb #253 
    7768 --- 
    7769 HSD — (HSD) 
    7770 POT — (POT) 
    7771  
    7772 
    7773 > open
    7774 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/50.6.pdb
    7775 
    7776 Summary of feedback from opening
    7777 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/50.6.pdb 
    7778 --- 
    7779 warnings | Ignored bad PDB record found on line 1 
    7780 REMARK GENERATED BY TRJCONV 
    7781  
    7782 Ignored bad PDB record found on line 3 
    7783 REMARK THIS IS A SIMULATION BOX 
    7784  
    7785 50.6.pdb title: 
    7786 Title t= 50600.00000 step= 25300000 [more info...] 
    7787  
    7788 Chain information for 50.6.pdb #254 
    7789 --- 
    7790 Chain | Description 
    7791 A B | No description available 
    7792  
    7793 Non-standard residues in 50.6.pdb #254 
    7794 --- 
    7795 HSD — (HSD) 
    7796 POT — (POT) 
    7797  
    7798 
    7799 > open
    7800 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/50.8.pdb
    7801 
    7802 Summary of feedback from opening
    7803 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/50.8.pdb 
    7804 --- 
    7805 warnings | Ignored bad PDB record found on line 1 
    7806 REMARK GENERATED BY TRJCONV 
    7807  
    7808 Ignored bad PDB record found on line 3 
    7809 REMARK THIS IS A SIMULATION BOX 
    7810  
    7811 50.8.pdb title: 
    7812 Title t= 50800.00000 step= 25400000 [more info...] 
    7813  
    7814 Chain information for 50.8.pdb #255 
    7815 --- 
    7816 Chain | Description 
    7817 A B | No description available 
    7818  
    7819 Non-standard residues in 50.8.pdb #255 
    7820 --- 
    7821 HSD — (HSD) 
    7822 POT — (POT) 
    7823  
    7824 
    7825 > open
    7826 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/51.0.pdb
    7827 
    7828 Summary of feedback from opening
    7829 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/51.0.pdb 
    7830 --- 
    7831 warnings | Ignored bad PDB record found on line 1 
    7832 REMARK GENERATED BY TRJCONV 
    7833  
    7834 Ignored bad PDB record found on line 3 
    7835 REMARK THIS IS A SIMULATION BOX 
    7836  
    7837 51.0.pdb title: 
    7838 Title t= 51000.00000 step= 25500000 [more info...] 
    7839  
    7840 Chain information for 51.0.pdb #256 
    7841 --- 
    7842 Chain | Description 
    7843 A B | No description available 
    7844  
    7845 Non-standard residues in 51.0.pdb #256 
    7846 --- 
    7847 HSD — (HSD) 
    7848 POT — (POT) 
    7849  
    7850 
    7851 > open
    7852 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/51.2.pdb
    7853 
    7854 Summary of feedback from opening
    7855 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/51.2.pdb 
    7856 --- 
    7857 warnings | Ignored bad PDB record found on line 1 
    7858 REMARK GENERATED BY TRJCONV 
    7859  
    7860 Ignored bad PDB record found on line 3 
    7861 REMARK THIS IS A SIMULATION BOX 
    7862  
    7863 51.2.pdb title: 
    7864 Title t= 51200.00000 step= 25600000 [more info...] 
    7865  
    7866 Chain information for 51.2.pdb #257 
    7867 --- 
    7868 Chain | Description 
    7869 A B | No description available 
    7870  
    7871 Non-standard residues in 51.2.pdb #257 
    7872 --- 
    7873 HSD — (HSD) 
    7874 POT — (POT) 
    7875  
    7876 
    7877 > open
    7878 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/51.4.pdb
    7879 
    7880 Summary of feedback from opening
    7881 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/51.4.pdb 
    7882 --- 
    7883 warnings | Ignored bad PDB record found on line 1 
    7884 REMARK GENERATED BY TRJCONV 
    7885  
    7886 Ignored bad PDB record found on line 3 
    7887 REMARK THIS IS A SIMULATION BOX 
    7888  
    7889 51.4.pdb title: 
    7890 Title t= 51400.00000 step= 25700000 [more info...] 
    7891  
    7892 Chain information for 51.4.pdb #258 
    7893 --- 
    7894 Chain | Description 
    7895 A B | No description available 
    7896  
    7897 Non-standard residues in 51.4.pdb #258 
    7898 --- 
    7899 HSD — (HSD) 
    7900 POT — (POT) 
    7901  
    7902 
    7903 > open
    7904 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/51.6.pdb
    7905 
    7906 Summary of feedback from opening
    7907 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/51.6.pdb 
    7908 --- 
    7909 warnings | Ignored bad PDB record found on line 1 
    7910 REMARK GENERATED BY TRJCONV 
    7911  
    7912 Ignored bad PDB record found on line 3 
    7913 REMARK THIS IS A SIMULATION BOX 
    7914  
    7915 51.6.pdb title: 
    7916 Title t= 51600.00000 step= 25800000 [more info...] 
    7917  
    7918 Chain information for 51.6.pdb #259 
    7919 --- 
    7920 Chain | Description 
    7921 A B | No description available 
    7922  
    7923 Non-standard residues in 51.6.pdb #259 
    7924 --- 
    7925 HSD — (HSD) 
    7926 POT — (POT) 
    7927  
    7928 
    7929 > open
    7930 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/51.8.pdb
    7931 
    7932 Summary of feedback from opening
    7933 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/51.8.pdb 
    7934 --- 
    7935 warnings | Ignored bad PDB record found on line 1 
    7936 REMARK GENERATED BY TRJCONV 
    7937  
    7938 Ignored bad PDB record found on line 3 
    7939 REMARK THIS IS A SIMULATION BOX 
    7940  
    7941 51.8.pdb title: 
    7942 Title t= 51800.00000 step= 25900000 [more info...] 
    7943  
    7944 Chain information for 51.8.pdb #260 
    7945 --- 
    7946 Chain | Description 
    7947 A B | No description available 
    7948  
    7949 Non-standard residues in 51.8.pdb #260 
    7950 --- 
    7951 HSD — (HSD) 
    7952 POT — (POT) 
    7953  
    7954 
    7955 > open
    7956 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/52.0.pdb
    7957 
    7958 Summary of feedback from opening
    7959 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/52.0.pdb 
    7960 --- 
    7961 warnings | Ignored bad PDB record found on line 1 
    7962 REMARK GENERATED BY TRJCONV 
    7963  
    7964 Ignored bad PDB record found on line 3 
    7965 REMARK THIS IS A SIMULATION BOX 
    7966  
    7967 52.0.pdb title: 
    7968 Title t= 52000.00000 step= 26000000 [more info...] 
    7969  
    7970 Chain information for 52.0.pdb #261 
    7971 --- 
    7972 Chain | Description 
    7973 A B | No description available 
    7974  
    7975 Non-standard residues in 52.0.pdb #261 
    7976 --- 
    7977 HSD — (HSD) 
    7978 POT — (POT) 
    7979  
    7980 
    7981 > open
    7982 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/52.2.pdb
    7983 
    7984 Summary of feedback from opening
    7985 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/52.2.pdb 
    7986 --- 
    7987 warnings | Ignored bad PDB record found on line 1 
    7988 REMARK GENERATED BY TRJCONV 
    7989  
    7990 Ignored bad PDB record found on line 3 
    7991 REMARK THIS IS A SIMULATION BOX 
    7992  
    7993 52.2.pdb title: 
    7994 Title t= 52200.00000 step= 26100000 [more info...] 
    7995  
    7996 Chain information for 52.2.pdb #262 
    7997 --- 
    7998 Chain | Description 
    7999 A B | No description available 
    8000  
    8001 Non-standard residues in 52.2.pdb #262 
    8002 --- 
    8003 HSD — (HSD) 
    8004 POT — (POT) 
    8005  
    8006 
    8007 > open
    8008 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/52.4.pdb
    8009 
    8010 Summary of feedback from opening
    8011 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/52.4.pdb 
    8012 --- 
    8013 warnings | Ignored bad PDB record found on line 1 
    8014 REMARK GENERATED BY TRJCONV 
    8015  
    8016 Ignored bad PDB record found on line 3 
    8017 REMARK THIS IS A SIMULATION BOX 
    8018  
    8019 52.4.pdb title: 
    8020 Title t= 52400.00000 step= 26200000 [more info...] 
    8021  
    8022 Chain information for 52.4.pdb #263 
    8023 --- 
    8024 Chain | Description 
    8025 A B | No description available 
    8026  
    8027 Non-standard residues in 52.4.pdb #263 
    8028 --- 
    8029 HSD — (HSD) 
    8030 POT — (POT) 
    8031  
    8032 
    8033 > open
    8034 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/52.6.pdb
    8035 
    8036 Summary of feedback from opening
    8037 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/52.6.pdb 
    8038 --- 
    8039 warnings | Ignored bad PDB record found on line 1 
    8040 REMARK GENERATED BY TRJCONV 
    8041  
    8042 Ignored bad PDB record found on line 3 
    8043 REMARK THIS IS A SIMULATION BOX 
    8044  
    8045 52.6.pdb title: 
    8046 Title t= 52600.00000 step= 26300000 [more info...] 
    8047  
    8048 Chain information for 52.6.pdb #264 
    8049 --- 
    8050 Chain | Description 
    8051 A B | No description available 
    8052  
    8053 Non-standard residues in 52.6.pdb #264 
    8054 --- 
    8055 HSD — (HSD) 
    8056 POT — (POT) 
    8057  
    8058 
    8059 > open
    8060 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/52.8.pdb
    8061 
    8062 Summary of feedback from opening
    8063 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/52.8.pdb 
    8064 --- 
    8065 warnings | Ignored bad PDB record found on line 1 
    8066 REMARK GENERATED BY TRJCONV 
    8067  
    8068 Ignored bad PDB record found on line 3 
    8069 REMARK THIS IS A SIMULATION BOX 
    8070  
    8071 52.8.pdb title: 
    8072 Title t= 52800.00000 step= 26400000 [more info...] 
    8073  
    8074 Chain information for 52.8.pdb #265 
    8075 --- 
    8076 Chain | Description 
    8077 A B | No description available 
    8078  
    8079 Non-standard residues in 52.8.pdb #265 
    8080 --- 
    8081 HSD — (HSD) 
    8082 POT — (POT) 
    8083  
    8084 
    8085 > open
    8086 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/53.0.pdb
    8087 
    8088 Summary of feedback from opening
    8089 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/53.0.pdb 
    8090 --- 
    8091 warnings | Ignored bad PDB record found on line 1 
    8092 REMARK GENERATED BY TRJCONV 
    8093  
    8094 Ignored bad PDB record found on line 3 
    8095 REMARK THIS IS A SIMULATION BOX 
    8096  
    8097 53.0.pdb title: 
    8098 Title t= 53000.00000 step= 26500000 [more info...] 
    8099  
    8100 Chain information for 53.0.pdb #266 
    8101 --- 
    8102 Chain | Description 
    8103 A B | No description available 
    8104  
    8105 Non-standard residues in 53.0.pdb #266 
    8106 --- 
    8107 HSD — (HSD) 
    8108 POT — (POT) 
    8109  
    8110 
    8111 > open
    8112 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/53.2.pdb
    8113 
    8114 Summary of feedback from opening
    8115 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/53.2.pdb 
    8116 --- 
    8117 warnings | Ignored bad PDB record found on line 1 
    8118 REMARK GENERATED BY TRJCONV 
    8119  
    8120 Ignored bad PDB record found on line 3 
    8121 REMARK THIS IS A SIMULATION BOX 
    8122  
    8123 53.2.pdb title: 
    8124 Title t= 53200.00000 step= 26600000 [more info...] 
    8125  
    8126 Chain information for 53.2.pdb #267 
    8127 --- 
    8128 Chain | Description 
    8129 A B | No description available 
    8130  
    8131 Non-standard residues in 53.2.pdb #267 
    8132 --- 
    8133 HSD — (HSD) 
    8134 POT — (POT) 
    8135  
    8136 
    8137 > open
    8138 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/53.4.pdb
    8139 
    8140 Summary of feedback from opening
    8141 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/53.4.pdb 
    8142 --- 
    8143 warnings | Ignored bad PDB record found on line 1 
    8144 REMARK GENERATED BY TRJCONV 
    8145  
    8146 Ignored bad PDB record found on line 3 
    8147 REMARK THIS IS A SIMULATION BOX 
    8148  
    8149 53.4.pdb title: 
    8150 Title t= 53400.00000 step= 26700000 [more info...] 
    8151  
    8152 Chain information for 53.4.pdb #268 
    8153 --- 
    8154 Chain | Description 
    8155 A B | No description available 
    8156  
    8157 Non-standard residues in 53.4.pdb #268 
    8158 --- 
    8159 HSD — (HSD) 
    8160 POT — (POT) 
    8161  
    8162 
    8163 > open
    8164 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/53.6.pdb
    8165 
    8166 Summary of feedback from opening
    8167 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/53.6.pdb 
    8168 --- 
    8169 warnings | Ignored bad PDB record found on line 1 
    8170 REMARK GENERATED BY TRJCONV 
    8171  
    8172 Ignored bad PDB record found on line 3 
    8173 REMARK THIS IS A SIMULATION BOX 
    8174  
    8175 53.6.pdb title: 
    8176 Title t= 53600.00000 step= 26800000 [more info...] 
    8177  
    8178 Chain information for 53.6.pdb #269 
    8179 --- 
    8180 Chain | Description 
    8181 A B | No description available 
    8182  
    8183 Non-standard residues in 53.6.pdb #269 
    8184 --- 
    8185 HSD — (HSD) 
    8186 POT — (POT) 
    8187  
    8188 
    8189 > open
    8190 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/53.8.pdb
    8191 
    8192 Summary of feedback from opening
    8193 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/53.8.pdb 
    8194 --- 
    8195 warnings | Ignored bad PDB record found on line 1 
    8196 REMARK GENERATED BY TRJCONV 
    8197  
    8198 Ignored bad PDB record found on line 3 
    8199 REMARK THIS IS A SIMULATION BOX 
    8200  
    8201 53.8.pdb title: 
    8202 Title t= 53800.00000 step= 26900000 [more info...] 
    8203  
    8204 Chain information for 53.8.pdb #270 
    8205 --- 
    8206 Chain | Description 
    8207 A B | No description available 
    8208  
    8209 Non-standard residues in 53.8.pdb #270 
    8210 --- 
    8211 HSD — (HSD) 
    8212 POT — (POT) 
    8213  
    8214 
    8215 > open
    8216 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/54.0.pdb
    8217 
    8218 Summary of feedback from opening
    8219 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/54.0.pdb 
    8220 --- 
    8221 warnings | Ignored bad PDB record found on line 1 
    8222 REMARK GENERATED BY TRJCONV 
    8223  
    8224 Ignored bad PDB record found on line 3 
    8225 REMARK THIS IS A SIMULATION BOX 
    8226  
    8227 54.0.pdb title: 
    8228 Title t= 54000.00000 step= 27000000 [more info...] 
    8229  
    8230 Chain information for 54.0.pdb #271 
    8231 --- 
    8232 Chain | Description 
    8233 A B | No description available 
    8234  
    8235 Non-standard residues in 54.0.pdb #271 
    8236 --- 
    8237 HSD — (HSD) 
    8238 POT — (POT) 
    8239  
    8240 
    8241 > open
    8242 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/54.2.pdb
    8243 
    8244 Summary of feedback from opening
    8245 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/54.2.pdb 
    8246 --- 
    8247 warnings | Ignored bad PDB record found on line 1 
    8248 REMARK GENERATED BY TRJCONV 
    8249  
    8250 Ignored bad PDB record found on line 3 
    8251 REMARK THIS IS A SIMULATION BOX 
    8252  
    8253 54.2.pdb title: 
    8254 Title t= 54200.00000 step= 27100000 [more info...] 
    8255  
    8256 Chain information for 54.2.pdb #272 
    8257 --- 
    8258 Chain | Description 
    8259 A B | No description available 
    8260  
    8261 Non-standard residues in 54.2.pdb #272 
    8262 --- 
    8263 HSD — (HSD) 
    8264 POT — (POT) 
    8265  
    8266 
    8267 > open
    8268 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/54.4.pdb
    8269 
    8270 Summary of feedback from opening
    8271 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/54.4.pdb 
    8272 --- 
    8273 warnings | Ignored bad PDB record found on line 1 
    8274 REMARK GENERATED BY TRJCONV 
    8275  
    8276 Ignored bad PDB record found on line 3 
    8277 REMARK THIS IS A SIMULATION BOX 
    8278  
    8279 54.4.pdb title: 
    8280 Title t= 54400.00000 step= 27200000 [more info...] 
    8281  
    8282 Chain information for 54.4.pdb #273 
    8283 --- 
    8284 Chain | Description 
    8285 A B | No description available 
    8286  
    8287 Non-standard residues in 54.4.pdb #273 
    8288 --- 
    8289 HSD — (HSD) 
    8290 POT — (POT) 
    8291  
    8292 
    8293 > open
    8294 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/54.6.pdb
    8295 
    8296 Summary of feedback from opening
    8297 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/54.6.pdb 
    8298 --- 
    8299 warnings | Ignored bad PDB record found on line 1 
    8300 REMARK GENERATED BY TRJCONV 
    8301  
    8302 Ignored bad PDB record found on line 3 
    8303 REMARK THIS IS A SIMULATION BOX 
    8304  
    8305 54.6.pdb title: 
    8306 Title t= 54600.00000 step= 27300000 [more info...] 
    8307  
    8308 Chain information for 54.6.pdb #274 
    8309 --- 
    8310 Chain | Description 
    8311 A B | No description available 
    8312  
    8313 Non-standard residues in 54.6.pdb #274 
    8314 --- 
    8315 HSD — (HSD) 
    8316 POT — (POT) 
    8317  
    8318 
    8319 > open
    8320 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/54.8.pdb
    8321 
    8322 Summary of feedback from opening
    8323 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/54.8.pdb 
    8324 --- 
    8325 warnings | Ignored bad PDB record found on line 1 
    8326 REMARK GENERATED BY TRJCONV 
    8327  
    8328 Ignored bad PDB record found on line 3 
    8329 REMARK THIS IS A SIMULATION BOX 
    8330  
    8331 54.8.pdb title: 
    8332 Title t= 54800.00000 step= 27400000 [more info...] 
    8333  
    8334 Chain information for 54.8.pdb #275 
    8335 --- 
    8336 Chain | Description 
    8337 A B | No description available 
    8338  
    8339 Non-standard residues in 54.8.pdb #275 
    8340 --- 
    8341 HSD — (HSD) 
    8342 POT — (POT) 
    8343  
    8344 
    8345 > open
    8346 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/55.0.pdb
    8347 
    8348 Summary of feedback from opening
    8349 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/55.0.pdb 
    8350 --- 
    8351 warnings | Ignored bad PDB record found on line 1 
    8352 REMARK GENERATED BY TRJCONV 
    8353  
    8354 Ignored bad PDB record found on line 3 
    8355 REMARK THIS IS A SIMULATION BOX 
    8356  
    8357 55.0.pdb title: 
    8358 Title t= 55000.00000 step= 27500000 [more info...] 
    8359  
    8360 Chain information for 55.0.pdb #276 
    8361 --- 
    8362 Chain | Description 
    8363 A B | No description available 
    8364  
    8365 Non-standard residues in 55.0.pdb #276 
    8366 --- 
    8367 HSD — (HSD) 
    8368 POT — (POT) 
    8369  
    8370 
    8371 > open
    8372 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/55.2.pdb
    8373 
    8374 Summary of feedback from opening
    8375 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/55.2.pdb 
    8376 --- 
    8377 warnings | Ignored bad PDB record found on line 1 
    8378 REMARK GENERATED BY TRJCONV 
    8379  
    8380 Ignored bad PDB record found on line 3 
    8381 REMARK THIS IS A SIMULATION BOX 
    8382  
    8383 55.2.pdb title: 
    8384 Title t= 55200.00000 step= 27600000 [more info...] 
    8385  
    8386 Chain information for 55.2.pdb #277 
    8387 --- 
    8388 Chain | Description 
    8389 A B | No description available 
    8390  
    8391 Non-standard residues in 55.2.pdb #277 
    8392 --- 
    8393 HSD — (HSD) 
    8394 POT — (POT) 
    8395  
    8396 
    8397 > open
    8398 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/55.4.pdb
    8399 
    8400 Summary of feedback from opening
    8401 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/55.4.pdb 
    8402 --- 
    8403 warnings | Ignored bad PDB record found on line 1 
    8404 REMARK GENERATED BY TRJCONV 
    8405  
    8406 Ignored bad PDB record found on line 3 
    8407 REMARK THIS IS A SIMULATION BOX 
    8408  
    8409 55.4.pdb title: 
    8410 Title t= 55400.00000 step= 27700000 [more info...] 
    8411  
    8412 Chain information for 55.4.pdb #278 
    8413 --- 
    8414 Chain | Description 
    8415 A B | No description available 
    8416  
    8417 Non-standard residues in 55.4.pdb #278 
    8418 --- 
    8419 HSD — (HSD) 
    8420 POT — (POT) 
    8421  
    8422 
    8423 > open
    8424 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/55.6.pdb
    8425 
    8426 Summary of feedback from opening
    8427 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/55.6.pdb 
    8428 --- 
    8429 warnings | Ignored bad PDB record found on line 1 
    8430 REMARK GENERATED BY TRJCONV 
    8431  
    8432 Ignored bad PDB record found on line 3 
    8433 REMARK THIS IS A SIMULATION BOX 
    8434  
    8435 55.6.pdb title: 
    8436 Title t= 55600.00000 step= 27800000 [more info...] 
    8437  
    8438 Chain information for 55.6.pdb #279 
    8439 --- 
    8440 Chain | Description 
    8441 A B | No description available 
    8442  
    8443 Non-standard residues in 55.6.pdb #279 
    8444 --- 
    8445 HSD — (HSD) 
    8446 POT — (POT) 
    8447  
    8448 
    8449 > open
    8450 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/55.8.pdb
    8451 
    8452 Summary of feedback from opening
    8453 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/55.8.pdb 
    8454 --- 
    8455 warnings | Ignored bad PDB record found on line 1 
    8456 REMARK GENERATED BY TRJCONV 
    8457  
    8458 Ignored bad PDB record found on line 3 
    8459 REMARK THIS IS A SIMULATION BOX 
    8460  
    8461 55.8.pdb title: 
    8462 Title t= 55800.00000 step= 27900000 [more info...] 
    8463  
    8464 Chain information for 55.8.pdb #280 
    8465 --- 
    8466 Chain | Description 
    8467 A B | No description available 
    8468  
    8469 Non-standard residues in 55.8.pdb #280 
    8470 --- 
    8471 HSD — (HSD) 
    8472 POT — (POT) 
    8473  
    8474 
    8475 > open
    8476 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/56.0.pdb
    8477 
    8478 Summary of feedback from opening
    8479 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/56.0.pdb 
    8480 --- 
    8481 warnings | Ignored bad PDB record found on line 1 
    8482 REMARK GENERATED BY TRJCONV 
    8483  
    8484 Ignored bad PDB record found on line 3 
    8485 REMARK THIS IS A SIMULATION BOX 
    8486  
    8487 56.0.pdb title: 
    8488 Title t= 56000.00000 step= 28000000 [more info...] 
    8489  
    8490 Chain information for 56.0.pdb #281 
    8491 --- 
    8492 Chain | Description 
    8493 A B | No description available 
    8494  
    8495 Non-standard residues in 56.0.pdb #281 
    8496 --- 
    8497 HSD — (HSD) 
    8498 POT — (POT) 
    8499  
    8500 
    8501 > open
    8502 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/56.2.pdb
    8503 
    8504 Summary of feedback from opening
    8505 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/56.2.pdb 
    8506 --- 
    8507 warnings | Ignored bad PDB record found on line 1 
    8508 REMARK GENERATED BY TRJCONV 
    8509  
    8510 Ignored bad PDB record found on line 3 
    8511 REMARK THIS IS A SIMULATION BOX 
    8512  
    8513 56.2.pdb title: 
    8514 Title t= 56200.00000 step= 28100000 [more info...] 
    8515  
    8516 Chain information for 56.2.pdb #282 
    8517 --- 
    8518 Chain | Description 
    8519 A B | No description available 
    8520  
    8521 Non-standard residues in 56.2.pdb #282 
    8522 --- 
    8523 HSD — (HSD) 
    8524 POT — (POT) 
    8525  
    8526 
    8527 > open
    8528 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/56.4.pdb
    8529 
    8530 Summary of feedback from opening
    8531 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/56.4.pdb 
    8532 --- 
    8533 warnings | Ignored bad PDB record found on line 1 
    8534 REMARK GENERATED BY TRJCONV 
    8535  
    8536 Ignored bad PDB record found on line 3 
    8537 REMARK THIS IS A SIMULATION BOX 
    8538  
    8539 56.4.pdb title: 
    8540 Title t= 56400.00000 step= 28200000 [more info...] 
    8541  
    8542 Chain information for 56.4.pdb #283 
    8543 --- 
    8544 Chain | Description 
    8545 A B | No description available 
    8546  
    8547 Non-standard residues in 56.4.pdb #283 
    8548 --- 
    8549 HSD — (HSD) 
    8550 POT — (POT) 
    8551  
    8552 
    8553 > open
    8554 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/56.6.pdb
    8555 
    8556 Summary of feedback from opening
    8557 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/56.6.pdb 
    8558 --- 
    8559 warnings | Ignored bad PDB record found on line 1 
    8560 REMARK GENERATED BY TRJCONV 
    8561  
    8562 Ignored bad PDB record found on line 3 
    8563 REMARK THIS IS A SIMULATION BOX 
    8564  
    8565 56.6.pdb title: 
    8566 Title t= 56600.00000 step= 28300000 [more info...] 
    8567  
    8568 Chain information for 56.6.pdb #284 
    8569 --- 
    8570 Chain | Description 
    8571 A B | No description available 
    8572  
    8573 Non-standard residues in 56.6.pdb #284 
    8574 --- 
    8575 HSD — (HSD) 
    8576 POT — (POT) 
    8577  
    8578 
    8579 > open
    8580 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/56.8.pdb
    8581 
    8582 Summary of feedback from opening
    8583 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/56.8.pdb 
    8584 --- 
    8585 warnings | Ignored bad PDB record found on line 1 
    8586 REMARK GENERATED BY TRJCONV 
    8587  
    8588 Ignored bad PDB record found on line 3 
    8589 REMARK THIS IS A SIMULATION BOX 
    8590  
    8591 56.8.pdb title: 
    8592 Title t= 56800.00000 step= 28400000 [more info...] 
    8593  
    8594 Chain information for 56.8.pdb #285 
    8595 --- 
    8596 Chain | Description 
    8597 A B | No description available 
    8598  
    8599 Non-standard residues in 56.8.pdb #285 
    8600 --- 
    8601 HSD — (HSD) 
    8602 POT — (POT) 
    8603  
    8604 
    8605 > open
    8606 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/57.0.pdb
    8607 
    8608 Summary of feedback from opening
    8609 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/57.0.pdb 
    8610 --- 
    8611 warnings | Ignored bad PDB record found on line 1 
    8612 REMARK GENERATED BY TRJCONV 
    8613  
    8614 Ignored bad PDB record found on line 3 
    8615 REMARK THIS IS A SIMULATION BOX 
    8616  
    8617 57.0.pdb title: 
    8618 Title t= 57000.00000 step= 28500000 [more info...] 
    8619  
    8620 Chain information for 57.0.pdb #286 
    8621 --- 
    8622 Chain | Description 
    8623 A B | No description available 
    8624  
    8625 Non-standard residues in 57.0.pdb #286 
    8626 --- 
    8627 HSD — (HSD) 
    8628 POT — (POT) 
    8629  
    8630 
    8631 > open
    8632 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/57.2.pdb
    8633 
    8634 Summary of feedback from opening
    8635 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/57.2.pdb 
    8636 --- 
    8637 warnings | Ignored bad PDB record found on line 1 
    8638 REMARK GENERATED BY TRJCONV 
    8639  
    8640 Ignored bad PDB record found on line 3 
    8641 REMARK THIS IS A SIMULATION BOX 
    8642  
    8643 57.2.pdb title: 
    8644 Title t= 57200.00000 step= 28600000 [more info...] 
    8645  
    8646 Chain information for 57.2.pdb #287 
    8647 --- 
    8648 Chain | Description 
    8649 A B | No description available 
    8650  
    8651 Non-standard residues in 57.2.pdb #287 
    8652 --- 
    8653 HSD — (HSD) 
    8654 POT — (POT) 
    8655  
    8656 
    8657 > open
    8658 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/57.4.pdb
    8659 
    8660 Summary of feedback from opening
    8661 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/57.4.pdb 
    8662 --- 
    8663 warnings | Ignored bad PDB record found on line 1 
    8664 REMARK GENERATED BY TRJCONV 
    8665  
    8666 Ignored bad PDB record found on line 3 
    8667 REMARK THIS IS A SIMULATION BOX 
    8668  
    8669 57.4.pdb title: 
    8670 Title t= 57400.00000 step= 28700000 [more info...] 
    8671  
    8672 Chain information for 57.4.pdb #288 
    8673 --- 
    8674 Chain | Description 
    8675 A B | No description available 
    8676  
    8677 Non-standard residues in 57.4.pdb #288 
    8678 --- 
    8679 HSD — (HSD) 
    8680 POT — (POT) 
    8681  
    8682 
    8683 > open
    8684 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/57.6.pdb
    8685 
    8686 Summary of feedback from opening
    8687 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/57.6.pdb 
    8688 --- 
    8689 warnings | Ignored bad PDB record found on line 1 
    8690 REMARK GENERATED BY TRJCONV 
    8691  
    8692 Ignored bad PDB record found on line 3 
    8693 REMARK THIS IS A SIMULATION BOX 
    8694  
    8695 57.6.pdb title: 
    8696 Title t= 57600.00000 step= 28800000 [more info...] 
    8697  
    8698 Chain information for 57.6.pdb #289 
    8699 --- 
    8700 Chain | Description 
    8701 A B | No description available 
    8702  
    8703 Non-standard residues in 57.6.pdb #289 
    8704 --- 
    8705 HSD — (HSD) 
    8706 POT — (POT) 
    8707  
    8708 
    8709 > open
    8710 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/57.8.pdb
    8711 
    8712 Summary of feedback from opening
    8713 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/57.8.pdb 
    8714 --- 
    8715 warnings | Ignored bad PDB record found on line 1 
    8716 REMARK GENERATED BY TRJCONV 
    8717  
    8718 Ignored bad PDB record found on line 3 
    8719 REMARK THIS IS A SIMULATION BOX 
    8720  
    8721 57.8.pdb title: 
    8722 Title t= 57800.00000 step= 28900000 [more info...] 
    8723  
    8724 Chain information for 57.8.pdb #290 
    8725 --- 
    8726 Chain | Description 
    8727 A B | No description available 
    8728  
    8729 Non-standard residues in 57.8.pdb #290 
    8730 --- 
    8731 HSD — (HSD) 
    8732 POT — (POT) 
    8733  
    8734 
    8735 > open
    8736 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/58.0.pdb
    8737 
    8738 Summary of feedback from opening
    8739 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/58.0.pdb 
    8740 --- 
    8741 warnings | Ignored bad PDB record found on line 1 
    8742 REMARK GENERATED BY TRJCONV 
    8743  
    8744 Ignored bad PDB record found on line 3 
    8745 REMARK THIS IS A SIMULATION BOX 
    8746  
    8747 58.0.pdb title: 
    8748 Title t= 58000.00000 step= 29000000 [more info...] 
    8749  
    8750 Chain information for 58.0.pdb #291 
    8751 --- 
    8752 Chain | Description 
    8753 A B | No description available 
    8754  
    8755 Non-standard residues in 58.0.pdb #291 
    8756 --- 
    8757 HSD — (HSD) 
    8758 POT — (POT) 
    8759  
    8760 
    8761 > open
    8762 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/58.2.pdb
    8763 
    8764 Summary of feedback from opening
    8765 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/58.2.pdb 
    8766 --- 
    8767 warnings | Ignored bad PDB record found on line 1 
    8768 REMARK GENERATED BY TRJCONV 
    8769  
    8770 Ignored bad PDB record found on line 3 
    8771 REMARK THIS IS A SIMULATION BOX 
    8772  
    8773 58.2.pdb title: 
    8774 Title t= 58200.00000 step= 29100000 [more info...] 
    8775  
    8776 Chain information for 58.2.pdb #292 
    8777 --- 
    8778 Chain | Description 
    8779 A B | No description available 
    8780  
    8781 Non-standard residues in 58.2.pdb #292 
    8782 --- 
    8783 HSD — (HSD) 
    8784 POT — (POT) 
    8785  
    8786 
    8787 > open
    8788 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/58.4.pdb
    8789 
    8790 Summary of feedback from opening
    8791 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/58.4.pdb 
    8792 --- 
    8793 warnings | Ignored bad PDB record found on line 1 
    8794 REMARK GENERATED BY TRJCONV 
    8795  
    8796 Ignored bad PDB record found on line 3 
    8797 REMARK THIS IS A SIMULATION BOX 
    8798  
    8799 58.4.pdb title: 
    8800 Title t= 58400.00000 step= 29200000 [more info...] 
    8801  
    8802 Chain information for 58.4.pdb #293 
    8803 --- 
    8804 Chain | Description 
    8805 A B | No description available 
    8806  
    8807 Non-standard residues in 58.4.pdb #293 
    8808 --- 
    8809 HSD — (HSD) 
    8810 POT — (POT) 
    8811  
    8812 
    8813 > open
    8814 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/58.6.pdb
    8815 
    8816 Summary of feedback from opening
    8817 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/58.6.pdb 
    8818 --- 
    8819 warnings | Ignored bad PDB record found on line 1 
    8820 REMARK GENERATED BY TRJCONV 
    8821  
    8822 Ignored bad PDB record found on line 3 
    8823 REMARK THIS IS A SIMULATION BOX 
    8824  
    8825 58.6.pdb title: 
    8826 Title t= 58600.00000 step= 29300000 [more info...] 
    8827  
    8828 Chain information for 58.6.pdb #294 
    8829 --- 
    8830 Chain | Description 
    8831 A B | No description available 
    8832  
    8833 Non-standard residues in 58.6.pdb #294 
    8834 --- 
    8835 HSD — (HSD) 
    8836 POT — (POT) 
    8837  
    8838 
    8839 > open
    8840 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/58.8.pdb
    8841 
    8842 Summary of feedback from opening
    8843 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/58.8.pdb 
    8844 --- 
    8845 warnings | Ignored bad PDB record found on line 1 
    8846 REMARK GENERATED BY TRJCONV 
    8847  
    8848 Ignored bad PDB record found on line 3 
    8849 REMARK THIS IS A SIMULATION BOX 
    8850  
    8851 58.8.pdb title: 
    8852 Title t= 58800.00000 step= 29400000 [more info...] 
    8853  
    8854 Chain information for 58.8.pdb #295 
    8855 --- 
    8856 Chain | Description 
    8857 A B | No description available 
    8858  
    8859 Non-standard residues in 58.8.pdb #295 
    8860 --- 
    8861 HSD — (HSD) 
    8862 POT — (POT) 
    8863  
    8864 
    8865 > open
    8866 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/59.0.pdb
    8867 
    8868 Summary of feedback from opening
    8869 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/59.0.pdb 
    8870 --- 
    8871 warnings | Ignored bad PDB record found on line 1 
    8872 REMARK GENERATED BY TRJCONV 
    8873  
    8874 Ignored bad PDB record found on line 3 
    8875 REMARK THIS IS A SIMULATION BOX 
    8876  
    8877 59.0.pdb title: 
    8878 Title t= 59000.00000 step= 29500000 [more info...] 
    8879  
    8880 Chain information for 59.0.pdb #296 
    8881 --- 
    8882 Chain | Description 
    8883 A B | No description available 
    8884  
    8885 Non-standard residues in 59.0.pdb #296 
    8886 --- 
    8887 HSD — (HSD) 
    8888 POT — (POT) 
    8889  
    8890 
    8891 > open
    8892 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/59.2.pdb
    8893 
    8894 Summary of feedback from opening
    8895 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/59.2.pdb 
    8896 --- 
    8897 warnings | Ignored bad PDB record found on line 1 
    8898 REMARK GENERATED BY TRJCONV 
    8899  
    8900 Ignored bad PDB record found on line 3 
    8901 REMARK THIS IS A SIMULATION BOX 
    8902  
    8903 59.2.pdb title: 
    8904 Title t= 59200.00000 step= 29600000 [more info...] 
    8905  
    8906 Chain information for 59.2.pdb #297 
    8907 --- 
    8908 Chain | Description 
    8909 A B | No description available 
    8910  
    8911 Non-standard residues in 59.2.pdb #297 
    8912 --- 
    8913 HSD — (HSD) 
    8914 POT — (POT) 
    8915  
    8916 
    8917 > open
    8918 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/59.4.pdb
    8919 
    8920 Summary of feedback from opening
    8921 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/59.4.pdb 
    8922 --- 
    8923 warnings | Ignored bad PDB record found on line 1 
    8924 REMARK GENERATED BY TRJCONV 
    8925  
    8926 Ignored bad PDB record found on line 3 
    8927 REMARK THIS IS A SIMULATION BOX 
    8928  
    8929 59.4.pdb title: 
    8930 Title t= 59400.00000 step= 29700000 [more info...] 
    8931  
    8932 Chain information for 59.4.pdb #298 
    8933 --- 
    8934 Chain | Description 
    8935 A B | No description available 
    8936  
    8937 Non-standard residues in 59.4.pdb #298 
    8938 --- 
    8939 HSD — (HSD) 
    8940 POT — (POT) 
    8941  
    8942 
    8943 > open
    8944 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/59.6.pdb
    8945 
    8946 Summary of feedback from opening
    8947 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/59.6.pdb 
    8948 --- 
    8949 warnings | Ignored bad PDB record found on line 1 
    8950 REMARK GENERATED BY TRJCONV 
    8951  
    8952 Ignored bad PDB record found on line 3 
    8953 REMARK THIS IS A SIMULATION BOX 
    8954  
    8955 59.6.pdb title: 
    8956 Title t= 59600.00000 step= 29800000 [more info...] 
    8957  
    8958 Chain information for 59.6.pdb #299 
    8959 --- 
    8960 Chain | Description 
    8961 A B | No description available 
    8962  
    8963 Non-standard residues in 59.6.pdb #299 
    8964 --- 
    8965 HSD — (HSD) 
    8966 POT — (POT) 
    8967  
    8968 
    8969 > open
    8970 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/59.8.pdb
    8971 
    8972 Summary of feedback from opening
    8973 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/59.8.pdb 
    8974 --- 
    8975 warnings | Ignored bad PDB record found on line 1 
    8976 REMARK GENERATED BY TRJCONV 
    8977  
    8978 Ignored bad PDB record found on line 3 
    8979 REMARK THIS IS A SIMULATION BOX 
    8980  
    8981 59.8.pdb title: 
    8982 Title t= 59800.00000 step= 29900000 [more info...] 
    8983  
    8984 Chain information for 59.8.pdb #300 
    8985 --- 
    8986 Chain | Description 
    8987 A B | No description available 
    8988  
    8989 Non-standard residues in 59.8.pdb #300 
    8990 --- 
    8991 HSD — (HSD) 
    8992 POT — (POT) 
    8993  
    8994 
    8995 > open
    8996 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/60.0.pdb
    8997 
    8998 Summary of feedback from opening
    8999 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/60.0.pdb 
    9000 --- 
    9001 warnings | Ignored bad PDB record found on line 1 
    9002 REMARK GENERATED BY TRJCONV 
    9003  
    9004 Ignored bad PDB record found on line 3 
    9005 REMARK THIS IS A SIMULATION BOX 
    9006  
    9007 60.0.pdb title: 
    9008 Title t= 60000.00000 step= 30000000 [more info...] 
    9009  
    9010 Chain information for 60.0.pdb #301 
    9011 --- 
    9012 Chain | Description 
    9013 A B | No description available 
    9014  
    9015 Non-standard residues in 60.0.pdb #301 
    9016 --- 
    9017 HSD — (HSD) 
    9018 POT — (POT) 
    9019  
    9020 
    9021 > open
    9022 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/60.2.pdb
    9023 
    9024 Summary of feedback from opening
    9025 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/60.2.pdb 
    9026 --- 
    9027 warnings | Ignored bad PDB record found on line 1 
    9028 REMARK GENERATED BY TRJCONV 
    9029  
    9030 Ignored bad PDB record found on line 3 
    9031 REMARK THIS IS A SIMULATION BOX 
    9032  
    9033 60.2.pdb title: 
    9034 Title t= 60200.00000 step= 30100000 [more info...] 
    9035  
    9036 Chain information for 60.2.pdb #302 
    9037 --- 
    9038 Chain | Description 
    9039 A B | No description available 
    9040  
    9041 Non-standard residues in 60.2.pdb #302 
    9042 --- 
    9043 HSD — (HSD) 
    9044 POT — (POT) 
    9045  
    9046 
    9047 > open
    9048 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/60.4.pdb
    9049 
    9050 Summary of feedback from opening
    9051 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/60.4.pdb 
    9052 --- 
    9053 warnings | Ignored bad PDB record found on line 1 
    9054 REMARK GENERATED BY TRJCONV 
    9055  
    9056 Ignored bad PDB record found on line 3 
    9057 REMARK THIS IS A SIMULATION BOX 
    9058  
    9059 60.4.pdb title: 
    9060 Title t= 60400.00000 step= 30200000 [more info...] 
    9061  
    9062 Chain information for 60.4.pdb #303 
    9063 --- 
    9064 Chain | Description 
    9065 A B | No description available 
    9066  
    9067 Non-standard residues in 60.4.pdb #303 
    9068 --- 
    9069 HSD — (HSD) 
    9070 POT — (POT) 
    9071  
    9072 
    9073 > open
    9074 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/60.6.pdb
    9075 
    9076 Summary of feedback from opening
    9077 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/60.6.pdb 
    9078 --- 
    9079 warnings | Ignored bad PDB record found on line 1 
    9080 REMARK GENERATED BY TRJCONV 
    9081  
    9082 Ignored bad PDB record found on line 3 
    9083 REMARK THIS IS A SIMULATION BOX 
    9084  
    9085 60.6.pdb title: 
    9086 Title t= 60600.00000 step= 30300000 [more info...] 
    9087  
    9088 Chain information for 60.6.pdb #304 
    9089 --- 
    9090 Chain | Description 
    9091 A B | No description available 
    9092  
    9093 Non-standard residues in 60.6.pdb #304 
    9094 --- 
    9095 HSD — (HSD) 
    9096 POT — (POT) 
    9097  
    9098 
    9099 > open
    9100 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/60.8.pdb
    9101 
    9102 Summary of feedback from opening
    9103 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/60.8.pdb 
    9104 --- 
    9105 warnings | Ignored bad PDB record found on line 1 
    9106 REMARK GENERATED BY TRJCONV 
    9107  
    9108 Ignored bad PDB record found on line 3 
    9109 REMARK THIS IS A SIMULATION BOX 
    9110  
    9111 60.8.pdb title: 
    9112 Title t= 60800.00000 step= 30400000 [more info...] 
    9113  
    9114 Chain information for 60.8.pdb #305 
    9115 --- 
    9116 Chain | Description 
    9117 A B | No description available 
    9118  
    9119 Non-standard residues in 60.8.pdb #305 
    9120 --- 
    9121 HSD — (HSD) 
    9122 POT — (POT) 
    9123  
    9124 
    9125 > open
    9126 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/61.0.pdb
    9127 
    9128 Summary of feedback from opening
    9129 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/61.0.pdb 
    9130 --- 
    9131 warnings | Ignored bad PDB record found on line 1 
    9132 REMARK GENERATED BY TRJCONV 
    9133  
    9134 Ignored bad PDB record found on line 3 
    9135 REMARK THIS IS A SIMULATION BOX 
    9136  
    9137 61.0.pdb title: 
    9138 Title t= 61000.00000 step= 30500000 [more info...] 
    9139  
    9140 Chain information for 61.0.pdb #306 
    9141 --- 
    9142 Chain | Description 
    9143 A B | No description available 
    9144  
    9145 Non-standard residues in 61.0.pdb #306 
    9146 --- 
    9147 HSD — (HSD) 
    9148 POT — (POT) 
    9149  
    9150 
    9151 > open
    9152 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/61.2.pdb
    9153 
    9154 Summary of feedback from opening
    9155 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/61.2.pdb 
    9156 --- 
    9157 warnings | Ignored bad PDB record found on line 1 
    9158 REMARK GENERATED BY TRJCONV 
    9159  
    9160 Ignored bad PDB record found on line 3 
    9161 REMARK THIS IS A SIMULATION BOX 
    9162  
    9163 61.2.pdb title: 
    9164 Title t= 61200.00000 step= 30600000 [more info...] 
    9165  
    9166 Chain information for 61.2.pdb #307 
    9167 --- 
    9168 Chain | Description 
    9169 A B | No description available 
    9170  
    9171 Non-standard residues in 61.2.pdb #307 
    9172 --- 
    9173 HSD — (HSD) 
    9174 POT — (POT) 
    9175  
    9176 
    9177 > open
    9178 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/61.4.pdb
    9179 
    9180 Summary of feedback from opening
    9181 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/61.4.pdb 
    9182 --- 
    9183 warnings | Ignored bad PDB record found on line 1 
    9184 REMARK GENERATED BY TRJCONV 
    9185  
    9186 Ignored bad PDB record found on line 3 
    9187 REMARK THIS IS A SIMULATION BOX 
    9188  
    9189 61.4.pdb title: 
    9190 Title t= 61400.00000 step= 30700000 [more info...] 
    9191  
    9192 Chain information for 61.4.pdb #308 
    9193 --- 
    9194 Chain | Description 
    9195 A B | No description available 
    9196  
    9197 Non-standard residues in 61.4.pdb #308 
    9198 --- 
    9199 HSD — (HSD) 
    9200 POT — (POT) 
    9201  
    9202 
    9203 > open
    9204 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/61.6.pdb
    9205 
    9206 Summary of feedback from opening
    9207 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/61.6.pdb 
    9208 --- 
    9209 warnings | Ignored bad PDB record found on line 1 
    9210 REMARK GENERATED BY TRJCONV 
    9211  
    9212 Ignored bad PDB record found on line 3 
    9213 REMARK THIS IS A SIMULATION BOX 
    9214  
    9215 61.6.pdb title: 
    9216 Title t= 61600.00000 step= 30800000 [more info...] 
    9217  
    9218 Chain information for 61.6.pdb #309 
    9219 --- 
    9220 Chain | Description 
    9221 A B | No description available 
    9222  
    9223 Non-standard residues in 61.6.pdb #309 
    9224 --- 
    9225 HSD — (HSD) 
    9226 POT — (POT) 
    9227  
    9228 
    9229 > open
    9230 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/61.8.pdb
    9231 
    9232 Summary of feedback from opening
    9233 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/61.8.pdb 
    9234 --- 
    9235 warnings | Ignored bad PDB record found on line 1 
    9236 REMARK GENERATED BY TRJCONV 
    9237  
    9238 Ignored bad PDB record found on line 3 
    9239 REMARK THIS IS A SIMULATION BOX 
    9240  
    9241 61.8.pdb title: 
    9242 Title t= 61800.00000 step= 30900000 [more info...] 
    9243  
    9244 Chain information for 61.8.pdb #310 
    9245 --- 
    9246 Chain | Description 
    9247 A B | No description available 
    9248  
    9249 Non-standard residues in 61.8.pdb #310 
    9250 --- 
    9251 HSD — (HSD) 
    9252 POT — (POT) 
    9253  
    9254 
    9255 > open
    9256 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/62.0.pdb
    9257 
    9258 Summary of feedback from opening
    9259 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/62.0.pdb 
    9260 --- 
    9261 warnings | Ignored bad PDB record found on line 1 
    9262 REMARK GENERATED BY TRJCONV 
    9263  
    9264 Ignored bad PDB record found on line 3 
    9265 REMARK THIS IS A SIMULATION BOX 
    9266  
    9267 62.0.pdb title: 
    9268 Title t= 62000.00000 step= 31000000 [more info...] 
    9269  
    9270 Chain information for 62.0.pdb #311 
    9271 --- 
    9272 Chain | Description 
    9273 A B | No description available 
    9274  
    9275 Non-standard residues in 62.0.pdb #311 
    9276 --- 
    9277 HSD — (HSD) 
    9278 POT — (POT) 
    9279  
    9280 
    9281 > open
    9282 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/62.2.pdb
    9283 
    9284 Summary of feedback from opening
    9285 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/62.2.pdb 
    9286 --- 
    9287 warnings | Ignored bad PDB record found on line 1 
    9288 REMARK GENERATED BY TRJCONV 
    9289  
    9290 Ignored bad PDB record found on line 3 
    9291 REMARK THIS IS A SIMULATION BOX 
    9292  
    9293 62.2.pdb title: 
    9294 Title t= 62200.00000 step= 31100000 [more info...] 
    9295  
    9296 Chain information for 62.2.pdb #312 
    9297 --- 
    9298 Chain | Description 
    9299 A B | No description available 
    9300  
    9301 Non-standard residues in 62.2.pdb #312 
    9302 --- 
    9303 HSD — (HSD) 
    9304 POT — (POT) 
    9305  
    9306 
    9307 > open
    9308 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/62.4.pdb
    9309 
    9310 Summary of feedback from opening
    9311 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/62.4.pdb 
    9312 --- 
    9313 warnings | Ignored bad PDB record found on line 1 
    9314 REMARK GENERATED BY TRJCONV 
    9315  
    9316 Ignored bad PDB record found on line 3 
    9317 REMARK THIS IS A SIMULATION BOX 
    9318  
    9319 62.4.pdb title: 
    9320 Title t= 62400.00000 step= 31200000 [more info...] 
    9321  
    9322 Chain information for 62.4.pdb #313 
    9323 --- 
    9324 Chain | Description 
    9325 A B | No description available 
    9326  
    9327 Non-standard residues in 62.4.pdb #313 
    9328 --- 
    9329 HSD — (HSD) 
    9330 POT — (POT) 
    9331  
    9332 
    9333 > open
    9334 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/62.6.pdb
    9335 
    9336 Summary of feedback from opening
    9337 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/62.6.pdb 
    9338 --- 
    9339 warnings | Ignored bad PDB record found on line 1 
    9340 REMARK GENERATED BY TRJCONV 
    9341  
    9342 Ignored bad PDB record found on line 3 
    9343 REMARK THIS IS A SIMULATION BOX 
    9344  
    9345 62.6.pdb title: 
    9346 Title t= 62600.00000 step= 31300000 [more info...] 
    9347  
    9348 Chain information for 62.6.pdb #314 
    9349 --- 
    9350 Chain | Description 
    9351 A B | No description available 
    9352  
    9353 Non-standard residues in 62.6.pdb #314 
    9354 --- 
    9355 HSD — (HSD) 
    9356 POT — (POT) 
    9357  
    9358 
    9359 > open
    9360 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/62.8.pdb
    9361 
    9362 Summary of feedback from opening
    9363 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/62.8.pdb 
    9364 --- 
    9365 warnings | Ignored bad PDB record found on line 1 
    9366 REMARK GENERATED BY TRJCONV 
    9367  
    9368 Ignored bad PDB record found on line 3 
    9369 REMARK THIS IS A SIMULATION BOX 
    9370  
    9371 62.8.pdb title: 
    9372 Title t= 62800.00000 step= 31400000 [more info...] 
    9373  
    9374 Chain information for 62.8.pdb #315 
    9375 --- 
    9376 Chain | Description 
    9377 A B | No description available 
    9378  
    9379 Non-standard residues in 62.8.pdb #315 
    9380 --- 
    9381 HSD — (HSD) 
    9382 POT — (POT) 
    9383  
    9384 
    9385 > open
    9386 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/63.0.pdb
    9387 
    9388 Summary of feedback from opening
    9389 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/63.0.pdb 
    9390 --- 
    9391 warnings | Ignored bad PDB record found on line 1 
    9392 REMARK GENERATED BY TRJCONV 
    9393  
    9394 Ignored bad PDB record found on line 3 
    9395 REMARK THIS IS A SIMULATION BOX 
    9396  
    9397 63.0.pdb title: 
    9398 Title t= 63000.00000 step= 31500000 [more info...] 
    9399  
    9400 Chain information for 63.0.pdb #316 
    9401 --- 
    9402 Chain | Description 
    9403 A B | No description available 
    9404  
    9405 Non-standard residues in 63.0.pdb #316 
    9406 --- 
    9407 HSD — (HSD) 
    9408 POT — (POT) 
    9409  
    9410 
    9411 > open
    9412 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/63.2.pdb
    9413 
    9414 Summary of feedback from opening
    9415 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/63.2.pdb 
    9416 --- 
    9417 warnings | Ignored bad PDB record found on line 1 
    9418 REMARK GENERATED BY TRJCONV 
    9419  
    9420 Ignored bad PDB record found on line 3 
    9421 REMARK THIS IS A SIMULATION BOX 
    9422  
    9423 63.2.pdb title: 
    9424 Title t= 63200.00000 step= 31600000 [more info...] 
    9425  
    9426 Chain information for 63.2.pdb #317 
    9427 --- 
    9428 Chain | Description 
    9429 A B | No description available 
    9430  
    9431 Non-standard residues in 63.2.pdb #317 
    9432 --- 
    9433 HSD — (HSD) 
    9434 POT — (POT) 
    9435  
    9436 
    9437 > open
    9438 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/63.4.pdb
    9439 
    9440 Summary of feedback from opening
    9441 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/63.4.pdb 
    9442 --- 
    9443 warnings | Ignored bad PDB record found on line 1 
    9444 REMARK GENERATED BY TRJCONV 
    9445  
    9446 Ignored bad PDB record found on line 3 
    9447 REMARK THIS IS A SIMULATION BOX 
    9448  
    9449 63.4.pdb title: 
    9450 Title t= 63400.00000 step= 31700000 [more info...] 
    9451  
    9452 Chain information for 63.4.pdb #318 
    9453 --- 
    9454 Chain | Description 
    9455 A B | No description available 
    9456  
    9457 Non-standard residues in 63.4.pdb #318 
    9458 --- 
    9459 HSD — (HSD) 
    9460 POT — (POT) 
    9461  
    9462 
    9463 > open
    9464 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/63.6.pdb
    9465 
    9466 Summary of feedback from opening
    9467 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/63.6.pdb 
    9468 --- 
    9469 warnings | Ignored bad PDB record found on line 1 
    9470 REMARK GENERATED BY TRJCONV 
    9471  
    9472 Ignored bad PDB record found on line 3 
    9473 REMARK THIS IS A SIMULATION BOX 
    9474  
    9475 63.6.pdb title: 
    9476 Title t= 63600.00000 step= 31800000 [more info...] 
    9477  
    9478 Chain information for 63.6.pdb #319 
    9479 --- 
    9480 Chain | Description 
    9481 A B | No description available 
    9482  
    9483 Non-standard residues in 63.6.pdb #319 
    9484 --- 
    9485 HSD — (HSD) 
    9486 POT — (POT) 
    9487  
    9488 
    9489 > open
    9490 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/63.8.pdb
    9491 
    9492 Summary of feedback from opening
    9493 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/63.8.pdb 
    9494 --- 
    9495 warnings | Ignored bad PDB record found on line 1 
    9496 REMARK GENERATED BY TRJCONV 
    9497  
    9498 Ignored bad PDB record found on line 3 
    9499 REMARK THIS IS A SIMULATION BOX 
    9500  
    9501 63.8.pdb title: 
    9502 Title t= 63800.00000 step= 31900000 [more info...] 
    9503  
    9504 Chain information for 63.8.pdb #320 
    9505 --- 
    9506 Chain | Description 
    9507 A B | No description available 
    9508  
    9509 Non-standard residues in 63.8.pdb #320 
    9510 --- 
    9511 HSD — (HSD) 
    9512 POT — (POT) 
    9513  
    9514 
    9515 > open
    9516 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/64.0.pdb
    9517 
    9518 Summary of feedback from opening
    9519 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/64.0.pdb 
    9520 --- 
    9521 warnings | Ignored bad PDB record found on line 1 
    9522 REMARK GENERATED BY TRJCONV 
    9523  
    9524 Ignored bad PDB record found on line 3 
    9525 REMARK THIS IS A SIMULATION BOX 
    9526  
    9527 64.0.pdb title: 
    9528 Title t= 64000.00000 step= 32000000 [more info...] 
    9529  
    9530 Chain information for 64.0.pdb #321 
    9531 --- 
    9532 Chain | Description 
    9533 A B | No description available 
    9534  
    9535 Non-standard residues in 64.0.pdb #321 
    9536 --- 
    9537 HSD — (HSD) 
    9538 POT — (POT) 
    9539  
    9540 
    9541 > open
    9542 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/64.2.pdb
    9543 
    9544 Summary of feedback from opening
    9545 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/64.2.pdb 
    9546 --- 
    9547 warnings | Ignored bad PDB record found on line 1 
    9548 REMARK GENERATED BY TRJCONV 
    9549  
    9550 Ignored bad PDB record found on line 3 
    9551 REMARK THIS IS A SIMULATION BOX 
    9552  
    9553 64.2.pdb title: 
    9554 Title t= 64200.00000 step= 32100000 [more info...] 
    9555  
    9556 Chain information for 64.2.pdb #322 
    9557 --- 
    9558 Chain | Description 
    9559 A B | No description available 
    9560  
    9561 Non-standard residues in 64.2.pdb #322 
    9562 --- 
    9563 HSD — (HSD) 
    9564 POT — (POT) 
    9565  
    9566 
    9567 > open
    9568 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/64.4.pdb
    9569 
    9570 Summary of feedback from opening
    9571 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/64.4.pdb 
    9572 --- 
    9573 warnings | Ignored bad PDB record found on line 1 
    9574 REMARK GENERATED BY TRJCONV 
    9575  
    9576 Ignored bad PDB record found on line 3 
    9577 REMARK THIS IS A SIMULATION BOX 
    9578  
    9579 64.4.pdb title: 
    9580 Title t= 64400.00000 step= 32200000 [more info...] 
    9581  
    9582 Chain information for 64.4.pdb #323 
    9583 --- 
    9584 Chain | Description 
    9585 A B | No description available 
    9586  
    9587 Non-standard residues in 64.4.pdb #323 
    9588 --- 
    9589 HSD — (HSD) 
    9590 POT — (POT) 
    9591  
    9592 
    9593 > open
    9594 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/64.6.pdb
    9595 
    9596 Summary of feedback from opening
    9597 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/64.6.pdb 
    9598 --- 
    9599 warnings | Ignored bad PDB record found on line 1 
    9600 REMARK GENERATED BY TRJCONV 
    9601  
    9602 Ignored bad PDB record found on line 3 
    9603 REMARK THIS IS A SIMULATION BOX 
    9604  
    9605 64.6.pdb title: 
    9606 Title t= 64600.00000 step= 32300000 [more info...] 
    9607  
    9608 Chain information for 64.6.pdb #324 
    9609 --- 
    9610 Chain | Description 
    9611 A B | No description available 
    9612  
    9613 Non-standard residues in 64.6.pdb #324 
    9614 --- 
    9615 HSD — (HSD) 
    9616 POT — (POT) 
    9617  
    9618 
    9619 > open
    9620 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/64.8.pdb
    9621 
    9622 Summary of feedback from opening
    9623 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/64.8.pdb 
    9624 --- 
    9625 warnings | Ignored bad PDB record found on line 1 
    9626 REMARK GENERATED BY TRJCONV 
    9627  
    9628 Ignored bad PDB record found on line 3 
    9629 REMARK THIS IS A SIMULATION BOX 
    9630  
    9631 64.8.pdb title: 
    9632 Title t= 64800.00000 step= 32400000 [more info...] 
    9633  
    9634 Chain information for 64.8.pdb #325 
    9635 --- 
    9636 Chain | Description 
    9637 A B | No description available 
    9638  
    9639 Non-standard residues in 64.8.pdb #325 
    9640 --- 
    9641 HSD — (HSD) 
    9642 POT — (POT) 
    9643  
    9644 
    9645 > open
    9646 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/65.0.pdb
    9647 
    9648 Summary of feedback from opening
    9649 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/65.0.pdb 
    9650 --- 
    9651 warnings | Ignored bad PDB record found on line 1 
    9652 REMARK GENERATED BY TRJCONV 
    9653  
    9654 Ignored bad PDB record found on line 3 
    9655 REMARK THIS IS A SIMULATION BOX 
    9656  
    9657 65.0.pdb title: 
    9658 Title t= 65000.00000 step= 32500000 [more info...] 
    9659  
    9660 Chain information for 65.0.pdb #326 
    9661 --- 
    9662 Chain | Description 
    9663 A B | No description available 
    9664  
    9665 Non-standard residues in 65.0.pdb #326 
    9666 --- 
    9667 HSD — (HSD) 
    9668 POT — (POT) 
    9669  
    9670 
    9671 > open
    9672 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/65.2.pdb
    9673 
    9674 Summary of feedback from opening
    9675 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/65.2.pdb 
    9676 --- 
    9677 warnings | Ignored bad PDB record found on line 1 
    9678 REMARK GENERATED BY TRJCONV 
    9679  
    9680 Ignored bad PDB record found on line 3 
    9681 REMARK THIS IS A SIMULATION BOX 
    9682  
    9683 65.2.pdb title: 
    9684 Title t= 65200.00000 step= 32600000 [more info...] 
    9685  
    9686 Chain information for 65.2.pdb #327 
    9687 --- 
    9688 Chain | Description 
    9689 A B | No description available 
    9690  
    9691 Non-standard residues in 65.2.pdb #327 
    9692 --- 
    9693 HSD — (HSD) 
    9694 POT — (POT) 
    9695  
    9696 
    9697 > open
    9698 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/65.4.pdb
    9699 
    9700 Summary of feedback from opening
    9701 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/65.4.pdb 
    9702 --- 
    9703 warnings | Ignored bad PDB record found on line 1 
    9704 REMARK GENERATED BY TRJCONV 
    9705  
    9706 Ignored bad PDB record found on line 3 
    9707 REMARK THIS IS A SIMULATION BOX 
    9708  
    9709 65.4.pdb title: 
    9710 Title t= 65400.00000 step= 32700000 [more info...] 
    9711  
    9712 Chain information for 65.4.pdb #328 
    9713 --- 
    9714 Chain | Description 
    9715 A B | No description available 
    9716  
    9717 Non-standard residues in 65.4.pdb #328 
    9718 --- 
    9719 HSD — (HSD) 
    9720 POT — (POT) 
    9721  
    9722 
    9723 > open
    9724 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/65.6.pdb
    9725 
    9726 Summary of feedback from opening
    9727 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/65.6.pdb 
    9728 --- 
    9729 warnings | Ignored bad PDB record found on line 1 
    9730 REMARK GENERATED BY TRJCONV 
    9731  
    9732 Ignored bad PDB record found on line 3 
    9733 REMARK THIS IS A SIMULATION BOX 
    9734  
    9735 65.6.pdb title: 
    9736 Title t= 65600.00000 step= 32800000 [more info...] 
    9737  
    9738 Chain information for 65.6.pdb #329 
    9739 --- 
    9740 Chain | Description 
    9741 A B | No description available 
    9742  
    9743 Non-standard residues in 65.6.pdb #329 
    9744 --- 
    9745 HSD — (HSD) 
    9746 POT — (POT) 
    9747  
    9748 
    9749 > open
    9750 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/65.8.pdb
    9751 
    9752 Summary of feedback from opening
    9753 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/65.8.pdb 
    9754 --- 
    9755 warnings | Ignored bad PDB record found on line 1 
    9756 REMARK GENERATED BY TRJCONV 
    9757  
    9758 Ignored bad PDB record found on line 3 
    9759 REMARK THIS IS A SIMULATION BOX 
    9760  
    9761 65.8.pdb title: 
    9762 Title t= 65800.00000 step= 32900000 [more info...] 
    9763  
    9764 Chain information for 65.8.pdb #330 
    9765 --- 
    9766 Chain | Description 
    9767 A B | No description available 
    9768  
    9769 Non-standard residues in 65.8.pdb #330 
    9770 --- 
    9771 HSD — (HSD) 
    9772 POT — (POT) 
    9773  
    9774 
    9775 > open
    9776 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/66.0.pdb
    9777 
    9778 Summary of feedback from opening
    9779 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/66.0.pdb 
    9780 --- 
    9781 warnings | Ignored bad PDB record found on line 1 
    9782 REMARK GENERATED BY TRJCONV 
    9783  
    9784 Ignored bad PDB record found on line 3 
    9785 REMARK THIS IS A SIMULATION BOX 
    9786  
    9787 66.0.pdb title: 
    9788 Title t= 66000.00000 step= 33000000 [more info...] 
    9789  
    9790 Chain information for 66.0.pdb #331 
    9791 --- 
    9792 Chain | Description 
    9793 A B | No description available 
    9794  
    9795 Non-standard residues in 66.0.pdb #331 
    9796 --- 
    9797 HSD — (HSD) 
    9798 POT — (POT) 
    9799  
    9800 
    9801 > open
    9802 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/66.2.pdb
    9803 
    9804 Summary of feedback from opening
    9805 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/66.2.pdb 
    9806 --- 
    9807 warnings | Ignored bad PDB record found on line 1 
    9808 REMARK GENERATED BY TRJCONV 
    9809  
    9810 Ignored bad PDB record found on line 3 
    9811 REMARK THIS IS A SIMULATION BOX 
    9812  
    9813 66.2.pdb title: 
    9814 Title t= 66200.00000 step= 33100000 [more info...] 
    9815  
    9816 Chain information for 66.2.pdb #332 
    9817 --- 
    9818 Chain | Description 
    9819 A B | No description available 
    9820  
    9821 Non-standard residues in 66.2.pdb #332 
    9822 --- 
    9823 HSD — (HSD) 
    9824 POT — (POT) 
    9825  
    9826 
    9827 > open
    9828 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/66.4.pdb
    9829 
    9830 Summary of feedback from opening
    9831 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/66.4.pdb 
    9832 --- 
    9833 warnings | Ignored bad PDB record found on line 1 
    9834 REMARK GENERATED BY TRJCONV 
    9835  
    9836 Ignored bad PDB record found on line 3 
    9837 REMARK THIS IS A SIMULATION BOX 
    9838  
    9839 66.4.pdb title: 
    9840 Title t= 66400.00000 step= 33200000 [more info...] 
    9841  
    9842 Chain information for 66.4.pdb #333 
    9843 --- 
    9844 Chain | Description 
    9845 A B | No description available 
    9846  
    9847 Non-standard residues in 66.4.pdb #333 
    9848 --- 
    9849 HSD — (HSD) 
    9850 POT — (POT) 
    9851  
    9852 
    9853 > open
    9854 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/66.6.pdb
    9855 
    9856 Summary of feedback from opening
    9857 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/66.6.pdb 
    9858 --- 
    9859 warnings | Ignored bad PDB record found on line 1 
    9860 REMARK GENERATED BY TRJCONV 
    9861  
    9862 Ignored bad PDB record found on line 3 
    9863 REMARK THIS IS A SIMULATION BOX 
    9864  
    9865 66.6.pdb title: 
    9866 Title t= 66600.00000 step= 33300000 [more info...] 
    9867  
    9868 Chain information for 66.6.pdb #334 
    9869 --- 
    9870 Chain | Description 
    9871 A B | No description available 
    9872  
    9873 Non-standard residues in 66.6.pdb #334 
    9874 --- 
    9875 HSD — (HSD) 
    9876 POT — (POT) 
    9877  
    9878 
    9879 > open
    9880 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/66.8.pdb
    9881 
    9882 Summary of feedback from opening
    9883 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/66.8.pdb 
    9884 --- 
    9885 warnings | Ignored bad PDB record found on line 1 
    9886 REMARK GENERATED BY TRJCONV 
    9887  
    9888 Ignored bad PDB record found on line 3 
    9889 REMARK THIS IS A SIMULATION BOX 
    9890  
    9891 66.8.pdb title: 
    9892 Title t= 66800.00000 step= 33400000 [more info...] 
    9893  
    9894 Chain information for 66.8.pdb #335 
    9895 --- 
    9896 Chain | Description 
    9897 A B | No description available 
    9898  
    9899 Non-standard residues in 66.8.pdb #335 
    9900 --- 
    9901 HSD — (HSD) 
    9902 POT — (POT) 
    9903  
    9904 
    9905 > open
    9906 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/67.0.pdb
    9907 
    9908 Summary of feedback from opening
    9909 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/67.0.pdb 
    9910 --- 
    9911 warnings | Ignored bad PDB record found on line 1 
    9912 REMARK GENERATED BY TRJCONV 
    9913  
    9914 Ignored bad PDB record found on line 3 
    9915 REMARK THIS IS A SIMULATION BOX 
    9916  
    9917 67.0.pdb title: 
    9918 Title t= 67000.00000 step= 33500000 [more info...] 
    9919  
    9920 Chain information for 67.0.pdb #336 
    9921 --- 
    9922 Chain | Description 
    9923 A B | No description available 
    9924  
    9925 Non-standard residues in 67.0.pdb #336 
    9926 --- 
    9927 HSD — (HSD) 
    9928 POT — (POT) 
    9929  
    9930 
    9931 > open
    9932 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/67.2.pdb
    9933 
    9934 Summary of feedback from opening
    9935 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/67.2.pdb 
    9936 --- 
    9937 warnings | Ignored bad PDB record found on line 1 
    9938 REMARK GENERATED BY TRJCONV 
    9939  
    9940 Ignored bad PDB record found on line 3 
    9941 REMARK THIS IS A SIMULATION BOX 
    9942  
    9943 67.2.pdb title: 
    9944 Title t= 67200.00000 step= 33600000 [more info...] 
    9945  
    9946 Chain information for 67.2.pdb #337 
    9947 --- 
    9948 Chain | Description 
    9949 A B | No description available 
    9950  
    9951 Non-standard residues in 67.2.pdb #337 
    9952 --- 
    9953 HSD — (HSD) 
    9954 POT — (POT) 
    9955  
    9956 
    9957 > open
    9958 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/67.4.pdb
    9959 
    9960 Summary of feedback from opening
    9961 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/67.4.pdb 
    9962 --- 
    9963 warnings | Ignored bad PDB record found on line 1 
    9964 REMARK GENERATED BY TRJCONV 
    9965  
    9966 Ignored bad PDB record found on line 3 
    9967 REMARK THIS IS A SIMULATION BOX 
    9968  
    9969 67.4.pdb title: 
    9970 Title t= 67400.00000 step= 33700000 [more info...] 
    9971  
    9972 Chain information for 67.4.pdb #338 
    9973 --- 
    9974 Chain | Description 
    9975 A B | No description available 
    9976  
    9977 Non-standard residues in 67.4.pdb #338 
    9978 --- 
    9979 HSD — (HSD) 
    9980 POT — (POT) 
    9981  
    9982 
    9983 > open
    9984 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/67.6.pdb
    9985 
    9986 Summary of feedback from opening
    9987 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/67.6.pdb 
    9988 --- 
    9989 warnings | Ignored bad PDB record found on line 1 
    9990 REMARK GENERATED BY TRJCONV 
    9991  
    9992 Ignored bad PDB record found on line 3 
    9993 REMARK THIS IS A SIMULATION BOX 
    9994  
    9995 67.6.pdb title: 
    9996 Title t= 67600.00000 step= 33800000 [more info...] 
    9997  
    9998 Chain information for 67.6.pdb #339 
    9999 --- 
    10000 Chain | Description 
    10001 A B | No description available 
    10002  
    10003 Non-standard residues in 67.6.pdb #339 
    10004 --- 
    10005 HSD — (HSD) 
    10006 POT — (POT) 
    10007  
    10008 
    10009 > open
    10010 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/67.8.pdb
    10011 
    10012 Summary of feedback from opening
    10013 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/67.8.pdb 
    10014 --- 
    10015 warnings | Ignored bad PDB record found on line 1 
    10016 REMARK GENERATED BY TRJCONV 
    10017  
    10018 Ignored bad PDB record found on line 3 
    10019 REMARK THIS IS A SIMULATION BOX 
    10020  
    10021 67.8.pdb title: 
    10022 Title t= 67800.00000 step= 33900000 [more info...] 
    10023  
    10024 Chain information for 67.8.pdb #340 
    10025 --- 
    10026 Chain | Description 
    10027 A B | No description available 
    10028  
    10029 Non-standard residues in 67.8.pdb #340 
    10030 --- 
    10031 HSD — (HSD) 
    10032 POT — (POT) 
    10033  
    10034 
    10035 > open
    10036 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/68.0.pdb
    10037 
    10038 Summary of feedback from opening
    10039 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/68.0.pdb 
    10040 --- 
    10041 warnings | Ignored bad PDB record found on line 1 
    10042 REMARK GENERATED BY TRJCONV 
    10043  
    10044 Ignored bad PDB record found on line 3 
    10045 REMARK THIS IS A SIMULATION BOX 
    10046  
    10047 68.0.pdb title: 
    10048 Title t= 68000.00000 step= 34000000 [more info...] 
    10049  
    10050 Chain information for 68.0.pdb #341 
    10051 --- 
    10052 Chain | Description 
    10053 A B | No description available 
    10054  
    10055 Non-standard residues in 68.0.pdb #341 
    10056 --- 
    10057 HSD — (HSD) 
    10058 POT — (POT) 
    10059  
    10060 
    10061 > open
    10062 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/68.2.pdb
    10063 
    10064 Summary of feedback from opening
    10065 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/68.2.pdb 
    10066 --- 
    10067 warnings | Ignored bad PDB record found on line 1 
    10068 REMARK GENERATED BY TRJCONV 
    10069  
    10070 Ignored bad PDB record found on line 3 
    10071 REMARK THIS IS A SIMULATION BOX 
    10072  
    10073 68.2.pdb title: 
    10074 Title t= 68200.00000 step= 34100000 [more info...] 
    10075  
    10076 Chain information for 68.2.pdb #342 
    10077 --- 
    10078 Chain | Description 
    10079 A B | No description available 
    10080  
    10081 Non-standard residues in 68.2.pdb #342 
    10082 --- 
    10083 HSD — (HSD) 
    10084 POT — (POT) 
    10085  
    10086 
    10087 > open
    10088 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/68.4.pdb
    10089 
    10090 Summary of feedback from opening
    10091 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/68.4.pdb 
    10092 --- 
    10093 warnings | Ignored bad PDB record found on line 1 
    10094 REMARK GENERATED BY TRJCONV 
    10095  
    10096 Ignored bad PDB record found on line 3 
    10097 REMARK THIS IS A SIMULATION BOX 
    10098  
    10099 68.4.pdb title: 
    10100 Title t= 68400.00000 step= 34200000 [more info...] 
    10101  
    10102 Chain information for 68.4.pdb #343 
    10103 --- 
    10104 Chain | Description 
    10105 A B | No description available 
    10106  
    10107 Non-standard residues in 68.4.pdb #343 
    10108 --- 
    10109 HSD — (HSD) 
    10110 POT — (POT) 
    10111  
    10112 
    10113 > open
    10114 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/68.6.pdb
    10115 
    10116 Summary of feedback from opening
    10117 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/68.6.pdb 
    10118 --- 
    10119 warnings | Ignored bad PDB record found on line 1 
    10120 REMARK GENERATED BY TRJCONV 
    10121  
    10122 Ignored bad PDB record found on line 3 
    10123 REMARK THIS IS A SIMULATION BOX 
    10124  
    10125 68.6.pdb title: 
    10126 Title t= 68600.00000 step= 34300000 [more info...] 
    10127  
    10128 Chain information for 68.6.pdb #344 
    10129 --- 
    10130 Chain | Description 
    10131 A B | No description available 
    10132  
    10133 Non-standard residues in 68.6.pdb #344 
    10134 --- 
    10135 HSD — (HSD) 
    10136 POT — (POT) 
    10137  
    10138 
    10139 > open
    10140 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/68.8.pdb
    10141 
    10142 Summary of feedback from opening
    10143 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/68.8.pdb 
    10144 --- 
    10145 warnings | Ignored bad PDB record found on line 1 
    10146 REMARK GENERATED BY TRJCONV 
    10147  
    10148 Ignored bad PDB record found on line 3 
    10149 REMARK THIS IS A SIMULATION BOX 
    10150  
    10151 68.8.pdb title: 
    10152 Title t= 68800.00000 step= 34400000 [more info...] 
    10153  
    10154 Chain information for 68.8.pdb #345 
    10155 --- 
    10156 Chain | Description 
    10157 A B | No description available 
    10158  
    10159 Non-standard residues in 68.8.pdb #345 
    10160 --- 
    10161 HSD — (HSD) 
    10162 POT — (POT) 
    10163  
    10164 
    10165 > open
    10166 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/69.0.pdb
    10167 
    10168 Summary of feedback from opening
    10169 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/69.0.pdb 
    10170 --- 
    10171 warnings | Ignored bad PDB record found on line 1 
    10172 REMARK GENERATED BY TRJCONV 
    10173  
    10174 Ignored bad PDB record found on line 3 
    10175 REMARK THIS IS A SIMULATION BOX 
    10176  
    10177 69.0.pdb title: 
    10178 Title t= 69000.00000 step= 34500000 [more info...] 
    10179  
    10180 Chain information for 69.0.pdb #346 
    10181 --- 
    10182 Chain | Description 
    10183 A B | No description available 
    10184  
    10185 Non-standard residues in 69.0.pdb #346 
    10186 --- 
    10187 HSD — (HSD) 
    10188 POT — (POT) 
    10189  
    10190 
    10191 > open
    10192 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/69.2.pdb
    10193 
    10194 Summary of feedback from opening
    10195 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/69.2.pdb 
    10196 --- 
    10197 warnings | Ignored bad PDB record found on line 1 
    10198 REMARK GENERATED BY TRJCONV 
    10199  
    10200 Ignored bad PDB record found on line 3 
    10201 REMARK THIS IS A SIMULATION BOX 
    10202  
    10203 69.2.pdb title: 
    10204 Title t= 69200.00000 step= 34600000 [more info...] 
    10205  
    10206 Chain information for 69.2.pdb #347 
    10207 --- 
    10208 Chain | Description 
    10209 A B | No description available 
    10210  
    10211 Non-standard residues in 69.2.pdb #347 
    10212 --- 
    10213 HSD — (HSD) 
    10214 POT — (POT) 
    10215  
    10216 
    10217 > open
    10218 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/69.4.pdb
    10219 
    10220 Summary of feedback from opening
    10221 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/69.4.pdb 
    10222 --- 
    10223 warnings | Ignored bad PDB record found on line 1 
    10224 REMARK GENERATED BY TRJCONV 
    10225  
    10226 Ignored bad PDB record found on line 3 
    10227 REMARK THIS IS A SIMULATION BOX 
    10228  
    10229 69.4.pdb title: 
    10230 Title t= 69400.00000 step= 34700000 [more info...] 
    10231  
    10232 Chain information for 69.4.pdb #348 
    10233 --- 
    10234 Chain | Description 
    10235 A B | No description available 
    10236  
    10237 Non-standard residues in 69.4.pdb #348 
    10238 --- 
    10239 HSD — (HSD) 
    10240 POT — (POT) 
    10241  
    10242 
    10243 > open
    10244 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/69.6.pdb
    10245 
    10246 Summary of feedback from opening
    10247 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/69.6.pdb 
    10248 --- 
    10249 warnings | Ignored bad PDB record found on line 1 
    10250 REMARK GENERATED BY TRJCONV 
    10251  
    10252 Ignored bad PDB record found on line 3 
    10253 REMARK THIS IS A SIMULATION BOX 
    10254  
    10255 69.6.pdb title: 
    10256 Title t= 69600.00000 step= 34800000 [more info...] 
    10257  
    10258 Chain information for 69.6.pdb #349 
    10259 --- 
    10260 Chain | Description 
    10261 A B | No description available 
    10262  
    10263 Non-standard residues in 69.6.pdb #349 
    10264 --- 
    10265 HSD — (HSD) 
    10266 POT — (POT) 
    10267  
    10268 
    10269 > open
    10270 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/69.8.pdb
    10271 
    10272 Summary of feedback from opening
    10273 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/69.8.pdb 
    10274 --- 
    10275 warnings | Ignored bad PDB record found on line 1 
    10276 REMARK GENERATED BY TRJCONV 
    10277  
    10278 Ignored bad PDB record found on line 3 
    10279 REMARK THIS IS A SIMULATION BOX 
    10280  
    10281 69.8.pdb title: 
    10282 Title t= 69800.00000 step= 34900000 [more info...] 
    10283  
    10284 Chain information for 69.8.pdb #350 
    10285 --- 
    10286 Chain | Description 
    10287 A B | No description available 
    10288  
    10289 Non-standard residues in 69.8.pdb #350 
    10290 --- 
    10291 HSD — (HSD) 
    10292 POT — (POT) 
    10293  
    10294 
    10295 > open
    10296 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/70.0.pdb
    10297 
    10298 Summary of feedback from opening
    10299 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/70.0.pdb 
    10300 --- 
    10301 warnings | Ignored bad PDB record found on line 1 
    10302 REMARK GENERATED BY TRJCONV 
    10303  
    10304 Ignored bad PDB record found on line 3 
    10305 REMARK THIS IS A SIMULATION BOX 
    10306  
    10307 70.0.pdb title: 
    10308 Title t= 70000.00000 step= 35000000 [more info...] 
    10309  
    10310 Chain information for 70.0.pdb #351 
    10311 --- 
    10312 Chain | Description 
    10313 A B | No description available 
    10314  
    10315 Non-standard residues in 70.0.pdb #351 
    10316 --- 
    10317 HSD — (HSD) 
    10318 POT — (POT) 
    10319  
    10320 
    10321 > open
    10322 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/70.2.pdb
    10323 
    10324 Summary of feedback from opening
    10325 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/70.2.pdb 
    10326 --- 
    10327 warnings | Ignored bad PDB record found on line 1 
    10328 REMARK GENERATED BY TRJCONV 
    10329  
    10330 Ignored bad PDB record found on line 3 
    10331 REMARK THIS IS A SIMULATION BOX 
    10332  
    10333 70.2.pdb title: 
    10334 Title t= 70200.00000 step= 35100000 [more info...] 
    10335  
    10336 Chain information for 70.2.pdb #352 
    10337 --- 
    10338 Chain | Description 
    10339 A B | No description available 
    10340  
    10341 Non-standard residues in 70.2.pdb #352 
    10342 --- 
    10343 HSD — (HSD) 
    10344 POT — (POT) 
    10345  
    10346 
    10347 > open
    10348 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/70.4.pdb
    10349 
    10350 Summary of feedback from opening
    10351 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/70.4.pdb 
    10352 --- 
    10353 warnings | Ignored bad PDB record found on line 1 
    10354 REMARK GENERATED BY TRJCONV 
    10355  
    10356 Ignored bad PDB record found on line 3 
    10357 REMARK THIS IS A SIMULATION BOX 
    10358  
    10359 70.4.pdb title: 
    10360 Title t= 70400.00000 step= 35200000 [more info...] 
    10361  
    10362 Chain information for 70.4.pdb #353 
    10363 --- 
    10364 Chain | Description 
    10365 A B | No description available 
    10366  
    10367 Non-standard residues in 70.4.pdb #353 
    10368 --- 
    10369 HSD — (HSD) 
    10370 POT — (POT) 
    10371  
    10372 
    10373 > open
    10374 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/70.6.pdb
    10375 
    10376 Summary of feedback from opening
    10377 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/70.6.pdb 
    10378 --- 
    10379 warnings | Ignored bad PDB record found on line 1 
    10380 REMARK GENERATED BY TRJCONV 
    10381  
    10382 Ignored bad PDB record found on line 3 
    10383 REMARK THIS IS A SIMULATION BOX 
    10384  
    10385 70.6.pdb title: 
    10386 Title t= 70600.00000 step= 35300000 [more info...] 
    10387  
    10388 Chain information for 70.6.pdb #354 
    10389 --- 
    10390 Chain | Description 
    10391 A B | No description available 
    10392  
    10393 Non-standard residues in 70.6.pdb #354 
    10394 --- 
    10395 HSD — (HSD) 
    10396 POT — (POT) 
    10397  
    10398 
    10399 > open
    10400 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/70.8.pdb
    10401 
    10402 Summary of feedback from opening
    10403 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/70.8.pdb 
    10404 --- 
    10405 warnings | Ignored bad PDB record found on line 1 
    10406 REMARK GENERATED BY TRJCONV 
    10407  
    10408 Ignored bad PDB record found on line 3 
    10409 REMARK THIS IS A SIMULATION BOX 
    10410  
    10411 70.8.pdb title: 
    10412 Title t= 70800.00000 step= 35400000 [more info...] 
    10413  
    10414 Chain information for 70.8.pdb #355 
    10415 --- 
    10416 Chain | Description 
    10417 A B | No description available 
    10418  
    10419 Non-standard residues in 70.8.pdb #355 
    10420 --- 
    10421 HSD — (HSD) 
    10422 POT — (POT) 
    10423  
    10424 
    10425 > open
    10426 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/71.0.pdb
    10427 
    10428 Summary of feedback from opening
    10429 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/71.0.pdb 
    10430 --- 
    10431 warnings | Ignored bad PDB record found on line 1 
    10432 REMARK GENERATED BY TRJCONV 
    10433  
    10434 Ignored bad PDB record found on line 3 
    10435 REMARK THIS IS A SIMULATION BOX 
    10436  
    10437 71.0.pdb title: 
    10438 Title t= 71000.00000 step= 35500000 [more info...] 
    10439  
    10440 Chain information for 71.0.pdb #356 
    10441 --- 
    10442 Chain | Description 
    10443 A B | No description available 
    10444  
    10445 Non-standard residues in 71.0.pdb #356 
    10446 --- 
    10447 HSD — (HSD) 
    10448 POT — (POT) 
    10449  
    10450 
    10451 > open
    10452 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/71.2.pdb
    10453 
    10454 Summary of feedback from opening
    10455 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/71.2.pdb 
    10456 --- 
    10457 warnings | Ignored bad PDB record found on line 1 
    10458 REMARK GENERATED BY TRJCONV 
    10459  
    10460 Ignored bad PDB record found on line 3 
    10461 REMARK THIS IS A SIMULATION BOX 
    10462  
    10463 71.2.pdb title: 
    10464 Title t= 71200.00000 step= 35600000 [more info...] 
    10465  
    10466 Chain information for 71.2.pdb #357 
    10467 --- 
    10468 Chain | Description 
    10469 A B | No description available 
    10470  
    10471 Non-standard residues in 71.2.pdb #357 
    10472 --- 
    10473 HSD — (HSD) 
    10474 POT — (POT) 
    10475  
    10476 
    10477 > open
    10478 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/71.4.pdb
    10479 
    10480 Summary of feedback from opening
    10481 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/71.4.pdb 
    10482 --- 
    10483 warnings | Ignored bad PDB record found on line 1 
    10484 REMARK GENERATED BY TRJCONV 
    10485  
    10486 Ignored bad PDB record found on line 3 
    10487 REMARK THIS IS A SIMULATION BOX 
    10488  
    10489 71.4.pdb title: 
    10490 Title t= 71400.00000 step= 35700000 [more info...] 
    10491  
    10492 Chain information for 71.4.pdb #358 
    10493 --- 
    10494 Chain | Description 
    10495 A B | No description available 
    10496  
    10497 Non-standard residues in 71.4.pdb #358 
    10498 --- 
    10499 HSD — (HSD) 
    10500 POT — (POT) 
    10501  
    10502 
    10503 > open
    10504 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/71.6.pdb
    10505 
    10506 Summary of feedback from opening
    10507 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/71.6.pdb 
    10508 --- 
    10509 warnings | Ignored bad PDB record found on line 1 
    10510 REMARK GENERATED BY TRJCONV 
    10511  
    10512 Ignored bad PDB record found on line 3 
    10513 REMARK THIS IS A SIMULATION BOX 
    10514  
    10515 71.6.pdb title: 
    10516 Title t= 71600.00000 step= 35800000 [more info...] 
    10517  
    10518 Chain information for 71.6.pdb #359 
    10519 --- 
    10520 Chain | Description 
    10521 A B | No description available 
    10522  
    10523 Non-standard residues in 71.6.pdb #359 
    10524 --- 
    10525 HSD — (HSD) 
    10526 POT — (POT) 
    10527  
    10528 
    10529 > open
    10530 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/71.8.pdb
    10531 
    10532 Summary of feedback from opening
    10533 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/71.8.pdb 
    10534 --- 
    10535 warnings | Ignored bad PDB record found on line 1 
    10536 REMARK GENERATED BY TRJCONV 
    10537  
    10538 Ignored bad PDB record found on line 3 
    10539 REMARK THIS IS A SIMULATION BOX 
    10540  
    10541 71.8.pdb title: 
    10542 Title t= 71800.00000 step= 35900000 [more info...] 
    10543  
    10544 Chain information for 71.8.pdb #360 
    10545 --- 
    10546 Chain | Description 
    10547 A B | No description available 
    10548  
    10549 Non-standard residues in 71.8.pdb #360 
    10550 --- 
    10551 HSD — (HSD) 
    10552 POT — (POT) 
    10553  
    10554 
    10555 > open
    10556 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/72.0.pdb
    10557 
    10558 Summary of feedback from opening
    10559 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/72.0.pdb 
    10560 --- 
    10561 warnings | Ignored bad PDB record found on line 1 
    10562 REMARK GENERATED BY TRJCONV 
    10563  
    10564 Ignored bad PDB record found on line 3 
    10565 REMARK THIS IS A SIMULATION BOX 
    10566  
    10567 72.0.pdb title: 
    10568 Title t= 72000.00000 step= 36000000 [more info...] 
    10569  
    10570 Chain information for 72.0.pdb #361 
    10571 --- 
    10572 Chain | Description 
    10573 A B | No description available 
    10574  
    10575 Non-standard residues in 72.0.pdb #361 
    10576 --- 
    10577 HSD — (HSD) 
    10578 POT — (POT) 
    10579  
    10580 
    10581 > open
    10582 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/72.2.pdb
    10583 
    10584 Summary of feedback from opening
    10585 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/72.2.pdb 
    10586 --- 
    10587 warnings | Ignored bad PDB record found on line 1 
    10588 REMARK GENERATED BY TRJCONV 
    10589  
    10590 Ignored bad PDB record found on line 3 
    10591 REMARK THIS IS A SIMULATION BOX 
    10592  
    10593 72.2.pdb title: 
    10594 Title t= 72200.00000 step= 36100000 [more info...] 
    10595  
    10596 Chain information for 72.2.pdb #362 
    10597 --- 
    10598 Chain | Description 
    10599 A B | No description available 
    10600  
    10601 Non-standard residues in 72.2.pdb #362 
    10602 --- 
    10603 HSD — (HSD) 
    10604 POT — (POT) 
    10605  
    10606 
    10607 > open
    10608 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/72.4.pdb
    10609 
    10610 Summary of feedback from opening
    10611 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/72.4.pdb 
    10612 --- 
    10613 warnings | Ignored bad PDB record found on line 1 
    10614 REMARK GENERATED BY TRJCONV 
    10615  
    10616 Ignored bad PDB record found on line 3 
    10617 REMARK THIS IS A SIMULATION BOX 
    10618  
    10619 72.4.pdb title: 
    10620 Title t= 72400.00000 step= 36200000 [more info...] 
    10621  
    10622 Chain information for 72.4.pdb #363 
    10623 --- 
    10624 Chain | Description 
    10625 A B | No description available 
    10626  
    10627 Non-standard residues in 72.4.pdb #363 
    10628 --- 
    10629 HSD — (HSD) 
    10630 POT — (POT) 
    10631  
    10632 
    10633 > open
    10634 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/72.6.pdb
    10635 
    10636 Summary of feedback from opening
    10637 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/72.6.pdb 
    10638 --- 
    10639 warnings | Ignored bad PDB record found on line 1 
    10640 REMARK GENERATED BY TRJCONV 
    10641  
    10642 Ignored bad PDB record found on line 3 
    10643 REMARK THIS IS A SIMULATION BOX 
    10644  
    10645 72.6.pdb title: 
    10646 Title t= 72600.00000 step= 36300000 [more info...] 
    10647  
    10648 Chain information for 72.6.pdb #364 
    10649 --- 
    10650 Chain | Description 
    10651 A B | No description available 
    10652  
    10653 Non-standard residues in 72.6.pdb #364 
    10654 --- 
    10655 HSD — (HSD) 
    10656 POT — (POT) 
    10657  
    10658 
    10659 > open
    10660 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/72.8.pdb
    10661 
    10662 Summary of feedback from opening
    10663 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/72.8.pdb 
    10664 --- 
    10665 warnings | Ignored bad PDB record found on line 1 
    10666 REMARK GENERATED BY TRJCONV 
    10667  
    10668 Ignored bad PDB record found on line 3 
    10669 REMARK THIS IS A SIMULATION BOX 
    10670  
    10671 72.8.pdb title: 
    10672 Title t= 72800.00000 step= 36400000 [more info...] 
    10673  
    10674 Chain information for 72.8.pdb #365 
    10675 --- 
    10676 Chain | Description 
    10677 A B | No description available 
    10678  
    10679 Non-standard residues in 72.8.pdb #365 
    10680 --- 
    10681 HSD — (HSD) 
    10682 POT — (POT) 
    10683  
    10684 
    10685 > open
    10686 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/73.0.pdb
    10687 
    10688 Summary of feedback from opening
    10689 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/73.0.pdb 
    10690 --- 
    10691 warnings | Ignored bad PDB record found on line 1 
    10692 REMARK GENERATED BY TRJCONV 
    10693  
    10694 Ignored bad PDB record found on line 3 
    10695 REMARK THIS IS A SIMULATION BOX 
    10696  
    10697 73.0.pdb title: 
    10698 Title t= 73000.00000 step= 36500000 [more info...] 
    10699  
    10700 Chain information for 73.0.pdb #366 
    10701 --- 
    10702 Chain | Description 
    10703 A B | No description available 
    10704  
    10705 Non-standard residues in 73.0.pdb #366 
    10706 --- 
    10707 HSD — (HSD) 
    10708 POT — (POT) 
    10709  
    10710 
    10711 > open
    10712 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/73.2.pdb
    10713 
    10714 Summary of feedback from opening
    10715 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/73.2.pdb 
    10716 --- 
    10717 warnings | Ignored bad PDB record found on line 1 
    10718 REMARK GENERATED BY TRJCONV 
    10719  
    10720 Ignored bad PDB record found on line 3 
    10721 REMARK THIS IS A SIMULATION BOX 
    10722  
    10723 73.2.pdb title: 
    10724 Title t= 73200.00000 step= 36600000 [more info...] 
    10725  
    10726 Chain information for 73.2.pdb #367 
    10727 --- 
    10728 Chain | Description 
    10729 A B | No description available 
    10730  
    10731 Non-standard residues in 73.2.pdb #367 
    10732 --- 
    10733 HSD — (HSD) 
    10734 POT — (POT) 
    10735  
    10736 
    10737 > open
    10738 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/73.4.pdb
    10739 
    10740 Summary of feedback from opening
    10741 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/73.4.pdb 
    10742 --- 
    10743 warnings | Ignored bad PDB record found on line 1 
    10744 REMARK GENERATED BY TRJCONV 
    10745  
    10746 Ignored bad PDB record found on line 3 
    10747 REMARK THIS IS A SIMULATION BOX 
    10748  
    10749 73.4.pdb title: 
    10750 Title t= 73400.00000 step= 36700000 [more info...] 
    10751  
    10752 Chain information for 73.4.pdb #368 
    10753 --- 
    10754 Chain | Description 
    10755 A B | No description available 
    10756  
    10757 Non-standard residues in 73.4.pdb #368 
    10758 --- 
    10759 HSD — (HSD) 
    10760 POT — (POT) 
    10761  
    10762 
    10763 > open
    10764 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/73.6.pdb
    10765 
    10766 Summary of feedback from opening
    10767 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/73.6.pdb 
    10768 --- 
    10769 warnings | Ignored bad PDB record found on line 1 
    10770 REMARK GENERATED BY TRJCONV 
    10771  
    10772 Ignored bad PDB record found on line 3 
    10773 REMARK THIS IS A SIMULATION BOX 
    10774  
    10775 73.6.pdb title: 
    10776 Title t= 73600.00000 step= 36800000 [more info...] 
    10777  
    10778 Chain information for 73.6.pdb #369 
    10779 --- 
    10780 Chain | Description 
    10781 A B | No description available 
    10782  
    10783 Non-standard residues in 73.6.pdb #369 
    10784 --- 
    10785 HSD — (HSD) 
    10786 POT — (POT) 
    10787  
    10788 
    10789 > open
    10790 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/73.8.pdb
    10791 
    10792 Summary of feedback from opening
    10793 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/73.8.pdb 
    10794 --- 
    10795 warnings | Ignored bad PDB record found on line 1 
    10796 REMARK GENERATED BY TRJCONV 
    10797  
    10798 Ignored bad PDB record found on line 3 
    10799 REMARK THIS IS A SIMULATION BOX 
    10800  
    10801 73.8.pdb title: 
    10802 Title t= 73800.00000 step= 36900000 [more info...] 
    10803  
    10804 Chain information for 73.8.pdb #370 
    10805 --- 
    10806 Chain | Description 
    10807 A B | No description available 
    10808  
    10809 Non-standard residues in 73.8.pdb #370 
    10810 --- 
    10811 HSD — (HSD) 
    10812 POT — (POT) 
    10813  
    10814 
    10815 > open
    10816 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/74.0.pdb
    10817 
    10818 Summary of feedback from opening
    10819 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/74.0.pdb 
    10820 --- 
    10821 warnings | Ignored bad PDB record found on line 1 
    10822 REMARK GENERATED BY TRJCONV 
    10823  
    10824 Ignored bad PDB record found on line 3 
    10825 REMARK THIS IS A SIMULATION BOX 
    10826  
    10827 74.0.pdb title: 
    10828 Title t= 74000.00000 step= 37000000 [more info...] 
    10829  
    10830 Chain information for 74.0.pdb #371 
    10831 --- 
    10832 Chain | Description 
    10833 A B | No description available 
    10834  
    10835 Non-standard residues in 74.0.pdb #371 
    10836 --- 
    10837 HSD — (HSD) 
    10838 POT — (POT) 
    10839  
    10840 
    10841 > open
    10842 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/74.2.pdb
    10843 
    10844 Summary of feedback from opening
    10845 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/74.2.pdb 
    10846 --- 
    10847 warnings | Ignored bad PDB record found on line 1 
    10848 REMARK GENERATED BY TRJCONV 
    10849  
    10850 Ignored bad PDB record found on line 3 
    10851 REMARK THIS IS A SIMULATION BOX 
    10852  
    10853 74.2.pdb title: 
    10854 Title t= 74200.00000 step= 37100000 [more info...] 
    10855  
    10856 Chain information for 74.2.pdb #372 
    10857 --- 
    10858 Chain | Description 
    10859 A B | No description available 
    10860  
    10861 Non-standard residues in 74.2.pdb #372 
    10862 --- 
    10863 HSD — (HSD) 
    10864 POT — (POT) 
    10865  
    10866 
    10867 > open
    10868 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/74.4.pdb
    10869 
    10870 Summary of feedback from opening
    10871 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/74.4.pdb 
    10872 --- 
    10873 warnings | Ignored bad PDB record found on line 1 
    10874 REMARK GENERATED BY TRJCONV 
    10875  
    10876 Ignored bad PDB record found on line 3 
    10877 REMARK THIS IS A SIMULATION BOX 
    10878  
    10879 74.4.pdb title: 
    10880 Title t= 74400.00000 step= 37200000 [more info...] 
    10881  
    10882 Chain information for 74.4.pdb #373 
    10883 --- 
    10884 Chain | Description 
    10885 A B | No description available 
    10886  
    10887 Non-standard residues in 74.4.pdb #373 
    10888 --- 
    10889 HSD — (HSD) 
    10890 POT — (POT) 
    10891  
    10892 
    10893 > open
    10894 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/74.6.pdb
    10895 
    10896 Summary of feedback from opening
    10897 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/74.6.pdb 
    10898 --- 
    10899 warnings | Ignored bad PDB record found on line 1 
    10900 REMARK GENERATED BY TRJCONV 
    10901  
    10902 Ignored bad PDB record found on line 3 
    10903 REMARK THIS IS A SIMULATION BOX 
    10904  
    10905 74.6.pdb title: 
    10906 Title t= 74600.00000 step= 37300000 [more info...] 
    10907  
    10908 Chain information for 74.6.pdb #374 
    10909 --- 
    10910 Chain | Description 
    10911 A B | No description available 
    10912  
    10913 Non-standard residues in 74.6.pdb #374 
    10914 --- 
    10915 HSD — (HSD) 
    10916 POT — (POT) 
    10917  
    10918 
    10919 > open
    10920 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/74.8.pdb
    10921 
    10922 Summary of feedback from opening
    10923 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/74.8.pdb 
    10924 --- 
    10925 warnings | Ignored bad PDB record found on line 1 
    10926 REMARK GENERATED BY TRJCONV 
    10927  
    10928 Ignored bad PDB record found on line 3 
    10929 REMARK THIS IS A SIMULATION BOX 
    10930  
    10931 74.8.pdb title: 
    10932 Title t= 74800.00000 step= 37400000 [more info...] 
    10933  
    10934 Chain information for 74.8.pdb #375 
    10935 --- 
    10936 Chain | Description 
    10937 A B | No description available 
    10938  
    10939 Non-standard residues in 74.8.pdb #375 
    10940 --- 
    10941 HSD — (HSD) 
    10942 POT — (POT) 
    10943  
    10944 
    10945 > open
    10946 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/75.0.pdb
    10947 
    10948 Summary of feedback from opening
    10949 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/75.0.pdb 
    10950 --- 
    10951 warnings | Ignored bad PDB record found on line 1 
    10952 REMARK GENERATED BY TRJCONV 
    10953  
    10954 Ignored bad PDB record found on line 3 
    10955 REMARK THIS IS A SIMULATION BOX 
    10956  
    10957 75.0.pdb title: 
    10958 Title t= 75000.00000 step= 37500000 [more info...] 
    10959  
    10960 Chain information for 75.0.pdb #376 
    10961 --- 
    10962 Chain | Description 
    10963 A B | No description available 
    10964  
    10965 Non-standard residues in 75.0.pdb #376 
    10966 --- 
    10967 HSD — (HSD) 
    10968 POT — (POT) 
    10969  
    10970 
    10971 > open
    10972 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/75.2.pdb
    10973 
    10974 Summary of feedback from opening
    10975 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/75.2.pdb 
    10976 --- 
    10977 warnings | Ignored bad PDB record found on line 1 
    10978 REMARK GENERATED BY TRJCONV 
    10979  
    10980 Ignored bad PDB record found on line 3 
    10981 REMARK THIS IS A SIMULATION BOX 
    10982  
    10983 75.2.pdb title: 
    10984 Title t= 75200.00000 step= 37600000 [more info...] 
    10985  
    10986 Chain information for 75.2.pdb #377 
    10987 --- 
    10988 Chain | Description 
    10989 A B | No description available 
    10990  
    10991 Non-standard residues in 75.2.pdb #377 
    10992 --- 
    10993 HSD — (HSD) 
    10994 POT — (POT) 
    10995  
    10996 
    10997 > open
    10998 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/75.4.pdb
    10999 
    11000 Summary of feedback from opening
    11001 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/75.4.pdb 
    11002 --- 
    11003 warnings | Ignored bad PDB record found on line 1 
    11004 REMARK GENERATED BY TRJCONV 
    11005  
    11006 Ignored bad PDB record found on line 3 
    11007 REMARK THIS IS A SIMULATION BOX 
    11008  
    11009 75.4.pdb title: 
    11010 Title t= 75400.00000 step= 37700000 [more info...] 
    11011  
    11012 Chain information for 75.4.pdb #378 
    11013 --- 
    11014 Chain | Description 
    11015 A B | No description available 
    11016  
    11017 Non-standard residues in 75.4.pdb #378 
    11018 --- 
    11019 HSD — (HSD) 
    11020 POT — (POT) 
    11021  
    11022 
    11023 > open
    11024 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/75.6.pdb
    11025 
    11026 Summary of feedback from opening
    11027 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/75.6.pdb 
    11028 --- 
    11029 warnings | Ignored bad PDB record found on line 1 
    11030 REMARK GENERATED BY TRJCONV 
    11031  
    11032 Ignored bad PDB record found on line 3 
    11033 REMARK THIS IS A SIMULATION BOX 
    11034  
    11035 75.6.pdb title: 
    11036 Title t= 75600.00000 step= 37800000 [more info...] 
    11037  
    11038 Chain information for 75.6.pdb #379 
    11039 --- 
    11040 Chain | Description 
    11041 A B | No description available 
    11042  
    11043 Non-standard residues in 75.6.pdb #379 
    11044 --- 
    11045 HSD — (HSD) 
    11046 POT — (POT) 
    11047  
    11048 
    11049 > open
    11050 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/75.8.pdb
    11051 
    11052 Summary of feedback from opening
    11053 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/75.8.pdb 
    11054 --- 
    11055 warnings | Ignored bad PDB record found on line 1 
    11056 REMARK GENERATED BY TRJCONV 
    11057  
    11058 Ignored bad PDB record found on line 3 
    11059 REMARK THIS IS A SIMULATION BOX 
    11060  
    11061 75.8.pdb title: 
    11062 Title t= 75800.00000 step= 37900000 [more info...] 
    11063  
    11064 Chain information for 75.8.pdb #380 
    11065 --- 
    11066 Chain | Description 
    11067 A B | No description available 
    11068  
    11069 Non-standard residues in 75.8.pdb #380 
    11070 --- 
    11071 HSD — (HSD) 
    11072 POT — (POT) 
    11073  
    11074 
    11075 > open
    11076 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/76.0.pdb
    11077 
    11078 Summary of feedback from opening
    11079 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/76.0.pdb 
    11080 --- 
    11081 warnings | Ignored bad PDB record found on line 1 
    11082 REMARK GENERATED BY TRJCONV 
    11083  
    11084 Ignored bad PDB record found on line 3 
    11085 REMARK THIS IS A SIMULATION BOX 
    11086  
    11087 76.0.pdb title: 
    11088 Title t= 76000.00000 step= 38000000 [more info...] 
    11089  
    11090 Chain information for 76.0.pdb #381 
    11091 --- 
    11092 Chain | Description 
    11093 A B | No description available 
    11094  
    11095 Non-standard residues in 76.0.pdb #381 
    11096 --- 
    11097 HSD — (HSD) 
    11098 POT — (POT) 
    11099  
    11100 
    11101 > open
    11102 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/76.2.pdb
    11103 
    11104 Summary of feedback from opening
    11105 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/76.2.pdb 
    11106 --- 
    11107 warnings | Ignored bad PDB record found on line 1 
    11108 REMARK GENERATED BY TRJCONV 
    11109  
    11110 Ignored bad PDB record found on line 3 
    11111 REMARK THIS IS A SIMULATION BOX 
    11112  
    11113 76.2.pdb title: 
    11114 Title t= 76200.00000 step= 38100000 [more info...] 
    11115  
    11116 Chain information for 76.2.pdb #382 
    11117 --- 
    11118 Chain | Description 
    11119 A B | No description available 
    11120  
    11121 Non-standard residues in 76.2.pdb #382 
    11122 --- 
    11123 HSD — (HSD) 
    11124 POT — (POT) 
    11125  
    11126 
    11127 > open
    11128 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/76.4.pdb
    11129 
    11130 Summary of feedback from opening
    11131 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/76.4.pdb 
    11132 --- 
    11133 warnings | Ignored bad PDB record found on line 1 
    11134 REMARK GENERATED BY TRJCONV 
    11135  
    11136 Ignored bad PDB record found on line 3 
    11137 REMARK THIS IS A SIMULATION BOX 
    11138  
    11139 76.4.pdb title: 
    11140 Title t= 76400.00000 step= 38200000 [more info...] 
    11141  
    11142 Chain information for 76.4.pdb #383 
    11143 --- 
    11144 Chain | Description 
    11145 A B | No description available 
    11146  
    11147 Non-standard residues in 76.4.pdb #383 
    11148 --- 
    11149 HSD — (HSD) 
    11150 POT — (POT) 
    11151  
    11152 
    11153 > open
    11154 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/76.6.pdb
    11155 
    11156 Summary of feedback from opening
    11157 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/76.6.pdb 
    11158 --- 
    11159 warnings | Ignored bad PDB record found on line 1 
    11160 REMARK GENERATED BY TRJCONV 
    11161  
    11162 Ignored bad PDB record found on line 3 
    11163 REMARK THIS IS A SIMULATION BOX 
    11164  
    11165 76.6.pdb title: 
    11166 Title t= 76600.00000 step= 38300000 [more info...] 
    11167  
    11168 Chain information for 76.6.pdb #384 
    11169 --- 
    11170 Chain | Description 
    11171 A B | No description available 
    11172  
    11173 Non-standard residues in 76.6.pdb #384 
    11174 --- 
    11175 HSD — (HSD) 
    11176 POT — (POT) 
    11177  
    11178 
    11179 > open
    11180 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/76.8.pdb
    11181 
    11182 Summary of feedback from opening
    11183 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/76.8.pdb 
    11184 --- 
    11185 warnings | Ignored bad PDB record found on line 1 
    11186 REMARK GENERATED BY TRJCONV 
    11187  
    11188 Ignored bad PDB record found on line 3 
    11189 REMARK THIS IS A SIMULATION BOX 
    11190  
    11191 76.8.pdb title: 
    11192 Title t= 76800.00000 step= 38400000 [more info...] 
    11193  
    11194 Chain information for 76.8.pdb #385 
    11195 --- 
    11196 Chain | Description 
    11197 A B | No description available 
    11198  
    11199 Non-standard residues in 76.8.pdb #385 
    11200 --- 
    11201 HSD — (HSD) 
    11202 POT — (POT) 
    11203  
    11204 
    11205 > open
    11206 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/77.0.pdb
    11207 
    11208 Summary of feedback from opening
    11209 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/77.0.pdb 
    11210 --- 
    11211 warnings | Ignored bad PDB record found on line 1 
    11212 REMARK GENERATED BY TRJCONV 
    11213  
    11214 Ignored bad PDB record found on line 3 
    11215 REMARK THIS IS A SIMULATION BOX 
    11216  
    11217 77.0.pdb title: 
    11218 Title t= 77000.00000 step= 38500000 [more info...] 
    11219  
    11220 Chain information for 77.0.pdb #386 
    11221 --- 
    11222 Chain | Description 
    11223 A B | No description available 
    11224  
    11225 Non-standard residues in 77.0.pdb #386 
    11226 --- 
    11227 HSD — (HSD) 
    11228 POT — (POT) 
    11229  
    11230 
    11231 > open
    11232 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/77.2.pdb
    11233 
    11234 Summary of feedback from opening
    11235 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/77.2.pdb 
    11236 --- 
    11237 warnings | Ignored bad PDB record found on line 1 
    11238 REMARK GENERATED BY TRJCONV 
    11239  
    11240 Ignored bad PDB record found on line 3 
    11241 REMARK THIS IS A SIMULATION BOX 
    11242  
    11243 77.2.pdb title: 
    11244 Title t= 77200.00000 step= 38600000 [more info...] 
    11245  
    11246 Chain information for 77.2.pdb #387 
    11247 --- 
    11248 Chain | Description 
    11249 A B | No description available 
    11250  
    11251 Non-standard residues in 77.2.pdb #387 
    11252 --- 
    11253 HSD — (HSD) 
    11254 POT — (POT) 
    11255  
    11256 
    11257 > open
    11258 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/77.4.pdb
    11259 
    11260 Summary of feedback from opening
    11261 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/77.4.pdb 
    11262 --- 
    11263 warnings | Ignored bad PDB record found on line 1 
    11264 REMARK GENERATED BY TRJCONV 
    11265  
    11266 Ignored bad PDB record found on line 3 
    11267 REMARK THIS IS A SIMULATION BOX 
    11268  
    11269 77.4.pdb title: 
    11270 Title t= 77400.00000 step= 38700000 [more info...] 
    11271  
    11272 Chain information for 77.4.pdb #388 
    11273 --- 
    11274 Chain | Description 
    11275 A B | No description available 
    11276  
    11277 Non-standard residues in 77.4.pdb #388 
    11278 --- 
    11279 HSD — (HSD) 
    11280 POT — (POT) 
    11281  
    11282 
    11283 > open
    11284 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/77.6.pdb
    11285 
    11286 Summary of feedback from opening
    11287 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/77.6.pdb 
    11288 --- 
    11289 warnings | Ignored bad PDB record found on line 1 
    11290 REMARK GENERATED BY TRJCONV 
    11291  
    11292 Ignored bad PDB record found on line 3 
    11293 REMARK THIS IS A SIMULATION BOX 
    11294  
    11295 77.6.pdb title: 
    11296 Title t= 77600.00000 step= 38800000 [more info...] 
    11297  
    11298 Chain information for 77.6.pdb #389 
    11299 --- 
    11300 Chain | Description 
    11301 A B | No description available 
    11302  
    11303 Non-standard residues in 77.6.pdb #389 
    11304 --- 
    11305 HSD — (HSD) 
    11306 POT — (POT) 
    11307  
    11308 
    11309 > open
    11310 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/77.8.pdb
    11311 
    11312 Summary of feedback from opening
    11313 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/77.8.pdb 
    11314 --- 
    11315 warnings | Ignored bad PDB record found on line 1 
    11316 REMARK GENERATED BY TRJCONV 
    11317  
    11318 Ignored bad PDB record found on line 3 
    11319 REMARK THIS IS A SIMULATION BOX 
    11320  
    11321 77.8.pdb title: 
    11322 Title t= 77800.00000 step= 38900000 [more info...] 
    11323  
    11324 Chain information for 77.8.pdb #390 
    11325 --- 
    11326 Chain | Description 
    11327 A B | No description available 
    11328  
    11329 Non-standard residues in 77.8.pdb #390 
    11330 --- 
    11331 HSD — (HSD) 
    11332 POT — (POT) 
    11333  
    11334 
    11335 > open
    11336 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/78.0.pdb
    11337 
    11338 Summary of feedback from opening
    11339 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/78.0.pdb 
    11340 --- 
    11341 warnings | Ignored bad PDB record found on line 1 
    11342 REMARK GENERATED BY TRJCONV 
    11343  
    11344 Ignored bad PDB record found on line 3 
    11345 REMARK THIS IS A SIMULATION BOX 
    11346  
    11347 78.0.pdb title: 
    11348 Title t= 78000.00000 step= 39000000 [more info...] 
    11349  
    11350 Chain information for 78.0.pdb #391 
    11351 --- 
    11352 Chain | Description 
    11353 A B | No description available 
    11354  
    11355 Non-standard residues in 78.0.pdb #391 
    11356 --- 
    11357 HSD — (HSD) 
    11358 POT — (POT) 
    11359  
    11360 
    11361 > open
    11362 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/78.2.pdb
    11363 
    11364 Summary of feedback from opening
    11365 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/78.2.pdb 
    11366 --- 
    11367 warnings | Ignored bad PDB record found on line 1 
    11368 REMARK GENERATED BY TRJCONV 
    11369  
    11370 Ignored bad PDB record found on line 3 
    11371 REMARK THIS IS A SIMULATION BOX 
    11372  
    11373 78.2.pdb title: 
    11374 Title t= 78200.00000 step= 39100000 [more info...] 
    11375  
    11376 Chain information for 78.2.pdb #392 
    11377 --- 
    11378 Chain | Description 
    11379 A B | No description available 
    11380  
    11381 Non-standard residues in 78.2.pdb #392 
    11382 --- 
    11383 HSD — (HSD) 
    11384 POT — (POT) 
    11385  
    11386 
    11387 > open
    11388 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/78.4.pdb
    11389 
    11390 Summary of feedback from opening
    11391 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/78.4.pdb 
    11392 --- 
    11393 warnings | Ignored bad PDB record found on line 1 
    11394 REMARK GENERATED BY TRJCONV 
    11395  
    11396 Ignored bad PDB record found on line 3 
    11397 REMARK THIS IS A SIMULATION BOX 
    11398  
    11399 78.4.pdb title: 
    11400 Title t= 78400.00000 step= 39200000 [more info...] 
    11401  
    11402 Chain information for 78.4.pdb #393 
    11403 --- 
    11404 Chain | Description 
    11405 A B | No description available 
    11406  
    11407 Non-standard residues in 78.4.pdb #393 
    11408 --- 
    11409 HSD — (HSD) 
    11410 POT — (POT) 
    11411  
    11412 
    11413 > open
    11414 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/78.6.pdb
    11415 
    11416 Summary of feedback from opening
    11417 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/78.6.pdb 
    11418 --- 
    11419 warnings | Ignored bad PDB record found on line 1 
    11420 REMARK GENERATED BY TRJCONV 
    11421  
    11422 Ignored bad PDB record found on line 3 
    11423 REMARK THIS IS A SIMULATION BOX 
    11424  
    11425 78.6.pdb title: 
    11426 Title t= 78600.00000 step= 39300000 [more info...] 
    11427  
    11428 Chain information for 78.6.pdb #394 
    11429 --- 
    11430 Chain | Description 
    11431 A B | No description available 
    11432  
    11433 Non-standard residues in 78.6.pdb #394 
    11434 --- 
    11435 HSD — (HSD) 
    11436 POT — (POT) 
    11437  
    11438 
    11439 > open
    11440 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/78.8.pdb
    11441 
    11442 Summary of feedback from opening
    11443 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/78.8.pdb 
    11444 --- 
    11445 warnings | Ignored bad PDB record found on line 1 
    11446 REMARK GENERATED BY TRJCONV 
    11447  
    11448 Ignored bad PDB record found on line 3 
    11449 REMARK THIS IS A SIMULATION BOX 
    11450  
    11451 78.8.pdb title: 
    11452 Title t= 78800.00000 step= 39400000 [more info...] 
    11453  
    11454 Chain information for 78.8.pdb #395 
    11455 --- 
    11456 Chain | Description 
    11457 A B | No description available 
    11458  
    11459 Non-standard residues in 78.8.pdb #395 
    11460 --- 
    11461 HSD — (HSD) 
    11462 POT — (POT) 
    11463  
    11464 
    11465 > open
    11466 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/79.0.pdb
    11467 
    11468 Summary of feedback from opening
    11469 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/79.0.pdb 
    11470 --- 
    11471 warnings | Ignored bad PDB record found on line 1 
    11472 REMARK GENERATED BY TRJCONV 
    11473  
    11474 Ignored bad PDB record found on line 3 
    11475 REMARK THIS IS A SIMULATION BOX 
    11476  
    11477 79.0.pdb title: 
    11478 Title t= 79000.00000 step= 39500000 [more info...] 
    11479  
    11480 Chain information for 79.0.pdb #396 
    11481 --- 
    11482 Chain | Description 
    11483 A B | No description available 
    11484  
    11485 Non-standard residues in 79.0.pdb #396 
    11486 --- 
    11487 HSD — (HSD) 
    11488 POT — (POT) 
    11489  
    11490 
    11491 > open
    11492 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/79.2.pdb
    11493 
    11494 Summary of feedback from opening
    11495 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/79.2.pdb 
    11496 --- 
    11497 warnings | Ignored bad PDB record found on line 1 
    11498 REMARK GENERATED BY TRJCONV 
    11499  
    11500 Ignored bad PDB record found on line 3 
    11501 REMARK THIS IS A SIMULATION BOX 
    11502  
    11503 79.2.pdb title: 
    11504 Title t= 79200.00000 step= 39600000 [more info...] 
    11505  
    11506 Chain information for 79.2.pdb #397 
    11507 --- 
    11508 Chain | Description 
    11509 A B | No description available 
    11510  
    11511 Non-standard residues in 79.2.pdb #397 
    11512 --- 
    11513 HSD — (HSD) 
    11514 POT — (POT) 
    11515  
    11516 
    11517 > open
    11518 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/79.4.pdb
    11519 
    11520 Summary of feedback from opening
    11521 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/79.4.pdb 
    11522 --- 
    11523 warnings | Ignored bad PDB record found on line 1 
    11524 REMARK GENERATED BY TRJCONV 
    11525  
    11526 Ignored bad PDB record found on line 3 
    11527 REMARK THIS IS A SIMULATION BOX 
    11528  
    11529 79.4.pdb title: 
    11530 Title t= 79400.00000 step= 39700000 [more info...] 
    11531  
    11532 Chain information for 79.4.pdb #398 
    11533 --- 
    11534 Chain | Description 
    11535 A B | No description available 
    11536  
    11537 Non-standard residues in 79.4.pdb #398 
    11538 --- 
    11539 HSD — (HSD) 
    11540 POT — (POT) 
    11541  
    11542 
    11543 > open
    11544 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/79.6.pdb
    11545 
    11546 Summary of feedback from opening
    11547 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/79.6.pdb 
    11548 --- 
    11549 warnings | Ignored bad PDB record found on line 1 
    11550 REMARK GENERATED BY TRJCONV 
    11551  
    11552 Ignored bad PDB record found on line 3 
    11553 REMARK THIS IS A SIMULATION BOX 
    11554  
    11555 79.6.pdb title: 
    11556 Title t= 79600.00000 step= 39800000 [more info...] 
    11557  
    11558 Chain information for 79.6.pdb #399 
    11559 --- 
    11560 Chain | Description 
    11561 A B | No description available 
    11562  
    11563 Non-standard residues in 79.6.pdb #399 
    11564 --- 
    11565 HSD — (HSD) 
    11566 POT — (POT) 
    11567  
    11568 
    11569 > open
    11570 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/79.8.pdb
    11571 
    11572 Summary of feedback from opening
    11573 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/79.8.pdb 
    11574 --- 
    11575 warnings | Ignored bad PDB record found on line 1 
    11576 REMARK GENERATED BY TRJCONV 
    11577  
    11578 Ignored bad PDB record found on line 3 
    11579 REMARK THIS IS A SIMULATION BOX 
    11580  
    11581 79.8.pdb title: 
    11582 Title t= 79800.00000 step= 39900000 [more info...] 
    11583  
    11584 Chain information for 79.8.pdb #400 
    11585 --- 
    11586 Chain | Description 
    11587 A B | No description available 
    11588  
    11589 Non-standard residues in 79.8.pdb #400 
    11590 --- 
    11591 HSD — (HSD) 
    11592 POT — (POT) 
    11593  
    11594 
    11595 > open
    11596 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/80.0.pdb
    11597 
    11598 Summary of feedback from opening
    11599 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/80.0.pdb 
    11600 --- 
    11601 warnings | Ignored bad PDB record found on line 1 
    11602 REMARK GENERATED BY TRJCONV 
    11603  
    11604 Ignored bad PDB record found on line 3 
    11605 REMARK THIS IS A SIMULATION BOX 
    11606  
    11607 80.0.pdb title: 
    11608 Title t= 80000.00000 step= 40000000 [more info...] 
    11609  
    11610 Chain information for 80.0.pdb #401 
    11611 --- 
    11612 Chain | Description 
    11613 A B | No description available 
    11614  
    11615 Non-standard residues in 80.0.pdb #401 
    11616 --- 
    11617 HSD — (HSD) 
    11618 POT — (POT) 
    11619  
    11620 
    11621 > open
    11622 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/80.2.pdb
    11623 
    11624 Summary of feedback from opening
    11625 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/80.2.pdb 
    11626 --- 
    11627 warnings | Ignored bad PDB record found on line 1 
    11628 REMARK GENERATED BY TRJCONV 
    11629  
    11630 Ignored bad PDB record found on line 3 
    11631 REMARK THIS IS A SIMULATION BOX 
    11632  
    11633 80.2.pdb title: 
    11634 Title t= 80200.00000 step= 40100000 [more info...] 
    11635  
    11636 Chain information for 80.2.pdb #402 
    11637 --- 
    11638 Chain | Description 
    11639 A B | No description available 
    11640  
    11641 Non-standard residues in 80.2.pdb #402 
    11642 --- 
    11643 HSD — (HSD) 
    11644 POT — (POT) 
    11645  
    11646 
    11647 > open
    11648 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/80.4.pdb
    11649 
    11650 Summary of feedback from opening
    11651 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/80.4.pdb 
    11652 --- 
    11653 warnings | Ignored bad PDB record found on line 1 
    11654 REMARK GENERATED BY TRJCONV 
    11655  
    11656 Ignored bad PDB record found on line 3 
    11657 REMARK THIS IS A SIMULATION BOX 
    11658  
    11659 80.4.pdb title: 
    11660 Title t= 80400.00000 step= 40200000 [more info...] 
    11661  
    11662 Chain information for 80.4.pdb #403 
    11663 --- 
    11664 Chain | Description 
    11665 A B | No description available 
    11666  
    11667 Non-standard residues in 80.4.pdb #403 
    11668 --- 
    11669 HSD — (HSD) 
    11670 POT — (POT) 
    11671  
    11672 
    11673 > open
    11674 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/80.6.pdb
    11675 
    11676 Summary of feedback from opening
    11677 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/80.6.pdb 
    11678 --- 
    11679 warnings | Ignored bad PDB record found on line 1 
    11680 REMARK GENERATED BY TRJCONV 
    11681  
    11682 Ignored bad PDB record found on line 3 
    11683 REMARK THIS IS A SIMULATION BOX 
    11684  
    11685 80.6.pdb title: 
    11686 Title t= 80600.00000 step= 40300000 [more info...] 
    11687  
    11688 Chain information for 80.6.pdb #404 
    11689 --- 
    11690 Chain | Description 
    11691 A B | No description available 
    11692  
    11693 Non-standard residues in 80.6.pdb #404 
    11694 --- 
    11695 HSD — (HSD) 
    11696 POT — (POT) 
    11697  
    11698 
    11699 > open
    11700 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/80.8.pdb
    11701 
    11702 Summary of feedback from opening
    11703 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/80.8.pdb 
    11704 --- 
    11705 warnings | Ignored bad PDB record found on line 1 
    11706 REMARK GENERATED BY TRJCONV 
    11707  
    11708 Ignored bad PDB record found on line 3 
    11709 REMARK THIS IS A SIMULATION BOX 
    11710  
    11711 80.8.pdb title: 
    11712 Title t= 80800.00000 step= 40400000 [more info...] 
    11713  
    11714 Chain information for 80.8.pdb #405 
    11715 --- 
    11716 Chain | Description 
    11717 A B | No description available 
    11718  
    11719 Non-standard residues in 80.8.pdb #405 
    11720 --- 
    11721 HSD — (HSD) 
    11722 POT — (POT) 
    11723  
    11724 
    11725 > open
    11726 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/81.0.pdb
    11727 
    11728 Summary of feedback from opening
    11729 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/81.0.pdb 
    11730 --- 
    11731 warnings | Ignored bad PDB record found on line 1 
    11732 REMARK GENERATED BY TRJCONV 
    11733  
    11734 Ignored bad PDB record found on line 3 
    11735 REMARK THIS IS A SIMULATION BOX 
    11736  
    11737 81.0.pdb title: 
    11738 Title t= 81000.00000 step= 40500000 [more info...] 
    11739  
    11740 Chain information for 81.0.pdb #406 
    11741 --- 
    11742 Chain | Description 
    11743 A B | No description available 
    11744  
    11745 Non-standard residues in 81.0.pdb #406 
    11746 --- 
    11747 HSD — (HSD) 
    11748 POT — (POT) 
    11749  
    11750 
    11751 > open
    11752 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/81.2.pdb
    11753 
    11754 Summary of feedback from opening
    11755 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/81.2.pdb 
    11756 --- 
    11757 warnings | Ignored bad PDB record found on line 1 
    11758 REMARK GENERATED BY TRJCONV 
    11759  
    11760 Ignored bad PDB record found on line 3 
    11761 REMARK THIS IS A SIMULATION BOX 
    11762  
    11763 81.2.pdb title: 
    11764 Title t= 81200.00000 step= 40600000 [more info...] 
    11765  
    11766 Chain information for 81.2.pdb #407 
    11767 --- 
    11768 Chain | Description 
    11769 A B | No description available 
    11770  
    11771 Non-standard residues in 81.2.pdb #407 
    11772 --- 
    11773 HSD — (HSD) 
    11774 POT — (POT) 
    11775  
    11776 
    11777 > open
    11778 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/81.4.pdb
    11779 
    11780 Summary of feedback from opening
    11781 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/81.4.pdb 
    11782 --- 
    11783 warnings | Ignored bad PDB record found on line 1 
    11784 REMARK GENERATED BY TRJCONV 
    11785  
    11786 Ignored bad PDB record found on line 3 
    11787 REMARK THIS IS A SIMULATION BOX 
    11788  
    11789 81.4.pdb title: 
    11790 Title t= 81400.00000 step= 40700000 [more info...] 
    11791  
    11792 Chain information for 81.4.pdb #408 
    11793 --- 
    11794 Chain | Description 
    11795 A B | No description available 
    11796  
    11797 Non-standard residues in 81.4.pdb #408 
    11798 --- 
    11799 HSD — (HSD) 
    11800 POT — (POT) 
    11801  
    11802 
    11803 > open
    11804 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/81.6.pdb
    11805 
    11806 Summary of feedback from opening
    11807 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/81.6.pdb 
    11808 --- 
    11809 warnings | Ignored bad PDB record found on line 1 
    11810 REMARK GENERATED BY TRJCONV 
    11811  
    11812 Ignored bad PDB record found on line 3 
    11813 REMARK THIS IS A SIMULATION BOX 
    11814  
    11815 81.6.pdb title: 
    11816 Title t= 81600.00000 step= 40800000 [more info...] 
    11817  
    11818 Chain information for 81.6.pdb #409 
    11819 --- 
    11820 Chain | Description 
    11821 A B | No description available 
    11822  
    11823 Non-standard residues in 81.6.pdb #409 
    11824 --- 
    11825 HSD — (HSD) 
    11826 POT — (POT) 
    11827  
    11828 
    11829 > open
    11830 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/81.8.pdb
    11831 
    11832 Summary of feedback from opening
    11833 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/81.8.pdb 
    11834 --- 
    11835 warnings | Ignored bad PDB record found on line 1 
    11836 REMARK GENERATED BY TRJCONV 
    11837  
    11838 Ignored bad PDB record found on line 3 
    11839 REMARK THIS IS A SIMULATION BOX 
    11840  
    11841 81.8.pdb title: 
    11842 Title t= 81800.00000 step= 40900000 [more info...] 
    11843  
    11844 Chain information for 81.8.pdb #410 
    11845 --- 
    11846 Chain | Description 
    11847 A B | No description available 
    11848  
    11849 Non-standard residues in 81.8.pdb #410 
    11850 --- 
    11851 HSD — (HSD) 
    11852 POT — (POT) 
    11853  
    11854 
    11855 > open
    11856 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/82.0.pdb
    11857 
    11858 Summary of feedback from opening
    11859 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/82.0.pdb 
    11860 --- 
    11861 warnings | Ignored bad PDB record found on line 1 
    11862 REMARK GENERATED BY TRJCONV 
    11863  
    11864 Ignored bad PDB record found on line 3 
    11865 REMARK THIS IS A SIMULATION BOX 
    11866  
    11867 82.0.pdb title: 
    11868 Title t= 82000.00000 step= 41000000 [more info...] 
    11869  
    11870 Chain information for 82.0.pdb #411 
    11871 --- 
    11872 Chain | Description 
    11873 A B | No description available 
    11874  
    11875 Non-standard residues in 82.0.pdb #411 
    11876 --- 
    11877 HSD — (HSD) 
    11878 POT — (POT) 
    11879  
    11880 
    11881 > open
    11882 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/82.2.pdb
    11883 
    11884 Summary of feedback from opening
    11885 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/82.2.pdb 
    11886 --- 
    11887 warnings | Ignored bad PDB record found on line 1 
    11888 REMARK GENERATED BY TRJCONV 
    11889  
    11890 Ignored bad PDB record found on line 3 
    11891 REMARK THIS IS A SIMULATION BOX 
    11892  
    11893 82.2.pdb title: 
    11894 Title t= 82200.00000 step= 41100000 [more info...] 
    11895  
    11896 Chain information for 82.2.pdb #412 
    11897 --- 
    11898 Chain | Description 
    11899 A B | No description available 
    11900  
    11901 Non-standard residues in 82.2.pdb #412 
    11902 --- 
    11903 HSD — (HSD) 
    11904 POT — (POT) 
    11905  
    11906 
    11907 > open
    11908 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/82.4.pdb
    11909 
    11910 Summary of feedback from opening
    11911 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/82.4.pdb 
    11912 --- 
    11913 warnings | Ignored bad PDB record found on line 1 
    11914 REMARK GENERATED BY TRJCONV 
    11915  
    11916 Ignored bad PDB record found on line 3 
    11917 REMARK THIS IS A SIMULATION BOX 
    11918  
    11919 82.4.pdb title: 
    11920 Title t= 82400.00000 step= 41200000 [more info...] 
    11921  
    11922 Chain information for 82.4.pdb #413 
    11923 --- 
    11924 Chain | Description 
    11925 A B | No description available 
    11926  
    11927 Non-standard residues in 82.4.pdb #413 
    11928 --- 
    11929 HSD — (HSD) 
    11930 POT — (POT) 
    11931  
    11932 
    11933 > open
    11934 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/82.6.pdb
    11935 
    11936 Summary of feedback from opening
    11937 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/82.6.pdb 
    11938 --- 
    11939 warnings | Ignored bad PDB record found on line 1 
    11940 REMARK GENERATED BY TRJCONV 
    11941  
    11942 Ignored bad PDB record found on line 3 
    11943 REMARK THIS IS A SIMULATION BOX 
    11944  
    11945 82.6.pdb title: 
    11946 Title t= 82600.00000 step= 41300000 [more info...] 
    11947  
    11948 Chain information for 82.6.pdb #414 
    11949 --- 
    11950 Chain | Description 
    11951 A B | No description available 
    11952  
    11953 Non-standard residues in 82.6.pdb #414 
    11954 --- 
    11955 HSD — (HSD) 
    11956 POT — (POT) 
    11957  
    11958 
    11959 > open
    11960 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/82.8.pdb
    11961 
    11962 Summary of feedback from opening
    11963 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/82.8.pdb 
    11964 --- 
    11965 warnings | Ignored bad PDB record found on line 1 
    11966 REMARK GENERATED BY TRJCONV 
    11967  
    11968 Ignored bad PDB record found on line 3 
    11969 REMARK THIS IS A SIMULATION BOX 
    11970  
    11971 82.8.pdb title: 
    11972 Title t= 82800.00000 step= 41400000 [more info...] 
    11973  
    11974 Chain information for 82.8.pdb #415 
    11975 --- 
    11976 Chain | Description 
    11977 A B | No description available 
    11978  
    11979 Non-standard residues in 82.8.pdb #415 
    11980 --- 
    11981 HSD — (HSD) 
    11982 POT — (POT) 
    11983  
    11984 
    11985 > open
    11986 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/83.0.pdb
    11987 
    11988 Summary of feedback from opening
    11989 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/83.0.pdb 
    11990 --- 
    11991 warnings | Ignored bad PDB record found on line 1 
    11992 REMARK GENERATED BY TRJCONV 
    11993  
    11994 Ignored bad PDB record found on line 3 
    11995 REMARK THIS IS A SIMULATION BOX 
    11996  
    11997 83.0.pdb title: 
    11998 Title t= 83000.00000 step= 41500000 [more info...] 
    11999  
    12000 Chain information for 83.0.pdb #416 
    12001 --- 
    12002 Chain | Description 
    12003 A B | No description available 
    12004  
    12005 Non-standard residues in 83.0.pdb #416 
    12006 --- 
    12007 HSD — (HSD) 
    12008 POT — (POT) 
    12009  
    12010 
    12011 > open
    12012 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/83.2.pdb
    12013 
    12014 Summary of feedback from opening
    12015 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/83.2.pdb 
    12016 --- 
    12017 warnings | Ignored bad PDB record found on line 1 
    12018 REMARK GENERATED BY TRJCONV 
    12019  
    12020 Ignored bad PDB record found on line 3 
    12021 REMARK THIS IS A SIMULATION BOX 
    12022  
    12023 83.2.pdb title: 
    12024 Title t= 83200.00000 step= 41600000 [more info...] 
    12025  
    12026 Chain information for 83.2.pdb #417 
    12027 --- 
    12028 Chain | Description 
    12029 A B | No description available 
    12030  
    12031 Non-standard residues in 83.2.pdb #417 
    12032 --- 
    12033 HSD — (HSD) 
    12034 POT — (POT) 
    12035  
    12036 
    12037 > open
    12038 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/83.4.pdb
    12039 
    12040 Summary of feedback from opening
    12041 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/83.4.pdb 
    12042 --- 
    12043 warnings | Ignored bad PDB record found on line 1 
    12044 REMARK GENERATED BY TRJCONV 
    12045  
    12046 Ignored bad PDB record found on line 3 
    12047 REMARK THIS IS A SIMULATION BOX 
    12048  
    12049 83.4.pdb title: 
    12050 Title t= 83400.00000 step= 41700000 [more info...] 
    12051  
    12052 Chain information for 83.4.pdb #418 
    12053 --- 
    12054 Chain | Description 
    12055 A B | No description available 
    12056  
    12057 Non-standard residues in 83.4.pdb #418 
    12058 --- 
    12059 HSD — (HSD) 
    12060 POT — (POT) 
    12061  
    12062 
    12063 > open
    12064 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/83.6.pdb
    12065 
    12066 Summary of feedback from opening
    12067 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/83.6.pdb 
    12068 --- 
    12069 warnings | Ignored bad PDB record found on line 1 
    12070 REMARK GENERATED BY TRJCONV 
    12071  
    12072 Ignored bad PDB record found on line 3 
    12073 REMARK THIS IS A SIMULATION BOX 
    12074  
    12075 83.6.pdb title: 
    12076 Title t= 83600.00000 step= 41800000 [more info...] 
    12077  
    12078 Chain information for 83.6.pdb #419 
    12079 --- 
    12080 Chain | Description 
    12081 A B | No description available 
    12082  
    12083 Non-standard residues in 83.6.pdb #419 
    12084 --- 
    12085 HSD — (HSD) 
    12086 POT — (POT) 
    12087  
    12088 
    12089 > open
    12090 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/83.8.pdb
    12091 
    12092 Summary of feedback from opening
    12093 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/83.8.pdb 
    12094 --- 
    12095 warnings | Ignored bad PDB record found on line 1 
    12096 REMARK GENERATED BY TRJCONV 
    12097  
    12098 Ignored bad PDB record found on line 3 
    12099 REMARK THIS IS A SIMULATION BOX 
    12100  
    12101 83.8.pdb title: 
    12102 Title t= 83800.00000 step= 41900000 [more info...] 
    12103  
    12104 Chain information for 83.8.pdb #420 
    12105 --- 
    12106 Chain | Description 
    12107 A B | No description available 
    12108  
    12109 Non-standard residues in 83.8.pdb #420 
    12110 --- 
    12111 HSD — (HSD) 
    12112 POT — (POT) 
    12113  
    12114 
    12115 > open
    12116 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/84.0.pdb
    12117 
    12118 Summary of feedback from opening
    12119 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/84.0.pdb 
    12120 --- 
    12121 warnings | Ignored bad PDB record found on line 1 
    12122 REMARK GENERATED BY TRJCONV 
    12123  
    12124 Ignored bad PDB record found on line 3 
    12125 REMARK THIS IS A SIMULATION BOX 
    12126  
    12127 84.0.pdb title: 
    12128 Title t= 84000.00000 step= 42000000 [more info...] 
    12129  
    12130 Chain information for 84.0.pdb #421 
    12131 --- 
    12132 Chain | Description 
    12133 A B | No description available 
    12134  
    12135 Non-standard residues in 84.0.pdb #421 
    12136 --- 
    12137 HSD — (HSD) 
    12138 POT — (POT) 
    12139  
    12140 
    12141 > open
    12142 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/84.2.pdb
    12143 
    12144 Summary of feedback from opening
    12145 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/84.2.pdb 
    12146 --- 
    12147 warnings | Ignored bad PDB record found on line 1 
    12148 REMARK GENERATED BY TRJCONV 
    12149  
    12150 Ignored bad PDB record found on line 3 
    12151 REMARK THIS IS A SIMULATION BOX 
    12152  
    12153 84.2.pdb title: 
    12154 Title t= 84200.00000 step= 42100000 [more info...] 
    12155  
    12156 Chain information for 84.2.pdb #422 
    12157 --- 
    12158 Chain | Description 
    12159 A B | No description available 
    12160  
    12161 Non-standard residues in 84.2.pdb #422 
    12162 --- 
    12163 HSD — (HSD) 
    12164 POT — (POT) 
    12165  
    12166 
    12167 > open
    12168 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/84.4.pdb
    12169 
    12170 Summary of feedback from opening
    12171 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/84.4.pdb 
    12172 --- 
    12173 warnings | Ignored bad PDB record found on line 1 
    12174 REMARK GENERATED BY TRJCONV 
    12175  
    12176 Ignored bad PDB record found on line 3 
    12177 REMARK THIS IS A SIMULATION BOX 
    12178  
    12179 84.4.pdb title: 
    12180 Title t= 84400.00000 step= 42200000 [more info...] 
    12181  
    12182 Chain information for 84.4.pdb #423 
    12183 --- 
    12184 Chain | Description 
    12185 A B | No description available 
    12186  
    12187 Non-standard residues in 84.4.pdb #423 
    12188 --- 
    12189 HSD — (HSD) 
    12190 POT — (POT) 
    12191  
    12192 
    12193 > open
    12194 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/84.6.pdb
    12195 
    12196 Summary of feedback from opening
    12197 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/84.6.pdb 
    12198 --- 
    12199 warnings | Ignored bad PDB record found on line 1 
    12200 REMARK GENERATED BY TRJCONV 
    12201  
    12202 Ignored bad PDB record found on line 3 
    12203 REMARK THIS IS A SIMULATION BOX 
    12204  
    12205 84.6.pdb title: 
    12206 Title t= 84600.00000 step= 42300000 [more info...] 
    12207  
    12208 Chain information for 84.6.pdb #424 
    12209 --- 
    12210 Chain | Description 
    12211 A B | No description available 
    12212  
    12213 Non-standard residues in 84.6.pdb #424 
    12214 --- 
    12215 HSD — (HSD) 
    12216 POT — (POT) 
    12217  
    12218 
    12219 > open
    12220 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/84.8.pdb
    12221 
    12222 Summary of feedback from opening
    12223 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/84.8.pdb 
    12224 --- 
    12225 warnings | Ignored bad PDB record found on line 1 
    12226 REMARK GENERATED BY TRJCONV 
    12227  
    12228 Ignored bad PDB record found on line 3 
    12229 REMARK THIS IS A SIMULATION BOX 
    12230  
    12231 84.8.pdb title: 
    12232 Title t= 84800.00000 step= 42400000 [more info...] 
    12233  
    12234 Chain information for 84.8.pdb #425 
    12235 --- 
    12236 Chain | Description 
    12237 A B | No description available 
    12238  
    12239 Non-standard residues in 84.8.pdb #425 
    12240 --- 
    12241 HSD — (HSD) 
    12242 POT — (POT) 
    12243  
    12244 
    12245 > open
    12246 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/85.0.pdb
    12247 
    12248 Summary of feedback from opening
    12249 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/85.0.pdb 
    12250 --- 
    12251 warnings | Ignored bad PDB record found on line 1 
    12252 REMARK GENERATED BY TRJCONV 
    12253  
    12254 Ignored bad PDB record found on line 3 
    12255 REMARK THIS IS A SIMULATION BOX 
    12256  
    12257 85.0.pdb title: 
    12258 Title t= 85000.00000 step= 42500000 [more info...] 
    12259  
    12260 Chain information for 85.0.pdb #426 
    12261 --- 
    12262 Chain | Description 
    12263 A B | No description available 
    12264  
    12265 Non-standard residues in 85.0.pdb #426 
    12266 --- 
    12267 HSD — (HSD) 
    12268 POT — (POT) 
    12269  
    12270 
    12271 > open
    12272 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/85.2.pdb
    12273 
    12274 Summary of feedback from opening
    12275 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/85.2.pdb 
    12276 --- 
    12277 warnings | Ignored bad PDB record found on line 1 
    12278 REMARK GENERATED BY TRJCONV 
    12279  
    12280 Ignored bad PDB record found on line 3 
    12281 REMARK THIS IS A SIMULATION BOX 
    12282  
    12283 85.2.pdb title: 
    12284 Title t= 85200.00000 step= 42600000 [more info...] 
    12285  
    12286 Chain information for 85.2.pdb #427 
    12287 --- 
    12288 Chain | Description 
    12289 A B | No description available 
    12290  
    12291 Non-standard residues in 85.2.pdb #427 
    12292 --- 
    12293 HSD — (HSD) 
    12294 POT — (POT) 
    12295  
    12296 
    12297 > open
    12298 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/85.4.pdb
    12299 
    12300 Summary of feedback from opening
    12301 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/85.4.pdb 
    12302 --- 
    12303 warnings | Ignored bad PDB record found on line 1 
    12304 REMARK GENERATED BY TRJCONV 
    12305  
    12306 Ignored bad PDB record found on line 3 
    12307 REMARK THIS IS A SIMULATION BOX 
    12308  
    12309 85.4.pdb title: 
    12310 Title t= 85400.00000 step= 42700000 [more info...] 
    12311  
    12312 Chain information for 85.4.pdb #428 
    12313 --- 
    12314 Chain | Description 
    12315 A B | No description available 
    12316  
    12317 Non-standard residues in 85.4.pdb #428 
    12318 --- 
    12319 HSD — (HSD) 
    12320 POT — (POT) 
    12321  
    12322 
    12323 > open
    12324 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/85.6.pdb
    12325 
    12326 Summary of feedback from opening
    12327 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/85.6.pdb 
    12328 --- 
    12329 warnings | Ignored bad PDB record found on line 1 
    12330 REMARK GENERATED BY TRJCONV 
    12331  
    12332 Ignored bad PDB record found on line 3 
    12333 REMARK THIS IS A SIMULATION BOX 
    12334  
    12335 85.6.pdb title: 
    12336 Title t= 85600.00000 step= 42800000 [more info...] 
    12337  
    12338 Chain information for 85.6.pdb #429 
    12339 --- 
    12340 Chain | Description 
    12341 A B | No description available 
    12342  
    12343 Non-standard residues in 85.6.pdb #429 
    12344 --- 
    12345 HSD — (HSD) 
    12346 POT — (POT) 
    12347  
    12348 
    12349 > open
    12350 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/85.8.pdb
    12351 
    12352 Summary of feedback from opening
    12353 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/85.8.pdb 
    12354 --- 
    12355 warnings | Ignored bad PDB record found on line 1 
    12356 REMARK GENERATED BY TRJCONV 
    12357  
    12358 Ignored bad PDB record found on line 3 
    12359 REMARK THIS IS A SIMULATION BOX 
    12360  
    12361 85.8.pdb title: 
    12362 Title t= 85800.00000 step= 42900000 [more info...] 
    12363  
    12364 Chain information for 85.8.pdb #430 
    12365 --- 
    12366 Chain | Description 
    12367 A B | No description available 
    12368  
    12369 Non-standard residues in 85.8.pdb #430 
    12370 --- 
    12371 HSD — (HSD) 
    12372 POT — (POT) 
    12373  
    12374 
    12375 > open
    12376 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/86.0.pdb
    12377 
    12378 Summary of feedback from opening
    12379 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/86.0.pdb 
    12380 --- 
    12381 warnings | Ignored bad PDB record found on line 1 
    12382 REMARK GENERATED BY TRJCONV 
    12383  
    12384 Ignored bad PDB record found on line 3 
    12385 REMARK THIS IS A SIMULATION BOX 
    12386  
    12387 86.0.pdb title: 
    12388 Title t= 86000.00000 step= 43000000 [more info...] 
    12389  
    12390 Chain information for 86.0.pdb #431 
    12391 --- 
    12392 Chain | Description 
    12393 A B | No description available 
    12394  
    12395 Non-standard residues in 86.0.pdb #431 
    12396 --- 
    12397 HSD — (HSD) 
    12398 POT — (POT) 
    12399  
    12400 
    12401 > open
    12402 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/86.2.pdb
    12403 
    12404 Summary of feedback from opening
    12405 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/86.2.pdb 
    12406 --- 
    12407 warnings | Ignored bad PDB record found on line 1 
    12408 REMARK GENERATED BY TRJCONV 
    12409  
    12410 Ignored bad PDB record found on line 3 
    12411 REMARK THIS IS A SIMULATION BOX 
    12412  
    12413 86.2.pdb title: 
    12414 Title t= 86200.00000 step= 43100000 [more info...] 
    12415  
    12416 Chain information for 86.2.pdb #432 
    12417 --- 
    12418 Chain | Description 
    12419 A B | No description available 
    12420  
    12421 Non-standard residues in 86.2.pdb #432 
    12422 --- 
    12423 HSD — (HSD) 
    12424 POT — (POT) 
    12425  
    12426 
    12427 > open
    12428 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/86.4.pdb
    12429 
    12430 Summary of feedback from opening
    12431 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/86.4.pdb 
    12432 --- 
    12433 warnings | Ignored bad PDB record found on line 1 
    12434 REMARK GENERATED BY TRJCONV 
    12435  
    12436 Ignored bad PDB record found on line 3 
    12437 REMARK THIS IS A SIMULATION BOX 
    12438  
    12439 86.4.pdb title: 
    12440 Title t= 86400.00000 step= 43200000 [more info...] 
    12441  
    12442 Chain information for 86.4.pdb #433 
    12443 --- 
    12444 Chain | Description 
    12445 A B | No description available 
    12446  
    12447 Non-standard residues in 86.4.pdb #433 
    12448 --- 
    12449 HSD — (HSD) 
    12450 POT — (POT) 
    12451  
    12452 
    12453 > open
    12454 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/86.6.pdb
    12455 
    12456 Summary of feedback from opening
    12457 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/86.6.pdb 
    12458 --- 
    12459 warnings | Ignored bad PDB record found on line 1 
    12460 REMARK GENERATED BY TRJCONV 
    12461  
    12462 Ignored bad PDB record found on line 3 
    12463 REMARK THIS IS A SIMULATION BOX 
    12464  
    12465 86.6.pdb title: 
    12466 Title t= 86600.00000 step= 43300000 [more info...] 
    12467  
    12468 Chain information for 86.6.pdb #434 
    12469 --- 
    12470 Chain | Description 
    12471 A B | No description available 
    12472  
    12473 Non-standard residues in 86.6.pdb #434 
    12474 --- 
    12475 HSD — (HSD) 
    12476 POT — (POT) 
    12477  
    12478 
    12479 > open
    12480 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/86.8.pdb
    12481 
    12482 Summary of feedback from opening
    12483 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/86.8.pdb 
    12484 --- 
    12485 warnings | Ignored bad PDB record found on line 1 
    12486 REMARK GENERATED BY TRJCONV 
    12487  
    12488 Ignored bad PDB record found on line 3 
    12489 REMARK THIS IS A SIMULATION BOX 
    12490  
    12491 86.8.pdb title: 
    12492 Title t= 86800.00000 step= 43400000 [more info...] 
    12493  
    12494 Chain information for 86.8.pdb #435 
    12495 --- 
    12496 Chain | Description 
    12497 A B | No description available 
    12498  
    12499 Non-standard residues in 86.8.pdb #435 
    12500 --- 
    12501 HSD — (HSD) 
    12502 POT — (POT) 
    12503  
    12504 
    12505 > open
    12506 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/87.0.pdb
    12507 
    12508 Summary of feedback from opening
    12509 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/87.0.pdb 
    12510 --- 
    12511 warnings | Ignored bad PDB record found on line 1 
    12512 REMARK GENERATED BY TRJCONV 
    12513  
    12514 Ignored bad PDB record found on line 3 
    12515 REMARK THIS IS A SIMULATION BOX 
    12516  
    12517 87.0.pdb title: 
    12518 Title t= 87000.00000 step= 43500000 [more info...] 
    12519  
    12520 Chain information for 87.0.pdb #436 
    12521 --- 
    12522 Chain | Description 
    12523 A B | No description available 
    12524  
    12525 Non-standard residues in 87.0.pdb #436 
    12526 --- 
    12527 HSD — (HSD) 
    12528 POT — (POT) 
    12529  
    12530 
    12531 > open
    12532 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/87.2.pdb
    12533 
    12534 Summary of feedback from opening
    12535 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/87.2.pdb 
    12536 --- 
    12537 warnings | Ignored bad PDB record found on line 1 
    12538 REMARK GENERATED BY TRJCONV 
    12539  
    12540 Ignored bad PDB record found on line 3 
    12541 REMARK THIS IS A SIMULATION BOX 
    12542  
    12543 87.2.pdb title: 
    12544 Title t= 87200.00000 step= 43600000 [more info...] 
    12545  
    12546 Chain information for 87.2.pdb #437 
    12547 --- 
    12548 Chain | Description 
    12549 A B | No description available 
    12550  
    12551 Non-standard residues in 87.2.pdb #437 
    12552 --- 
    12553 HSD — (HSD) 
    12554 POT — (POT) 
    12555  
    12556 
    12557 > open
    12558 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/87.4.pdb
    12559 
    12560 Summary of feedback from opening
    12561 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/87.4.pdb 
    12562 --- 
    12563 warnings | Ignored bad PDB record found on line 1 
    12564 REMARK GENERATED BY TRJCONV 
    12565  
    12566 Ignored bad PDB record found on line 3 
    12567 REMARK THIS IS A SIMULATION BOX 
    12568  
    12569 87.4.pdb title: 
    12570 Title t= 87400.00000 step= 43700000 [more info...] 
    12571  
    12572 Chain information for 87.4.pdb #438 
    12573 --- 
    12574 Chain | Description 
    12575 A B | No description available 
    12576  
    12577 Non-standard residues in 87.4.pdb #438 
    12578 --- 
    12579 HSD — (HSD) 
    12580 POT — (POT) 
    12581  
    12582 
    12583 > open
    12584 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/87.6.pdb
    12585 
    12586 Summary of feedback from opening
    12587 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/87.6.pdb 
    12588 --- 
    12589 warnings | Ignored bad PDB record found on line 1 
    12590 REMARK GENERATED BY TRJCONV 
    12591  
    12592 Ignored bad PDB record found on line 3 
    12593 REMARK THIS IS A SIMULATION BOX 
    12594  
    12595 87.6.pdb title: 
    12596 Title t= 87600.00000 step= 43800000 [more info...] 
    12597  
    12598 Chain information for 87.6.pdb #439 
    12599 --- 
    12600 Chain | Description 
    12601 A B | No description available 
    12602  
    12603 Non-standard residues in 87.6.pdb #439 
    12604 --- 
    12605 HSD — (HSD) 
    12606 POT — (POT) 
    12607  
    12608 
    12609 > open
    12610 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/87.8.pdb
    12611 
    12612 Summary of feedback from opening
    12613 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/87.8.pdb 
    12614 --- 
    12615 warnings | Ignored bad PDB record found on line 1 
    12616 REMARK GENERATED BY TRJCONV 
    12617  
    12618 Ignored bad PDB record found on line 3 
    12619 REMARK THIS IS A SIMULATION BOX 
    12620  
    12621 87.8.pdb title: 
    12622 Title t= 87800.00000 step= 43900000 [more info...] 
    12623  
    12624 Chain information for 87.8.pdb #440 
    12625 --- 
    12626 Chain | Description 
    12627 A B | No description available 
    12628  
    12629 Non-standard residues in 87.8.pdb #440 
    12630 --- 
    12631 HSD — (HSD) 
    12632 POT — (POT) 
    12633  
    12634 
    12635 > open
    12636 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/88.0.pdb
    12637 
    12638 Summary of feedback from opening
    12639 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/88.0.pdb 
    12640 --- 
    12641 warnings | Ignored bad PDB record found on line 1 
    12642 REMARK GENERATED BY TRJCONV 
    12643  
    12644 Ignored bad PDB record found on line 3 
    12645 REMARK THIS IS A SIMULATION BOX 
    12646  
    12647 88.0.pdb title: 
    12648 Title t= 88000.00000 step= 44000000 [more info...] 
    12649  
    12650 Chain information for 88.0.pdb #441 
    12651 --- 
    12652 Chain | Description 
    12653 A B | No description available 
    12654  
    12655 Non-standard residues in 88.0.pdb #441 
    12656 --- 
    12657 HSD — (HSD) 
    12658 POT — (POT) 
    12659  
    12660 
    12661 > open
    12662 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/88.2.pdb
    12663 
    12664 Summary of feedback from opening
    12665 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/88.2.pdb 
    12666 --- 
    12667 warnings | Ignored bad PDB record found on line 1 
    12668 REMARK GENERATED BY TRJCONV 
    12669  
    12670 Ignored bad PDB record found on line 3 
    12671 REMARK THIS IS A SIMULATION BOX 
    12672  
    12673 88.2.pdb title: 
    12674 Title t= 88200.00000 step= 44100000 [more info...] 
    12675  
    12676 Chain information for 88.2.pdb #442 
    12677 --- 
    12678 Chain | Description 
    12679 A B | No description available 
    12680  
    12681 Non-standard residues in 88.2.pdb #442 
    12682 --- 
    12683 HSD — (HSD) 
    12684 POT — (POT) 
    12685  
    12686 
    12687 > open
    12688 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/88.4.pdb
    12689 
    12690 Summary of feedback from opening
    12691 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/88.4.pdb 
    12692 --- 
    12693 warnings | Ignored bad PDB record found on line 1 
    12694 REMARK GENERATED BY TRJCONV 
    12695  
    12696 Ignored bad PDB record found on line 3 
    12697 REMARK THIS IS A SIMULATION BOX 
    12698  
    12699 88.4.pdb title: 
    12700 Title t= 88400.00000 step= 44200000 [more info...] 
    12701  
    12702 Chain information for 88.4.pdb #443 
    12703 --- 
    12704 Chain | Description 
    12705 A B | No description available 
    12706  
    12707 Non-standard residues in 88.4.pdb #443 
    12708 --- 
    12709 HSD — (HSD) 
    12710 POT — (POT) 
    12711  
    12712 
    12713 > open
    12714 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/88.6.pdb
    12715 
    12716 Summary of feedback from opening
    12717 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/88.6.pdb 
    12718 --- 
    12719 warnings | Ignored bad PDB record found on line 1 
    12720 REMARK GENERATED BY TRJCONV 
    12721  
    12722 Ignored bad PDB record found on line 3 
    12723 REMARK THIS IS A SIMULATION BOX 
    12724  
    12725 88.6.pdb title: 
    12726 Title t= 88600.00000 step= 44300000 [more info...] 
    12727  
    12728 Chain information for 88.6.pdb #444 
    12729 --- 
    12730 Chain | Description 
    12731 A B | No description available 
    12732  
    12733 Non-standard residues in 88.6.pdb #444 
    12734 --- 
    12735 HSD — (HSD) 
    12736 POT — (POT) 
    12737  
    12738 
    12739 > open
    12740 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/88.8.pdb
    12741 
    12742 Summary of feedback from opening
    12743 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/88.8.pdb 
    12744 --- 
    12745 warnings | Ignored bad PDB record found on line 1 
    12746 REMARK GENERATED BY TRJCONV 
    12747  
    12748 Ignored bad PDB record found on line 3 
    12749 REMARK THIS IS A SIMULATION BOX 
    12750  
    12751 88.8.pdb title: 
    12752 Title t= 88800.00000 step= 44400000 [more info...] 
    12753  
    12754 Chain information for 88.8.pdb #445 
    12755 --- 
    12756 Chain | Description 
    12757 A B | No description available 
    12758  
    12759 Non-standard residues in 88.8.pdb #445 
    12760 --- 
    12761 HSD — (HSD) 
    12762 POT — (POT) 
    12763  
    12764 
    12765 > open
    12766 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/89.0.pdb
    12767 
    12768 Summary of feedback from opening
    12769 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/89.0.pdb 
    12770 --- 
    12771 warnings | Ignored bad PDB record found on line 1 
    12772 REMARK GENERATED BY TRJCONV 
    12773  
    12774 Ignored bad PDB record found on line 3 
    12775 REMARK THIS IS A SIMULATION BOX 
    12776  
    12777 89.0.pdb title: 
    12778 Title t= 89000.00000 step= 44500000 [more info...] 
    12779  
    12780 Chain information for 89.0.pdb #446 
    12781 --- 
    12782 Chain | Description 
    12783 A B | No description available 
    12784  
    12785 Non-standard residues in 89.0.pdb #446 
    12786 --- 
    12787 HSD — (HSD) 
    12788 POT — (POT) 
    12789  
    12790 
    12791 > open
    12792 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/89.2.pdb
    12793 
    12794 Summary of feedback from opening
    12795 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/89.2.pdb 
    12796 --- 
    12797 warnings | Ignored bad PDB record found on line 1 
    12798 REMARK GENERATED BY TRJCONV 
    12799  
    12800 Ignored bad PDB record found on line 3 
    12801 REMARK THIS IS A SIMULATION BOX 
    12802  
    12803 89.2.pdb title: 
    12804 Title t= 89200.00000 step= 44600000 [more info...] 
    12805  
    12806 Chain information for 89.2.pdb #447 
    12807 --- 
    12808 Chain | Description 
    12809 A B | No description available 
    12810  
    12811 Non-standard residues in 89.2.pdb #447 
    12812 --- 
    12813 HSD — (HSD) 
    12814 POT — (POT) 
    12815  
    12816 
    12817 > open
    12818 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/89.4.pdb
    12819 
    12820 Summary of feedback from opening
    12821 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/89.4.pdb 
    12822 --- 
    12823 warnings | Ignored bad PDB record found on line 1 
    12824 REMARK GENERATED BY TRJCONV 
    12825  
    12826 Ignored bad PDB record found on line 3 
    12827 REMARK THIS IS A SIMULATION BOX 
    12828  
    12829 89.4.pdb title: 
    12830 Title t= 89400.00000 step= 44700000 [more info...] 
    12831  
    12832 Chain information for 89.4.pdb #448 
    12833 --- 
    12834 Chain | Description 
    12835 A B | No description available 
    12836  
    12837 Non-standard residues in 89.4.pdb #448 
    12838 --- 
    12839 HSD — (HSD) 
    12840 POT — (POT) 
    12841  
    12842 
    12843 > open
    12844 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/89.6.pdb
    12845 
    12846 Summary of feedback from opening
    12847 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/89.6.pdb 
    12848 --- 
    12849 warnings | Ignored bad PDB record found on line 1 
    12850 REMARK GENERATED BY TRJCONV 
    12851  
    12852 Ignored bad PDB record found on line 3 
    12853 REMARK THIS IS A SIMULATION BOX 
    12854  
    12855 89.6.pdb title: 
    12856 Title t= 89600.00000 step= 44800000 [more info...] 
    12857  
    12858 Chain information for 89.6.pdb #449 
    12859 --- 
    12860 Chain | Description 
    12861 A B | No description available 
    12862  
    12863 Non-standard residues in 89.6.pdb #449 
    12864 --- 
    12865 HSD — (HSD) 
    12866 POT — (POT) 
    12867  
    12868 
    12869 > open
    12870 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/89.8.pdb
    12871 
    12872 Summary of feedback from opening
    12873 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/89.8.pdb 
    12874 --- 
    12875 warnings | Ignored bad PDB record found on line 1 
    12876 REMARK GENERATED BY TRJCONV 
    12877  
    12878 Ignored bad PDB record found on line 3 
    12879 REMARK THIS IS A SIMULATION BOX 
    12880  
    12881 89.8.pdb title: 
    12882 Title t= 89800.00000 step= 44900000 [more info...] 
    12883  
    12884 Chain information for 89.8.pdb #450 
    12885 --- 
    12886 Chain | Description 
    12887 A B | No description available 
    12888  
    12889 Non-standard residues in 89.8.pdb #450 
    12890 --- 
    12891 HSD — (HSD) 
    12892 POT — (POT) 
    12893  
    12894 
    12895 > open
    12896 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/90.0.pdb
    12897 
    12898 Summary of feedback from opening
    12899 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/90.0.pdb 
    12900 --- 
    12901 warnings | Ignored bad PDB record found on line 1 
    12902 REMARK GENERATED BY TRJCONV 
    12903  
    12904 Ignored bad PDB record found on line 3 
    12905 REMARK THIS IS A SIMULATION BOX 
    12906  
    12907 90.0.pdb title: 
    12908 Title t= 90000.00000 step= 45000000 [more info...] 
    12909  
    12910 Chain information for 90.0.pdb #451 
    12911 --- 
    12912 Chain | Description 
    12913 A B | No description available 
    12914  
    12915 Non-standard residues in 90.0.pdb #451 
    12916 --- 
    12917 HSD — (HSD) 
    12918 POT — (POT) 
    12919  
    12920 
    12921 > open
    12922 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/90.2.pdb
    12923 
    12924 Summary of feedback from opening
    12925 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/90.2.pdb 
    12926 --- 
    12927 warnings | Ignored bad PDB record found on line 1 
    12928 REMARK GENERATED BY TRJCONV 
    12929  
    12930 Ignored bad PDB record found on line 3 
    12931 REMARK THIS IS A SIMULATION BOX 
    12932  
    12933 90.2.pdb title: 
    12934 Title t= 90200.00000 step= 45100000 [more info...] 
    12935  
    12936 Chain information for 90.2.pdb #452 
    12937 --- 
    12938 Chain | Description 
    12939 A B | No description available 
    12940  
    12941 Non-standard residues in 90.2.pdb #452 
    12942 --- 
    12943 HSD — (HSD) 
    12944 POT — (POT) 
    12945  
    12946 
    12947 > open
    12948 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/90.4.pdb
    12949 
    12950 Summary of feedback from opening
    12951 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/90.4.pdb 
    12952 --- 
    12953 warnings | Ignored bad PDB record found on line 1 
    12954 REMARK GENERATED BY TRJCONV 
    12955  
    12956 Ignored bad PDB record found on line 3 
    12957 REMARK THIS IS A SIMULATION BOX 
    12958  
    12959 90.4.pdb title: 
    12960 Title t= 90400.00000 step= 45200000 [more info...] 
    12961  
    12962 Chain information for 90.4.pdb #453 
    12963 --- 
    12964 Chain | Description 
    12965 A B | No description available 
    12966  
    12967 Non-standard residues in 90.4.pdb #453 
    12968 --- 
    12969 HSD — (HSD) 
    12970 POT — (POT) 
    12971  
    12972 
    12973 > open
    12974 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/90.6.pdb
    12975 
    12976 Summary of feedback from opening
    12977 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/90.6.pdb 
    12978 --- 
    12979 warnings | Ignored bad PDB record found on line 1 
    12980 REMARK GENERATED BY TRJCONV 
    12981  
    12982 Ignored bad PDB record found on line 3 
    12983 REMARK THIS IS A SIMULATION BOX 
    12984  
    12985 90.6.pdb title: 
    12986 Title t= 90600.00000 step= 45300000 [more info...] 
    12987  
    12988 Chain information for 90.6.pdb #454 
    12989 --- 
    12990 Chain | Description 
    12991 A B | No description available 
    12992  
    12993 Non-standard residues in 90.6.pdb #454 
    12994 --- 
    12995 HSD — (HSD) 
    12996 POT — (POT) 
    12997  
    12998 
    12999 > open
    13000 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/90.8.pdb
    13001 
    13002 Summary of feedback from opening
    13003 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/90.8.pdb 
    13004 --- 
    13005 warnings | Ignored bad PDB record found on line 1 
    13006 REMARK GENERATED BY TRJCONV 
    13007  
    13008 Ignored bad PDB record found on line 3 
    13009 REMARK THIS IS A SIMULATION BOX 
    13010  
    13011 90.8.pdb title: 
    13012 Title t= 90800.00000 step= 45400000 [more info...] 
    13013  
    13014 Chain information for 90.8.pdb #455 
    13015 --- 
    13016 Chain | Description 
    13017 A B | No description available 
    13018  
    13019 Non-standard residues in 90.8.pdb #455 
    13020 --- 
    13021 HSD — (HSD) 
    13022 POT — (POT) 
    13023  
    13024 
    13025 > open
    13026 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/91.0.pdb
    13027 
    13028 Summary of feedback from opening
    13029 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/91.0.pdb 
    13030 --- 
    13031 warnings | Ignored bad PDB record found on line 1 
    13032 REMARK GENERATED BY TRJCONV 
    13033  
    13034 Ignored bad PDB record found on line 3 
    13035 REMARK THIS IS A SIMULATION BOX 
    13036  
    13037 91.0.pdb title: 
    13038 Title t= 91000.00000 step= 45500000 [more info...] 
    13039  
    13040 Chain information for 91.0.pdb #456 
    13041 --- 
    13042 Chain | Description 
    13043 A B | No description available 
    13044  
    13045 Non-standard residues in 91.0.pdb #456 
    13046 --- 
    13047 HSD — (HSD) 
    13048 POT — (POT) 
    13049  
    13050 
    13051 > open
    13052 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/91.2.pdb
    13053 
    13054 Summary of feedback from opening
    13055 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/91.2.pdb 
    13056 --- 
    13057 warnings | Ignored bad PDB record found on line 1 
    13058 REMARK GENERATED BY TRJCONV 
    13059  
    13060 Ignored bad PDB record found on line 3 
    13061 REMARK THIS IS A SIMULATION BOX 
    13062  
    13063 91.2.pdb title: 
    13064 Title t= 91200.00000 step= 45600000 [more info...] 
    13065  
    13066 Chain information for 91.2.pdb #457 
    13067 --- 
    13068 Chain | Description 
    13069 A B | No description available 
    13070  
    13071 Non-standard residues in 91.2.pdb #457 
    13072 --- 
    13073 HSD — (HSD) 
    13074 POT — (POT) 
    13075  
    13076 
    13077 > open
    13078 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/91.4.pdb
    13079 
    13080 Summary of feedback from opening
    13081 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/91.4.pdb 
    13082 --- 
    13083 warnings | Ignored bad PDB record found on line 1 
    13084 REMARK GENERATED BY TRJCONV 
    13085  
    13086 Ignored bad PDB record found on line 3 
    13087 REMARK THIS IS A SIMULATION BOX 
    13088  
    13089 91.4.pdb title: 
    13090 Title t= 91400.00000 step= 45700000 [more info...] 
    13091  
    13092 Chain information for 91.4.pdb #458 
    13093 --- 
    13094 Chain | Description 
    13095 A B | No description available 
    13096  
    13097 Non-standard residues in 91.4.pdb #458 
    13098 --- 
    13099 HSD — (HSD) 
    13100 POT — (POT) 
    13101  
    13102 
    13103 > open
    13104 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/91.6.pdb
    13105 
    13106 Summary of feedback from opening
    13107 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/91.6.pdb 
    13108 --- 
    13109 warnings | Ignored bad PDB record found on line 1 
    13110 REMARK GENERATED BY TRJCONV 
    13111  
    13112 Ignored bad PDB record found on line 3 
    13113 REMARK THIS IS A SIMULATION BOX 
    13114  
    13115 91.6.pdb title: 
    13116 Title t= 91600.00000 step= 45800000 [more info...] 
    13117  
    13118 Chain information for 91.6.pdb #459 
    13119 --- 
    13120 Chain | Description 
    13121 A B | No description available 
    13122  
    13123 Non-standard residues in 91.6.pdb #459 
    13124 --- 
    13125 HSD — (HSD) 
    13126 POT — (POT) 
    13127  
    13128 
    13129 > open
    13130 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/91.8.pdb
    13131 
    13132 Summary of feedback from opening
    13133 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/91.8.pdb 
    13134 --- 
    13135 warnings | Ignored bad PDB record found on line 1 
    13136 REMARK GENERATED BY TRJCONV 
    13137  
    13138 Ignored bad PDB record found on line 3 
    13139 REMARK THIS IS A SIMULATION BOX 
    13140  
    13141 91.8.pdb title: 
    13142 Title t= 91800.00000 step= 45900000 [more info...] 
    13143  
    13144 Chain information for 91.8.pdb #460 
    13145 --- 
    13146 Chain | Description 
    13147 A B | No description available 
    13148  
    13149 Non-standard residues in 91.8.pdb #460 
    13150 --- 
    13151 HSD — (HSD) 
    13152 POT — (POT) 
    13153  
    13154 
    13155 > open
    13156 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/92.0.pdb
    13157 
    13158 Summary of feedback from opening
    13159 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/92.0.pdb 
    13160 --- 
    13161 warnings | Ignored bad PDB record found on line 1 
    13162 REMARK GENERATED BY TRJCONV 
    13163  
    13164 Ignored bad PDB record found on line 3 
    13165 REMARK THIS IS A SIMULATION BOX 
    13166  
    13167 92.0.pdb title: 
    13168 Title t= 92000.00000 step= 46000000 [more info...] 
    13169  
    13170 Chain information for 92.0.pdb #461 
    13171 --- 
    13172 Chain | Description 
    13173 A B | No description available 
    13174  
    13175 Non-standard residues in 92.0.pdb #461 
    13176 --- 
    13177 HSD — (HSD) 
    13178 POT — (POT) 
    13179  
    13180 
    13181 > open
    13182 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/92.2.pdb
    13183 
    13184 Summary of feedback from opening
    13185 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/92.2.pdb 
    13186 --- 
    13187 warnings | Ignored bad PDB record found on line 1 
    13188 REMARK GENERATED BY TRJCONV 
    13189  
    13190 Ignored bad PDB record found on line 3 
    13191 REMARK THIS IS A SIMULATION BOX 
    13192  
    13193 92.2.pdb title: 
    13194 Title t= 92200.00000 step= 46100000 [more info...] 
    13195  
    13196 Chain information for 92.2.pdb #462 
    13197 --- 
    13198 Chain | Description 
    13199 A B | No description available 
    13200  
    13201 Non-standard residues in 92.2.pdb #462 
    13202 --- 
    13203 HSD — (HSD) 
    13204 POT — (POT) 
    13205  
    13206 
    13207 > open
    13208 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/92.4.pdb
    13209 
    13210 Summary of feedback from opening
    13211 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/92.4.pdb 
    13212 --- 
    13213 warnings | Ignored bad PDB record found on line 1 
    13214 REMARK GENERATED BY TRJCONV 
    13215  
    13216 Ignored bad PDB record found on line 3 
    13217 REMARK THIS IS A SIMULATION BOX 
    13218  
    13219 92.4.pdb title: 
    13220 Title t= 92400.00000 step= 46200000 [more info...] 
    13221  
    13222 Chain information for 92.4.pdb #463 
    13223 --- 
    13224 Chain | Description 
    13225 A B | No description available 
    13226  
    13227 Non-standard residues in 92.4.pdb #463 
    13228 --- 
    13229 HSD — (HSD) 
    13230 POT — (POT) 
    13231  
    13232 
    13233 > open
    13234 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/92.6.pdb
    13235 
    13236 Summary of feedback from opening
    13237 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/92.6.pdb 
    13238 --- 
    13239 warnings | Ignored bad PDB record found on line 1 
    13240 REMARK GENERATED BY TRJCONV 
    13241  
    13242 Ignored bad PDB record found on line 3 
    13243 REMARK THIS IS A SIMULATION BOX 
    13244  
    13245 92.6.pdb title: 
    13246 Title t= 92600.00000 step= 46300000 [more info...] 
    13247  
    13248 Chain information for 92.6.pdb #464 
    13249 --- 
    13250 Chain | Description 
    13251 A B | No description available 
    13252  
    13253 Non-standard residues in 92.6.pdb #464 
    13254 --- 
    13255 HSD — (HSD) 
    13256 POT — (POT) 
    13257  
    13258 
    13259 > open
    13260 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/92.8.pdb
    13261 
    13262 Summary of feedback from opening
    13263 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/92.8.pdb 
    13264 --- 
    13265 warnings | Ignored bad PDB record found on line 1 
    13266 REMARK GENERATED BY TRJCONV 
    13267  
    13268 Ignored bad PDB record found on line 3 
    13269 REMARK THIS IS A SIMULATION BOX 
    13270  
    13271 92.8.pdb title: 
    13272 Title t= 92800.00000 step= 46400000 [more info...] 
    13273  
    13274 Chain information for 92.8.pdb #465 
    13275 --- 
    13276 Chain | Description 
    13277 A B | No description available 
    13278  
    13279 Non-standard residues in 92.8.pdb #465 
    13280 --- 
    13281 HSD — (HSD) 
    13282 POT — (POT) 
    13283  
    13284 
    13285 > open
    13286 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/93.0.pdb
    13287 
    13288 Summary of feedback from opening
    13289 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/93.0.pdb 
    13290 --- 
    13291 warnings | Ignored bad PDB record found on line 1 
    13292 REMARK GENERATED BY TRJCONV 
    13293  
    13294 Ignored bad PDB record found on line 3 
    13295 REMARK THIS IS A SIMULATION BOX 
    13296  
    13297 93.0.pdb title: 
    13298 Title t= 93000.00000 step= 46500000 [more info...] 
    13299  
    13300 Chain information for 93.0.pdb #466 
    13301 --- 
    13302 Chain | Description 
    13303 A B | No description available 
    13304  
    13305 Non-standard residues in 93.0.pdb #466 
    13306 --- 
    13307 HSD — (HSD) 
    13308 POT — (POT) 
    13309  
    13310 
    13311 > open
    13312 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/93.2.pdb
    13313 
    13314 Summary of feedback from opening
    13315 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/93.2.pdb 
    13316 --- 
    13317 warnings | Ignored bad PDB record found on line 1 
    13318 REMARK GENERATED BY TRJCONV 
    13319  
    13320 Ignored bad PDB record found on line 3 
    13321 REMARK THIS IS A SIMULATION BOX 
    13322  
    13323 93.2.pdb title: 
    13324 Title t= 93200.00000 step= 46600000 [more info...] 
    13325  
    13326 Chain information for 93.2.pdb #467 
    13327 --- 
    13328 Chain | Description 
    13329 A B | No description available 
    13330  
    13331 Non-standard residues in 93.2.pdb #467 
    13332 --- 
    13333 HSD — (HSD) 
    13334 POT — (POT) 
    13335  
    13336 
    13337 > open
    13338 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/93.4.pdb
    13339 
    13340 Summary of feedback from opening
    13341 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/93.4.pdb 
    13342 --- 
    13343 warnings | Ignored bad PDB record found on line 1 
    13344 REMARK GENERATED BY TRJCONV 
    13345  
    13346 Ignored bad PDB record found on line 3 
    13347 REMARK THIS IS A SIMULATION BOX 
    13348  
    13349 93.4.pdb title: 
    13350 Title t= 93400.00000 step= 46700000 [more info...] 
    13351  
    13352 Chain information for 93.4.pdb #468 
    13353 --- 
    13354 Chain | Description 
    13355 A B | No description available 
    13356  
    13357 Non-standard residues in 93.4.pdb #468 
    13358 --- 
    13359 HSD — (HSD) 
    13360 POT — (POT) 
    13361  
    13362 
    13363 > open
    13364 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/93.6.pdb
    13365 
    13366 Summary of feedback from opening
    13367 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/93.6.pdb 
    13368 --- 
    13369 warnings | Ignored bad PDB record found on line 1 
    13370 REMARK GENERATED BY TRJCONV 
    13371  
    13372 Ignored bad PDB record found on line 3 
    13373 REMARK THIS IS A SIMULATION BOX 
    13374  
    13375 93.6.pdb title: 
    13376 Title t= 93600.00000 step= 46800000 [more info...] 
    13377  
    13378 Chain information for 93.6.pdb #469 
    13379 --- 
    13380 Chain | Description 
    13381 A B | No description available 
    13382  
    13383 Non-standard residues in 93.6.pdb #469 
    13384 --- 
    13385 HSD — (HSD) 
    13386 POT — (POT) 
    13387  
    13388 
    13389 > open
    13390 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/93.8.pdb
    13391 
    13392 Summary of feedback from opening
    13393 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/93.8.pdb 
    13394 --- 
    13395 warnings | Ignored bad PDB record found on line 1 
    13396 REMARK GENERATED BY TRJCONV 
    13397  
    13398 Ignored bad PDB record found on line 3 
    13399 REMARK THIS IS A SIMULATION BOX 
    13400  
    13401 93.8.pdb title: 
    13402 Title t= 93800.00000 step= 46900000 [more info...] 
    13403  
    13404 Chain information for 93.8.pdb #470 
    13405 --- 
    13406 Chain | Description 
    13407 A B | No description available 
    13408  
    13409 Non-standard residues in 93.8.pdb #470 
    13410 --- 
    13411 HSD — (HSD) 
    13412 POT — (POT) 
    13413  
    13414 
    13415 > open
    13416 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/94.0.pdb
    13417 
    13418 Summary of feedback from opening
    13419 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/94.0.pdb 
    13420 --- 
    13421 warnings | Ignored bad PDB record found on line 1 
    13422 REMARK GENERATED BY TRJCONV 
    13423  
    13424 Ignored bad PDB record found on line 3 
    13425 REMARK THIS IS A SIMULATION BOX 
    13426  
    13427 94.0.pdb title: 
    13428 Title t= 94000.00000 step= 47000000 [more info...] 
    13429  
    13430 Chain information for 94.0.pdb #471 
    13431 --- 
    13432 Chain | Description 
    13433 A B | No description available 
    13434  
    13435 Non-standard residues in 94.0.pdb #471 
    13436 --- 
    13437 HSD — (HSD) 
    13438 POT — (POT) 
    13439  
    13440 
    13441 > open
    13442 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/94.2.pdb
    13443 
    13444 Summary of feedback from opening
    13445 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/94.2.pdb 
    13446 --- 
    13447 warnings | Ignored bad PDB record found on line 1 
    13448 REMARK GENERATED BY TRJCONV 
    13449  
    13450 Ignored bad PDB record found on line 3 
    13451 REMARK THIS IS A SIMULATION BOX 
    13452  
    13453 94.2.pdb title: 
    13454 Title t= 94200.00000 step= 47100000 [more info...] 
    13455  
    13456 Chain information for 94.2.pdb #472 
    13457 --- 
    13458 Chain | Description 
    13459 A B | No description available 
    13460  
    13461 Non-standard residues in 94.2.pdb #472 
    13462 --- 
    13463 HSD — (HSD) 
    13464 POT — (POT) 
    13465  
    13466 
    13467 > open
    13468 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/94.4.pdb
    13469 
    13470 Summary of feedback from opening
    13471 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/94.4.pdb 
    13472 --- 
    13473 warnings | Ignored bad PDB record found on line 1 
    13474 REMARK GENERATED BY TRJCONV 
    13475  
    13476 Ignored bad PDB record found on line 3 
    13477 REMARK THIS IS A SIMULATION BOX 
    13478  
    13479 94.4.pdb title: 
    13480 Title t= 94400.00000 step= 47200000 [more info...] 
    13481  
    13482 Chain information for 94.4.pdb #473 
    13483 --- 
    13484 Chain | Description 
    13485 A B | No description available 
    13486  
    13487 Non-standard residues in 94.4.pdb #473 
    13488 --- 
    13489 HSD — (HSD) 
    13490 POT — (POT) 
    13491  
    13492 
    13493 > open
    13494 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/94.6.pdb
    13495 
    13496 Summary of feedback from opening
    13497 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/94.6.pdb 
    13498 --- 
    13499 warnings | Ignored bad PDB record found on line 1 
    13500 REMARK GENERATED BY TRJCONV 
    13501  
    13502 Ignored bad PDB record found on line 3 
    13503 REMARK THIS IS A SIMULATION BOX 
    13504  
    13505 94.6.pdb title: 
    13506 Title t= 94600.00000 step= 47300000 [more info...] 
    13507  
    13508 Chain information for 94.6.pdb #474 
    13509 --- 
    13510 Chain | Description 
    13511 A B | No description available 
    13512  
    13513 Non-standard residues in 94.6.pdb #474 
    13514 --- 
    13515 HSD — (HSD) 
    13516 POT — (POT) 
    13517  
    13518 
    13519 > open
    13520 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/94.8.pdb
    13521 
    13522 Summary of feedback from opening
    13523 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/94.8.pdb 
    13524 --- 
    13525 warnings | Ignored bad PDB record found on line 1 
    13526 REMARK GENERATED BY TRJCONV 
    13527  
    13528 Ignored bad PDB record found on line 3 
    13529 REMARK THIS IS A SIMULATION BOX 
    13530  
    13531 94.8.pdb title: 
    13532 Title t= 94800.00000 step= 47400000 [more info...] 
    13533  
    13534 Chain information for 94.8.pdb #475 
    13535 --- 
    13536 Chain | Description 
    13537 A B | No description available 
    13538  
    13539 Non-standard residues in 94.8.pdb #475 
    13540 --- 
    13541 HSD — (HSD) 
    13542 POT — (POT) 
    13543  
    13544 
    13545 > open
    13546 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/95.0.pdb
    13547 
    13548 Summary of feedback from opening
    13549 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/95.0.pdb 
    13550 --- 
    13551 warnings | Ignored bad PDB record found on line 1 
    13552 REMARK GENERATED BY TRJCONV 
    13553  
    13554 Ignored bad PDB record found on line 3 
    13555 REMARK THIS IS A SIMULATION BOX 
    13556  
    13557 95.0.pdb title: 
    13558 Title t= 95000.00000 step= 47500000 [more info...] 
    13559  
    13560 Chain information for 95.0.pdb #476 
    13561 --- 
    13562 Chain | Description 
    13563 A B | No description available 
    13564  
    13565 Non-standard residues in 95.0.pdb #476 
    13566 --- 
    13567 HSD — (HSD) 
    13568 POT — (POT) 
    13569  
    13570 
    13571 > open
    13572 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/95.2.pdb
    13573 
    13574 Summary of feedback from opening
    13575 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/95.2.pdb 
    13576 --- 
    13577 warnings | Ignored bad PDB record found on line 1 
    13578 REMARK GENERATED BY TRJCONV 
    13579  
    13580 Ignored bad PDB record found on line 3 
    13581 REMARK THIS IS A SIMULATION BOX 
    13582  
    13583 95.2.pdb title: 
    13584 Title t= 95200.00000 step= 47600000 [more info...] 
    13585  
    13586 Chain information for 95.2.pdb #477 
    13587 --- 
    13588 Chain | Description 
    13589 A B | No description available 
    13590  
    13591 Non-standard residues in 95.2.pdb #477 
    13592 --- 
    13593 HSD — (HSD) 
    13594 POT — (POT) 
    13595  
    13596 
    13597 > open
    13598 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/95.4.pdb
    13599 
    13600 Summary of feedback from opening
    13601 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/95.4.pdb 
    13602 --- 
    13603 warnings | Ignored bad PDB record found on line 1 
    13604 REMARK GENERATED BY TRJCONV 
    13605  
    13606 Ignored bad PDB record found on line 3 
    13607 REMARK THIS IS A SIMULATION BOX 
    13608  
    13609 95.4.pdb title: 
    13610 Title t= 95400.00000 step= 47700000 [more info...] 
    13611  
    13612 Chain information for 95.4.pdb #478 
    13613 --- 
    13614 Chain | Description 
    13615 A B | No description available 
    13616  
    13617 Non-standard residues in 95.4.pdb #478 
    13618 --- 
    13619 HSD — (HSD) 
    13620 POT — (POT) 
    13621  
    13622 
    13623 > open
    13624 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/95.6.pdb
    13625 
    13626 Summary of feedback from opening
    13627 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/95.6.pdb 
    13628 --- 
    13629 warnings | Ignored bad PDB record found on line 1 
    13630 REMARK GENERATED BY TRJCONV 
    13631  
    13632 Ignored bad PDB record found on line 3 
    13633 REMARK THIS IS A SIMULATION BOX 
    13634  
    13635 95.6.pdb title: 
    13636 Title t= 95600.00000 step= 47800000 [more info...] 
    13637  
    13638 Chain information for 95.6.pdb #479 
    13639 --- 
    13640 Chain | Description 
    13641 A B | No description available 
    13642  
    13643 Non-standard residues in 95.6.pdb #479 
    13644 --- 
    13645 HSD — (HSD) 
    13646 POT — (POT) 
    13647  
    13648 
    13649 > open
    13650 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/95.8.pdb
    13651 
    13652 Summary of feedback from opening
    13653 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/95.8.pdb 
    13654 --- 
    13655 warnings | Ignored bad PDB record found on line 1 
    13656 REMARK GENERATED BY TRJCONV 
    13657  
    13658 Ignored bad PDB record found on line 3 
    13659 REMARK THIS IS A SIMULATION BOX 
    13660  
    13661 95.8.pdb title: 
    13662 Title t= 95800.00000 step= 47900000 [more info...] 
    13663  
    13664 Chain information for 95.8.pdb #480 
    13665 --- 
    13666 Chain | Description 
    13667 A B | No description available 
    13668  
    13669 Non-standard residues in 95.8.pdb #480 
    13670 --- 
    13671 HSD — (HSD) 
    13672 POT — (POT) 
    13673  
    13674 
    13675 > open
    13676 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/96.0.pdb
    13677 
    13678 Summary of feedback from opening
    13679 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/96.0.pdb 
    13680 --- 
    13681 warnings | Ignored bad PDB record found on line 1 
    13682 REMARK GENERATED BY TRJCONV 
    13683  
    13684 Ignored bad PDB record found on line 3 
    13685 REMARK THIS IS A SIMULATION BOX 
    13686  
    13687 96.0.pdb title: 
    13688 Title t= 96000.00000 step= 48000000 [more info...] 
    13689  
    13690 Chain information for 96.0.pdb #481 
    13691 --- 
    13692 Chain | Description 
    13693 A B | No description available 
    13694  
    13695 Non-standard residues in 96.0.pdb #481 
    13696 --- 
    13697 HSD — (HSD) 
    13698 POT — (POT) 
    13699  
    13700 
    13701 > open
    13702 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/96.2.pdb
    13703 
    13704 Summary of feedback from opening
    13705 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/96.2.pdb 
    13706 --- 
    13707 warnings | Ignored bad PDB record found on line 1 
    13708 REMARK GENERATED BY TRJCONV 
    13709  
    13710 Ignored bad PDB record found on line 3 
    13711 REMARK THIS IS A SIMULATION BOX 
    13712  
    13713 96.2.pdb title: 
    13714 Title t= 96200.00000 step= 48100000 [more info...] 
    13715  
    13716 Chain information for 96.2.pdb #482 
    13717 --- 
    13718 Chain | Description 
    13719 A B | No description available 
    13720  
    13721 Non-standard residues in 96.2.pdb #482 
    13722 --- 
    13723 HSD — (HSD) 
    13724 POT — (POT) 
    13725  
    13726 
    13727 > open
    13728 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/96.4.pdb
    13729 
    13730 Summary of feedback from opening
    13731 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/96.4.pdb 
    13732 --- 
    13733 warnings | Ignored bad PDB record found on line 1 
    13734 REMARK GENERATED BY TRJCONV 
    13735  
    13736 Ignored bad PDB record found on line 3 
    13737 REMARK THIS IS A SIMULATION BOX 
    13738  
    13739 96.4.pdb title: 
    13740 Title t= 96400.00000 step= 48200000 [more info...] 
    13741  
    13742 Chain information for 96.4.pdb #483 
    13743 --- 
    13744 Chain | Description 
    13745 A B | No description available 
    13746  
    13747 Non-standard residues in 96.4.pdb #483 
    13748 --- 
    13749 HSD — (HSD) 
    13750 POT — (POT) 
    13751  
    13752 
    13753 > open
    13754 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/96.6.pdb
    13755 
    13756 Summary of feedback from opening
    13757 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/96.6.pdb 
    13758 --- 
    13759 warnings | Ignored bad PDB record found on line 1 
    13760 REMARK GENERATED BY TRJCONV 
    13761  
    13762 Ignored bad PDB record found on line 3 
    13763 REMARK THIS IS A SIMULATION BOX 
    13764  
    13765 96.6.pdb title: 
    13766 Title t= 96600.00000 step= 48300000 [more info...] 
    13767  
    13768 Chain information for 96.6.pdb #484 
    13769 --- 
    13770 Chain | Description 
    13771 A B | No description available 
    13772  
    13773 Non-standard residues in 96.6.pdb #484 
    13774 --- 
    13775 HSD — (HSD) 
    13776 POT — (POT) 
    13777  
    13778 
    13779 > open
    13780 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/96.8.pdb
    13781 
    13782 Summary of feedback from opening
    13783 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/96.8.pdb 
    13784 --- 
    13785 warnings | Ignored bad PDB record found on line 1 
    13786 REMARK GENERATED BY TRJCONV 
    13787  
    13788 Ignored bad PDB record found on line 3 
    13789 REMARK THIS IS A SIMULATION BOX 
    13790  
    13791 96.8.pdb title: 
    13792 Title t= 96800.00000 step= 48400000 [more info...] 
    13793  
    13794 Chain information for 96.8.pdb #485 
    13795 --- 
    13796 Chain | Description 
    13797 A B | No description available 
    13798  
    13799 Non-standard residues in 96.8.pdb #485 
    13800 --- 
    13801 HSD — (HSD) 
    13802 POT — (POT) 
    13803  
    13804 
    13805 > open
    13806 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/97.0.pdb
    13807 
    13808 Summary of feedback from opening
    13809 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/97.0.pdb 
    13810 --- 
    13811 warnings | Ignored bad PDB record found on line 1 
    13812 REMARK GENERATED BY TRJCONV 
    13813  
    13814 Ignored bad PDB record found on line 3 
    13815 REMARK THIS IS A SIMULATION BOX 
    13816  
    13817 97.0.pdb title: 
    13818 Title t= 97000.00000 step= 48500000 [more info...] 
    13819  
    13820 Chain information for 97.0.pdb #486 
    13821 --- 
    13822 Chain | Description 
    13823 A B | No description available 
    13824  
    13825 Non-standard residues in 97.0.pdb #486 
    13826 --- 
    13827 HSD — (HSD) 
    13828 POT — (POT) 
    13829  
    13830 
    13831 > open
    13832 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/97.2.pdb
    13833 
    13834 Summary of feedback from opening
    13835 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/97.2.pdb 
    13836 --- 
    13837 warnings | Ignored bad PDB record found on line 1 
    13838 REMARK GENERATED BY TRJCONV 
    13839  
    13840 Ignored bad PDB record found on line 3 
    13841 REMARK THIS IS A SIMULATION BOX 
    13842  
    13843 97.2.pdb title: 
    13844 Title t= 97200.00000 step= 48600000 [more info...] 
    13845  
    13846 Chain information for 97.2.pdb #487 
    13847 --- 
    13848 Chain | Description 
    13849 A B | No description available 
    13850  
    13851 Non-standard residues in 97.2.pdb #487 
    13852 --- 
    13853 HSD — (HSD) 
    13854 POT — (POT) 
    13855  
    13856 
    13857 > open
    13858 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/97.4.pdb
    13859 
    13860 Summary of feedback from opening
    13861 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/97.4.pdb 
    13862 --- 
    13863 warnings | Ignored bad PDB record found on line 1 
    13864 REMARK GENERATED BY TRJCONV 
    13865  
    13866 Ignored bad PDB record found on line 3 
    13867 REMARK THIS IS A SIMULATION BOX 
    13868  
    13869 97.4.pdb title: 
    13870 Title t= 97400.00000 step= 48700000 [more info...] 
    13871  
    13872 Chain information for 97.4.pdb #488 
    13873 --- 
    13874 Chain | Description 
    13875 A B | No description available 
    13876  
    13877 Non-standard residues in 97.4.pdb #488 
    13878 --- 
    13879 HSD — (HSD) 
    13880 POT — (POT) 
    13881  
    13882 
    13883 > open
    13884 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/97.6.pdb
    13885 
    13886 Summary of feedback from opening
    13887 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/97.6.pdb 
    13888 --- 
    13889 warnings | Ignored bad PDB record found on line 1 
    13890 REMARK GENERATED BY TRJCONV 
    13891  
    13892 Ignored bad PDB record found on line 3 
    13893 REMARK THIS IS A SIMULATION BOX 
    13894  
    13895 97.6.pdb title: 
    13896 Title t= 97600.00000 step= 48800000 [more info...] 
    13897  
    13898 Chain information for 97.6.pdb #489 
    13899 --- 
    13900 Chain | Description 
    13901 A B | No description available 
    13902  
    13903 Non-standard residues in 97.6.pdb #489 
    13904 --- 
    13905 HSD — (HSD) 
    13906 POT — (POT) 
    13907  
    13908 
    13909 > open
    13910 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/97.8.pdb
    13911 
    13912 Summary of feedback from opening
    13913 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/97.8.pdb 
    13914 --- 
    13915 warnings | Ignored bad PDB record found on line 1 
    13916 REMARK GENERATED BY TRJCONV 
    13917  
    13918 Ignored bad PDB record found on line 3 
    13919 REMARK THIS IS A SIMULATION BOX 
    13920  
    13921 97.8.pdb title: 
    13922 Title t= 97800.00000 step= 48900000 [more info...] 
    13923  
    13924 Chain information for 97.8.pdb #490 
    13925 --- 
    13926 Chain | Description 
    13927 A B | No description available 
    13928  
    13929 Non-standard residues in 97.8.pdb #490 
    13930 --- 
    13931 HSD — (HSD) 
    13932 POT — (POT) 
    13933  
    13934 
    13935 > open
    13936 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/98.0.pdb
    13937 
    13938 Summary of feedback from opening
    13939 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/98.0.pdb 
    13940 --- 
    13941 warnings | Ignored bad PDB record found on line 1 
    13942 REMARK GENERATED BY TRJCONV 
    13943  
    13944 Ignored bad PDB record found on line 3 
    13945 REMARK THIS IS A SIMULATION BOX 
    13946  
    13947 98.0.pdb title: 
    13948 Title t= 98000.00000 step= 49000000 [more info...] 
    13949  
    13950 Chain information for 98.0.pdb #491 
    13951 --- 
    13952 Chain | Description 
    13953 A B | No description available 
    13954  
    13955 Non-standard residues in 98.0.pdb #491 
    13956 --- 
    13957 HSD — (HSD) 
    13958 POT — (POT) 
    13959  
    13960 
    13961 > open
    13962 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/98.2.pdb
    13963 
    13964 Summary of feedback from opening
    13965 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/98.2.pdb 
    13966 --- 
    13967 warnings | Ignored bad PDB record found on line 1 
    13968 REMARK GENERATED BY TRJCONV 
    13969  
    13970 Ignored bad PDB record found on line 3 
    13971 REMARK THIS IS A SIMULATION BOX 
    13972  
    13973 98.2.pdb title: 
    13974 Title t= 98200.00000 step= 49100000 [more info...] 
    13975  
    13976 Chain information for 98.2.pdb #492 
    13977 --- 
    13978 Chain | Description 
    13979 A B | No description available 
    13980  
    13981 Non-standard residues in 98.2.pdb #492 
    13982 --- 
    13983 HSD — (HSD) 
    13984 POT — (POT) 
    13985  
    13986 
    13987 > open
    13988 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/98.4.pdb
    13989 
    13990 Summary of feedback from opening
    13991 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/98.4.pdb 
    13992 --- 
    13993 warnings | Ignored bad PDB record found on line 1 
    13994 REMARK GENERATED BY TRJCONV 
    13995  
    13996 Ignored bad PDB record found on line 3 
    13997 REMARK THIS IS A SIMULATION BOX 
    13998  
    13999 98.4.pdb title: 
    14000 Title t= 98400.00000 step= 49200000 [more info...] 
    14001  
    14002 Chain information for 98.4.pdb #493 
    14003 --- 
    14004 Chain | Description 
    14005 A B | No description available 
    14006  
    14007 Non-standard residues in 98.4.pdb #493 
    14008 --- 
    14009 HSD — (HSD) 
    14010 POT — (POT) 
    14011  
    14012 
    14013 > open
    14014 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/98.6.pdb
    14015 
    14016 Summary of feedback from opening
    14017 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/98.6.pdb 
    14018 --- 
    14019 warnings | Ignored bad PDB record found on line 1 
    14020 REMARK GENERATED BY TRJCONV 
    14021  
    14022 Ignored bad PDB record found on line 3 
    14023 REMARK THIS IS A SIMULATION BOX 
    14024  
    14025 98.6.pdb title: 
    14026 Title t= 98600.00000 step= 49300000 [more info...] 
    14027  
    14028 Chain information for 98.6.pdb #494 
    14029 --- 
    14030 Chain | Description 
    14031 A B | No description available 
    14032  
    14033 Non-standard residues in 98.6.pdb #494 
    14034 --- 
    14035 HSD — (HSD) 
    14036 POT — (POT) 
    14037  
    14038 
    14039 > open
    14040 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/98.8.pdb
    14041 
    14042 Summary of feedback from opening
    14043 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/98.8.pdb 
    14044 --- 
    14045 warnings | Ignored bad PDB record found on line 1 
    14046 REMARK GENERATED BY TRJCONV 
    14047  
    14048 Ignored bad PDB record found on line 3 
    14049 REMARK THIS IS A SIMULATION BOX 
    14050  
    14051 98.8.pdb title: 
    14052 Title t= 98800.00000 step= 49400000 [more info...] 
    14053  
    14054 Chain information for 98.8.pdb #495 
    14055 --- 
    14056 Chain | Description 
    14057 A B | No description available 
    14058  
    14059 Non-standard residues in 98.8.pdb #495 
    14060 --- 
    14061 HSD — (HSD) 
    14062 POT — (POT) 
    14063  
    14064 
    14065 > open
    14066 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/99.0.pdb
    14067 
    14068 Summary of feedback from opening
    14069 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/99.0.pdb 
    14070 --- 
    14071 warnings | Ignored bad PDB record found on line 1 
    14072 REMARK GENERATED BY TRJCONV 
    14073  
    14074 Ignored bad PDB record found on line 3 
    14075 REMARK THIS IS A SIMULATION BOX 
    14076  
    14077 99.0.pdb title: 
    14078 Title t= 99000.00000 step= 49500000 [more info...] 
    14079  
    14080 Chain information for 99.0.pdb #496 
    14081 --- 
    14082 Chain | Description 
    14083 A B | No description available 
    14084  
    14085 Non-standard residues in 99.0.pdb #496 
    14086 --- 
    14087 HSD — (HSD) 
    14088 POT — (POT) 
    14089  
    14090 
    14091 > open
    14092 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/99.2.pdb
    14093 
    14094 Summary of feedback from opening
    14095 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/99.2.pdb 
    14096 --- 
    14097 warnings | Ignored bad PDB record found on line 1 
    14098 REMARK GENERATED BY TRJCONV 
    14099  
    14100 Ignored bad PDB record found on line 3 
    14101 REMARK THIS IS A SIMULATION BOX 
    14102  
    14103 99.2.pdb title: 
    14104 Title t= 99200.00000 step= 49600000 [more info...] 
    14105  
    14106 Chain information for 99.2.pdb #497 
    14107 --- 
    14108 Chain | Description 
    14109 A B | No description available 
    14110  
    14111 Non-standard residues in 99.2.pdb #497 
    14112 --- 
    14113 HSD — (HSD) 
    14114 POT — (POT) 
    14115  
    14116 
    14117 > open
    14118 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/99.4.pdb
    14119 
    14120 Summary of feedback from opening
    14121 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/99.4.pdb 
    14122 --- 
    14123 warnings | Ignored bad PDB record found on line 1 
    14124 REMARK GENERATED BY TRJCONV 
    14125  
    14126 Ignored bad PDB record found on line 3 
    14127 REMARK THIS IS A SIMULATION BOX 
    14128  
    14129 99.4.pdb title: 
    14130 Title t= 99400.00000 step= 49700000 [more info...] 
    14131  
    14132 Chain information for 99.4.pdb #498 
    14133 --- 
    14134 Chain | Description 
    14135 A B | No description available 
    14136  
    14137 Non-standard residues in 99.4.pdb #498 
    14138 --- 
    14139 HSD — (HSD) 
    14140 POT — (POT) 
    14141  
    14142 
    14143 > open
    14144 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/99.6.pdb
    14145 
    14146 Summary of feedback from opening
    14147 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/99.6.pdb 
    14148 --- 
    14149 warnings | Ignored bad PDB record found on line 1 
    14150 REMARK GENERATED BY TRJCONV 
    14151  
    14152 Ignored bad PDB record found on line 3 
    14153 REMARK THIS IS A SIMULATION BOX 
    14154  
    14155 99.6.pdb title: 
    14156 Title t= 99600.00000 step= 49800000 [more info...] 
    14157  
    14158 Chain information for 99.6.pdb #499 
    14159 --- 
    14160 Chain | Description 
    14161 A B | No description available 
    14162  
    14163 Non-standard residues in 99.6.pdb #499 
    14164 --- 
    14165 HSD — (HSD) 
    14166 POT — (POT) 
    14167  
    14168 
    14169 > open
    14170 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/99.8.pdb
    14171 
    14172 Summary of feedback from opening
    14173 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/99.8.pdb 
    14174 --- 
    14175 warnings | Ignored bad PDB record found on line 1 
    14176 REMARK GENERATED BY TRJCONV 
    14177  
    14178 Ignored bad PDB record found on line 3 
    14179 REMARK THIS IS A SIMULATION BOX 
    14180  
    14181 99.8.pdb title: 
    14182 Title t= 99800.00000 step= 49900000 [more info...] 
    14183  
    14184 Chain information for 99.8.pdb #500 
    14185 --- 
    14186 Chain | Description 
    14187 A B | No description available 
    14188  
    14189 Non-standard residues in 99.8.pdb #500 
    14190 --- 
    14191 HSD — (HSD) 
    14192 POT — (POT) 
    14193  
    14194 
    14195 > open
    14196 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/100.0.pdb
    14197 
    14198 Summary of feedback from opening
    14199 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/100.0.pdb 
    14200 --- 
    14201 warnings | Ignored bad PDB record found on line 1 
    14202 REMARK GENERATED BY TRJCONV 
    14203  
    14204 Ignored bad PDB record found on line 3 
    14205 REMARK THIS IS A SIMULATION BOX 
    14206  
    14207 100.0.pdb title: 
    14208 Title t= 100000.00000 step= 50000000 [more info...] 
    14209  
    14210 Chain information for 100.0.pdb #501 
    14211 --- 
    14212 Chain | Description 
    14213 A B | No description available 
    14214  
    14215 Non-standard residues in 100.0.pdb #501 
    14216 --- 
    14217 HSD — (HSD) 
    14218 POT — (POT) 
    14219  
    14220 
    14221 > open
    14222 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/100.2.pdb
    14223 
    14224 Summary of feedback from opening
    14225 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/100.2.pdb 
    14226 --- 
    14227 warnings | Ignored bad PDB record found on line 1 
    14228 REMARK GENERATED BY TRJCONV 
    14229  
    14230 Ignored bad PDB record found on line 3 
    14231 REMARK THIS IS A SIMULATION BOX 
    14232  
    14233 100.2.pdb title: 
    14234 Title t= 100200.00000 step= 50100000 [more info...] 
    14235  
    14236 Chain information for 100.2.pdb #502 
    14237 --- 
    14238 Chain | Description 
    14239 A B | No description available 
    14240  
    14241 Non-standard residues in 100.2.pdb #502 
    14242 --- 
    14243 HSD — (HSD) 
    14244 POT — (POT) 
    14245  
    14246 
    14247 > open
    14248 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/100.4.pdb
    14249 
    14250 Summary of feedback from opening
    14251 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/100.4.pdb 
    14252 --- 
    14253 warnings | Ignored bad PDB record found on line 1 
    14254 REMARK GENERATED BY TRJCONV 
    14255  
    14256 Ignored bad PDB record found on line 3 
    14257 REMARK THIS IS A SIMULATION BOX 
    14258  
    14259 100.4.pdb title: 
    14260 Title t= 100400.00000 step= 50200000 [more info...] 
    14261  
    14262 Chain information for 100.4.pdb #503 
    14263 --- 
    14264 Chain | Description 
    14265 A B | No description available 
    14266  
    14267 Non-standard residues in 100.4.pdb #503 
    14268 --- 
    14269 HSD — (HSD) 
    14270 POT — (POT) 
    14271  
    14272 
    14273 > open
    14274 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/100.6.pdb
    14275 
    14276 Summary of feedback from opening
    14277 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/100.6.pdb 
    14278 --- 
    14279 warnings | Ignored bad PDB record found on line 1 
    14280 REMARK GENERATED BY TRJCONV 
    14281  
    14282 Ignored bad PDB record found on line 3 
    14283 REMARK THIS IS A SIMULATION BOX 
    14284  
    14285 100.6.pdb title: 
    14286 Title t= 100600.00000 step= 50300000 [more info...] 
    14287  
    14288 Chain information for 100.6.pdb #504 
    14289 --- 
    14290 Chain | Description 
    14291 A B | No description available 
    14292  
    14293 Non-standard residues in 100.6.pdb #504 
    14294 --- 
    14295 HSD — (HSD) 
    14296 POT — (POT) 
    14297  
    14298 
    14299 > open
    14300 > /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/100.8.pdb
    14301 
    14302 Summary of feedback from opening
    14303 /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/100.8.pdb 
    14304 --- 
    14305 warnings | Ignored bad PDB record found on line 1 
    14306 REMARK GENERATED BY TRJCONV 
    14307  
    14308 Ignored bad PDB record found on line 3 
    14309 REMARK THIS IS A SIMULATION BOX 
    14310  
    14311 100.8.pdb title: 
    14312 Title t= 100800.00000 step= 50400000 [more info...] 
    14313  
    14314 Chain information for 100.8.pdb #505 
    14315 --- 
    14316 Chain | Description 
    14317 A B | No description available 
    14318  
    14319 Non-standard residues in 100.8.pdb #505 
    14320 --- 
    14321 HSD — (HSD) 
    14322 POT — (POT) 
    14323  
    14324 
    14325 > open new_setting.cxc
    14326 
    14327 > preset "overall look" "publication 1 (silhouettes)"
    14328 
    14329 Using preset: Overall Look / Publication 1 (Silhouettes) 
    14330 Preset expands to these ChimeraX commands:
    14331 
    14332    
    14333    
    14334     set bg white
    14335     graphics silhouettes t
    14336     lighting depthCue f
    14337 
    14338  
    14339 
    14340 > lighting soft
    14341 
    14342 > matchmaker #2-505 to #1
    14343 
    14344 Parameters 
    14345 --- 
    14346 Chain pairing | bb 
    14347 Alignment algorithm | Needleman-Wunsch 
    14348 Similarity matrix | BLOSUM-62 
    14349 SS fraction | 0.3 
    14350 Gap open (HH/SS/other) | 18/18/6 
    14351 Gap extend | 1 
    14352 SS matrix |  |  | H | S | O 
    14353 ---|---|---|--- 
    14354 H | 6 | -9 | -6 
    14355 S |  | 6 | -6 
    14356 O |  |  | 4 
    14357 Iteration cutoff | 2 
    14358  
    14359 Matchmaker 0.pdb, chain B (#1) with 0.2.pdb, chain B (#2), sequence alignment
    14360 score = 1696.3 
    14361 RMSD between 303 pruned atom pairs is 0.930 angstroms; (across all 330 pairs:
    14362 1.212) 
    14363  
    14364 Matchmaker 0.pdb, chain B (#1) with 0.4.pdb, chain A (#3), sequence alignment
    14365 score = 1699.3 
    14366 RMSD between 235 pruned atom pairs is 1.040 angstroms; (across all 330 pairs:
    14367 2.353) 
    14368  
    14369 Matchmaker 0.pdb, chain B (#1) with 0.6.pdb, chain A (#4), sequence alignment
    14370 score = 1689.7 
    14371 RMSD between 252 pruned atom pairs is 0.921 angstroms; (across all 330 pairs:
    14372 2.743) 
    14373  
    14374 Matchmaker 0.pdb, chain B (#1) with 0.8.pdb, chain B (#5), sequence alignment
    14375 score = 1689.1 
    14376 RMSD between 261 pruned atom pairs is 1.004 angstroms; (across all 330 pairs:
    14377 2.388) 
    14378  
    14379 Matchmaker 0.pdb, chain B (#1) with 1.0.pdb, chain A (#6), sequence alignment
    14380 score = 1689.1 
    14381 RMSD between 249 pruned atom pairs is 0.945 angstroms; (across all 330 pairs:
    14382 3.801) 
    14383  
    14384 Matchmaker 0.pdb, chain B (#1) with 1.2.pdb, chain B (#7), sequence alignment
    14385 score = 1692.7 
    14386 RMSD between 242 pruned atom pairs is 0.886 angstroms; (across all 330 pairs:
    14387 2.246) 
    14388  
    14389 Matchmaker 0.pdb, chain B (#1) with 1.4.pdb, chain B (#8), sequence alignment
    14390 score = 1696.3 
    14391 RMSD between 273 pruned atom pairs is 0.998 angstroms; (across all 330 pairs:
    14392 1.983) 
    14393  
    14394 Matchmaker 0.pdb, chain B (#1) with 1.6.pdb, chain B (#9), sequence alignment
    14395 score = 1683.7 
    14396 RMSD between 257 pruned atom pairs is 0.967 angstroms; (across all 330 pairs:
    14397 2.018) 
    14398  
    14399 Matchmaker 0.pdb, chain A (#1) with 1.8.pdb, chain A (#10), sequence alignment
    14400 score = 1681.9 
    14401 RMSD between 241 pruned atom pairs is 0.935 angstroms; (across all 330 pairs:
    14402 4.984) 
    14403  
    14404 Matchmaker 0.pdb, chain B (#1) with 2.0.pdb, chain A (#11), sequence alignment
    14405 score = 1678.3 
    14406 RMSD between 242 pruned atom pairs is 0.967 angstroms; (across all 330 pairs:
    14407 4.385) 
    14408  
    14409 Matchmaker 0.pdb, chain B (#1) with 2.2.pdb, chain A (#12), sequence alignment
    14410 score = 1678.3 
    14411 RMSD between 231 pruned atom pairs is 0.990 angstroms; (across all 330 pairs:
    14412 4.915) 
    14413  
    14414 Matchmaker 0.pdb, chain A (#1) with 2.4.pdb, chain A (#13), sequence alignment
    14415 score = 1684.9 
    14416 RMSD between 242 pruned atom pairs is 0.907 angstroms; (across all 330 pairs:
    14417 5.581) 
    14418  
    14419 Matchmaker 0.pdb, chain A (#1) with 2.6.pdb, chain B (#14), sequence alignment
    14420 score = 1692.7 
    14421 RMSD between 238 pruned atom pairs is 1.066 angstroms; (across all 330 pairs:
    14422 2.092) 
    14423  
    14424 Matchmaker 0.pdb, chain B (#1) with 2.8.pdb, chain B (#15), sequence alignment
    14425 score = 1690.3 
    14426 RMSD between 241 pruned atom pairs is 0.982 angstroms; (across all 330 pairs:
    14427 2.179) 
    14428  
    14429 Matchmaker 0.pdb, chain B (#1) with 3.0.pdb, chain A (#16), sequence alignment
    14430 score = 1688.5 
    14431 RMSD between 238 pruned atom pairs is 0.870 angstroms; (across all 330 pairs:
    14432 5.454) 
    14433  
    14434 Matchmaker 0.pdb, chain B (#1) with 3.2.pdb, chain B (#17), sequence alignment
    14435 score = 1683.1 
    14436 RMSD between 284 pruned atom pairs is 1.156 angstroms; (across all 330 pairs:
    14437 1.618) 
    14438  
    14439 Matchmaker 0.pdb, chain B (#1) with 3.4.pdb, chain B (#18), sequence alignment
    14440 score = 1683.7 
    14441 RMSD between 270 pruned atom pairs is 1.073 angstroms; (across all 330 pairs:
    14442 2.131) 
    14443  
    14444 Matchmaker 0.pdb, chain B (#1) with 3.6.pdb, chain B (#19), sequence alignment
    14445 score = 1683.7 
    14446 RMSD between 224 pruned atom pairs is 0.928 angstroms; (across all 330 pairs:
    14447 2.944) 
    14448  
    14449 Matchmaker 0.pdb, chain B (#1) with 3.8.pdb, chain B (#20), sequence alignment
    14450 score = 1692.7 
    14451 RMSD between 223 pruned atom pairs is 0.868 angstroms; (across all 330 pairs:
    14452 3.574) 
    14453  
    14454 Matchmaker 0.pdb, chain B (#1) with 4.0.pdb, chain B (#21), sequence alignment
    14455 score = 1692.7 
    14456 RMSD between 216 pruned atom pairs is 0.987 angstroms; (across all 330 pairs:
    14457 3.346) 
    14458  
    14459 Matchmaker 0.pdb, chain B (#1) with 4.2.pdb, chain A (#22), sequence alignment
    14460 score = 1689.1 
    14461 RMSD between 247 pruned atom pairs is 0.908 angstroms; (across all 330 pairs:
    14462 2.844) 
    14463  
    14464 Matchmaker 0.pdb, chain A (#1) with 4.4.pdb, chain A (#23), sequence alignment
    14465 score = 1688.5 
    14466 RMSD between 239 pruned atom pairs is 0.876 angstroms; (across all 330 pairs:
    14467 2.450) 
    14468  
    14469 Matchmaker 0.pdb, chain B (#1) with 4.6.pdb, chain B (#24), sequence alignment
    14470 score = 1688.5 
    14471 RMSD between 231 pruned atom pairs is 1.039 angstroms; (across all 330 pairs:
    14472 2.100) 
    14473  
    14474 Matchmaker 0.pdb, chain B (#1) with 4.8.pdb, chain B (#25), sequence alignment
    14475 score = 1692.7 
    14476 RMSD between 221 pruned atom pairs is 1.061 angstroms; (across all 330 pairs:
    14477 2.374) 
    14478  
    14479 Matchmaker 0.pdb, chain A (#1) with 5.0.pdb, chain A (#26), sequence alignment
    14480 score = 1681.9 
    14481 RMSD between 277 pruned atom pairs is 0.914 angstroms; (across all 330 pairs:
    14482 1.761) 
    14483  
    14484 Matchmaker 0.pdb, chain B (#1) with 5.2.pdb, chain B (#27), sequence alignment
    14485 score = 1682.5 
    14486 RMSD between 252 pruned atom pairs is 1.087 angstroms; (across all 330 pairs:
    14487 1.724) 
    14488  
    14489 Matchmaker 0.pdb, chain B (#1) with 5.4.pdb, chain B (#28), sequence alignment
    14490 score = 1675.9 
    14491 RMSD between 239 pruned atom pairs is 1.062 angstroms; (across all 330 pairs:
    14492 2.011) 
    14493  
    14494 Matchmaker 0.pdb, chain B (#1) with 5.6.pdb, chain B (#29), sequence alignment
    14495 score = 1692.1 
    14496 RMSD between 210 pruned atom pairs is 0.944 angstroms; (across all 330 pairs:
    14497 2.938) 
    14498  
    14499 Matchmaker 0.pdb, chain B (#1) with 5.8.pdb, chain B (#30), sequence alignment
    14500 score = 1677.1 
    14501 RMSD between 232 pruned atom pairs is 0.954 angstroms; (across all 330 pairs:
    14502 3.146) 
    14503  
    14504 Matchmaker 0.pdb, chain B (#1) with 6.0.pdb, chain B (#31), sequence alignment
    14505 score = 1682.5 
    14506 RMSD between 241 pruned atom pairs is 0.991 angstroms; (across all 330 pairs:
    14507 2.782) 
    14508  
    14509 Matchmaker 0.pdb, chain B (#1) with 6.2.pdb, chain B (#32), sequence alignment
    14510 score = 1672.3 
    14511 RMSD between 235 pruned atom pairs is 1.030 angstroms; (across all 330 pairs:
    14512 3.447) 
    14513  
    14514 Matchmaker 0.pdb, chain B (#1) with 6.4.pdb, chain B (#33), sequence alignment
    14515 score = 1692.1 
    14516 RMSD between 219 pruned atom pairs is 0.916 angstroms; (across all 330 pairs:
    14517 3.846) 
    14518  
    14519 Matchmaker 0.pdb, chain B (#1) with 6.6.pdb, chain A (#34), sequence alignment
    14520 score = 1689.1 
    14521 RMSD between 216 pruned atom pairs is 1.077 angstroms; (across all 330 pairs:
    14522 4.776) 
    14523  
    14524 Matchmaker 0.pdb, chain B (#1) with 6.8.pdb, chain B (#35), sequence alignment
    14525 score = 1686.1 
    14526 RMSD between 224 pruned atom pairs is 0.970 angstroms; (across all 330 pairs:
    14527 3.297) 
    14528  
    14529 Matchmaker 0.pdb, chain B (#1) with 7.0.pdb, chain A (#36), sequence alignment
    14530 score = 1675.3 
    14531 RMSD between 212 pruned atom pairs is 0.973 angstroms; (across all 330 pairs:
    14532 4.261) 
    14533  
    14534 Matchmaker 0.pdb, chain B (#1) with 7.2.pdb, chain B (#37), sequence alignment
    14535 score = 1689.1 
    14536 RMSD between 220 pruned atom pairs is 0.939 angstroms; (across all 330 pairs:
    14537 3.298) 
    14538  
    14539 Matchmaker 0.pdb, chain B (#1) with 7.4.pdb, chain B (#38), sequence alignment
    14540 score = 1683.7 
    14541 RMSD between 213 pruned atom pairs is 1.009 angstroms; (across all 330 pairs:
    14542 3.727) 
    14543  
    14544 Matchmaker 0.pdb, chain B (#1) with 7.6.pdb, chain B (#39), sequence alignment
    14545 score = 1673.5 
    14546 RMSD between 213 pruned atom pairs is 0.928 angstroms; (across all 330 pairs:
    14547 3.421) 
    14548  
    14549 Matchmaker 0.pdb, chain B (#1) with 7.8.pdb, chain B (#40), sequence alignment
    14550 score = 1676.5 
    14551 RMSD between 221 pruned atom pairs is 0.932 angstroms; (across all 330 pairs:
    14552 3.391) 
    14553  
    14554 Matchmaker 0.pdb, chain B (#1) with 8.0.pdb, chain B (#41), sequence alignment
    14555 score = 1685.5 
    14556 RMSD between 230 pruned atom pairs is 0.949 angstroms; (across all 330 pairs:
    14557 2.692) 
    14558  
    14559 Matchmaker 0.pdb, chain A (#1) with 8.2.pdb, chain B (#42), sequence alignment
    14560 score = 1685.5 
    14561 RMSD between 228 pruned atom pairs is 0.953 angstroms; (across all 330 pairs:
    14562 2.213) 
    14563  
    14564 Matchmaker 0.pdb, chain B (#1) with 8.4.pdb, chain B (#43), sequence alignment
    14565 score = 1674.7 
    14566 RMSD between 216 pruned atom pairs is 0.972 angstroms; (across all 330 pairs:
    14567 2.040) 
    14568  
    14569 Matchmaker 0.pdb, chain A (#1) with 8.6.pdb, chain B (#44), sequence alignment
    14570 score = 1675.3 
    14571 RMSD between 246 pruned atom pairs is 1.125 angstroms; (across all 330 pairs:
    14572 1.897) 
    14573  
    14574 Matchmaker 0.pdb, chain B (#1) with 8.8.pdb, chain B (#45), sequence alignment
    14575 score = 1686.1 
    14576 RMSD between 235 pruned atom pairs is 0.942 angstroms; (across all 330 pairs:
    14577 2.376) 
    14578  
    14579 Matchmaker 0.pdb, chain A (#1) with 9.0.pdb, chain A (#46), sequence alignment
    14580 score = 1678.3 
    14581 RMSD between 233 pruned atom pairs is 0.987 angstroms; (across all 330 pairs:
    14582 2.555) 
    14583  
    14584 Matchmaker 0.pdb, chain B (#1) with 9.2.pdb, chain B (#47), sequence alignment
    14585 score = 1668.1 
    14586 RMSD between 254 pruned atom pairs is 1.063 angstroms; (across all 330 pairs:
    14587 1.656) 
    14588  
    14589 Matchmaker 0.pdb, chain B (#1) with 9.4.pdb, chain B (#48), sequence alignment
    14590 score = 1678.3 
    14591 RMSD between 251 pruned atom pairs is 0.963 angstroms; (across all 330 pairs:
    14592 1.968) 
    14593  
    14594 Matchmaker 0.pdb, chain A (#1) with 9.6.pdb, chain B (#49), sequence alignment
    14595 score = 1688.5 
    14596 RMSD between 253 pruned atom pairs is 1.082 angstroms; (across all 330 pairs:
    14597 1.816) 
    14598  
    14599 Matchmaker 0.pdb, chain B (#1) with 9.8.pdb, chain B (#50), sequence alignment
    14600 score = 1685.5 
    14601 RMSD between 251 pruned atom pairs is 0.983 angstroms; (across all 330 pairs:
    14602 1.958) 
    14603  
    14604 Matchmaker 0.pdb, chain B (#1) with 10.0.pdb, chain B (#51), sequence
    14605 alignment score = 1685.5 
    14606 RMSD between 255 pruned atom pairs is 1.040 angstroms; (across all 330 pairs:
    14607 1.876) 
    14608  
    14609 Matchmaker 0.pdb, chain B (#1) with 10.2.pdb, chain B (#52), sequence
    14610 alignment score = 1689.1 
    14611 RMSD between 246 pruned atom pairs is 1.003 angstroms; (across all 330 pairs:
    14612 1.853) 
    14613  
    14614 Matchmaker 0.pdb, chain B (#1) with 10.4.pdb, chain B (#53), sequence
    14615 alignment score = 1692.7 
    14616 RMSD between 233 pruned atom pairs is 1.036 angstroms; (across all 330 pairs:
    14617 2.935) 
    14618  
    14619 Matchmaker 0.pdb, chain B (#1) with 10.6.pdb, chain B (#54), sequence
    14620 alignment score = 1688.5 
    14621 RMSD between 265 pruned atom pairs is 0.975 angstroms; (across all 330 pairs:
    14622 1.715) 
    14623  
    14624 Matchmaker 0.pdb, chain B (#1) with 10.8.pdb, chain B (#55), sequence
    14625 alignment score = 1692.7 
    14626 RMSD between 221 pruned atom pairs is 0.918 angstroms; (across all 330 pairs:
    14627 3.125) 
    14628  
    14629 Matchmaker 0.pdb, chain B (#1) with 11.0.pdb, chain B (#56), sequence
    14630 alignment score = 1696.3 
    14631 RMSD between 273 pruned atom pairs is 0.967 angstroms; (across all 330 pairs:
    14632 2.476) 
    14633  
    14634 Matchmaker 0.pdb, chain B (#1) with 11.2.pdb, chain B (#57), sequence
    14635 alignment score = 1693.3 
    14636 RMSD between 262 pruned atom pairs is 1.062 angstroms; (across all 330 pairs:
    14637 1.825) 
    14638  
    14639 Matchmaker 0.pdb, chain B (#1) with 11.4.pdb, chain B (#58), sequence
    14640 alignment score = 1695.7 
    14641 RMSD between 245 pruned atom pairs is 0.965 angstroms; (across all 330 pairs:
    14642 1.945) 
    14643  
    14644 Matchmaker 0.pdb, chain B (#1) with 11.6.pdb, chain B (#59), sequence
    14645 alignment score = 1681.9 
    14646 RMSD between 230 pruned atom pairs is 1.012 angstroms; (across all 330 pairs:
    14647 2.238) 
    14648  
    14649 Matchmaker 0.pdb, chain B (#1) with 11.8.pdb, chain B (#60), sequence
    14650 alignment score = 1678.9 
    14651 RMSD between 232 pruned atom pairs is 0.881 angstroms; (across all 330 pairs:
    14652 2.696) 
    14653  
    14654 Matchmaker 0.pdb, chain B (#1) with 12.0.pdb, chain B (#61), sequence
    14655 alignment score = 1692.7 
    14656 RMSD between 211 pruned atom pairs is 0.934 angstroms; (across all 330 pairs:
    14657 3.410) 
    14658  
    14659 Matchmaker 0.pdb, chain B (#1) with 12.2.pdb, chain B (#62), sequence
    14660 alignment score = 1692.7 
    14661 RMSD between 202 pruned atom pairs is 0.881 angstroms; (across all 330 pairs:
    14662 2.372) 
    14663  
    14664 Matchmaker 0.pdb, chain B (#1) with 12.4.pdb, chain B (#63), sequence
    14665 alignment score = 1686.1 
    14666 RMSD between 214 pruned atom pairs is 0.847 angstroms; (across all 330 pairs:
    14667 2.459) 
    14668  
    14669 Matchmaker 0.pdb, chain B (#1) with 12.6.pdb, chain B (#64), sequence
    14670 alignment score = 1696.3 
    14671 RMSD between 216 pruned atom pairs is 0.954 angstroms; (across all 330 pairs:
    14672 2.545) 
    14673  
    14674 Matchmaker 0.pdb, chain B (#1) with 12.8.pdb, chain A (#65), sequence
    14675 alignment score = 1681.9 
    14676 RMSD between 225 pruned atom pairs is 1.048 angstroms; (across all 330 pairs:
    14677 4.772) 
    14678  
    14679 Matchmaker 0.pdb, chain B (#1) with 13.0.pdb, chain A (#66), sequence
    14680 alignment score = 1678.9 
    14681 RMSD between 213 pruned atom pairs is 0.906 angstroms; (across all 330 pairs:
    14682 3.858) 
    14683  
    14684 Matchmaker 0.pdb, chain B (#1) with 13.2.pdb, chain B (#67), sequence
    14685 alignment score = 1696.3 
    14686 RMSD between 238 pruned atom pairs is 1.075 angstroms; (across all 330 pairs:
    14687 1.904) 
    14688  
    14689 Matchmaker 0.pdb, chain B (#1) with 13.4.pdb, chain B (#68), sequence
    14690 alignment score = 1681.9 
    14691 RMSD between 215 pruned atom pairs is 0.851 angstroms; (across all 330 pairs:
    14692 2.358) 
    14693  
    14694 Matchmaker 0.pdb, chain A (#1) with 13.6.pdb, chain B (#69), sequence
    14695 alignment score = 1689.7 
    14696 RMSD between 218 pruned atom pairs is 0.934 angstroms; (across all 330 pairs:
    14697 2.386) 
    14698  
    14699 Matchmaker 0.pdb, chain B (#1) with 13.8.pdb, chain B (#70), sequence
    14700 alignment score = 1688.5 
    14701 RMSD between 247 pruned atom pairs is 1.061 angstroms; (across all 330 pairs:
    14702 1.918) 
    14703  
    14704 Matchmaker 0.pdb, chain A (#1) with 14.0.pdb, chain B (#71), sequence
    14705 alignment score = 1689.1 
    14706 RMSD between 229 pruned atom pairs is 1.052 angstroms; (across all 330 pairs:
    14707 2.289) 
    14708  
    14709 Matchmaker 0.pdb, chain A (#1) with 14.2.pdb, chain B (#72), sequence
    14710 alignment score = 1692.1 
    14711 RMSD between 265 pruned atom pairs is 1.044 angstroms; (across all 330 pairs:
    14712 1.972) 
    14713  
    14714 Matchmaker 0.pdb, chain B (#1) with 14.4.pdb, chain B (#73), sequence
    14715 alignment score = 1683.7 
    14716 RMSD between 246 pruned atom pairs is 1.039 angstroms; (across all 330 pairs:
    14717 2.304) 
    14718  
    14719 Matchmaker 0.pdb, chain B (#1) with 14.6.pdb, chain B (#74), sequence
    14720 alignment score = 1693.3 
    14721 RMSD between 247 pruned atom pairs is 1.019 angstroms; (across all 330 pairs:
    14722 2.996) 
    14723  
    14724 Matchmaker 0.pdb, chain B (#1) with 14.8.pdb, chain B (#75), sequence
    14725 alignment score = 1699.3 
    14726 RMSD between 225 pruned atom pairs is 0.962 angstroms; (across all 330 pairs:
    14727 3.195) 
    14728  
    14729 Matchmaker 0.pdb, chain A (#1) with 15.0.pdb, chain B (#76), sequence
    14730 alignment score = 1692.7 
    14731 RMSD between 233 pruned atom pairs is 1.006 angstroms; (across all 330 pairs:
    14732 3.873) 
    14733  
    14734 Matchmaker 0.pdb, chain B (#1) with 15.2.pdb, chain B (#77), sequence
    14735 alignment score = 1684.3 
    14736 RMSD between 233 pruned atom pairs is 1.005 angstroms; (across all 330 pairs:
    14737 3.815) 
    14738  
    14739 Matchmaker 0.pdb, chain B (#1) with 15.4.pdb, chain B (#78), sequence
    14740 alignment score = 1685.5 
    14741 RMSD between 220 pruned atom pairs is 0.802 angstroms; (across all 330 pairs:
    14742 4.548) 
    14743  
    14744 Matchmaker 0.pdb, chain B (#1) with 15.6.pdb, chain B (#79), sequence
    14745 alignment score = 1696.3 
    14746 RMSD between 222 pruned atom pairs is 0.963 angstroms; (across all 330 pairs:
    14747 4.125) 
    14748  
    14749 Matchmaker 0.pdb, chain B (#1) with 15.8.pdb, chain B (#80), sequence
    14750 alignment score = 1682.5 
    14751 RMSD between 226 pruned atom pairs is 0.923 angstroms; (across all 330 pairs:
    14752 4.548) 
    14753  
    14754 Matchmaker 0.pdb, chain B (#1) with 16.0.pdb, chain B (#81), sequence
    14755 alignment score = 1678.9 
    14756 RMSD between 219 pruned atom pairs is 0.908 angstroms; (across all 330 pairs:
    14757 3.857) 
    14758  
    14759 Matchmaker 0.pdb, chain B (#1) with 16.2.pdb, chain B (#82), sequence
    14760 alignment score = 1692.7 
    14761 RMSD between 224 pruned atom pairs is 0.914 angstroms; (across all 330 pairs:
    14762 4.820) 
    14763  
    14764 Matchmaker 0.pdb, chain B (#1) with 16.4.pdb, chain A (#83), sequence
    14765 alignment score = 1671.1 
    14766 RMSD between 216 pruned atom pairs is 0.988 angstroms; (across all 330 pairs:
    14767 3.341) 
    14768  
    14769 Matchmaker 0.pdb, chain B (#1) with 16.6.pdb, chain B (#84), sequence
    14770 alignment score = 1682.5 
    14771 RMSD between 227 pruned atom pairs is 0.807 angstroms; (across all 330 pairs:
    14772 3.657) 
    14773  
    14774 Matchmaker 0.pdb, chain B (#1) with 16.8.pdb, chain B (#85), sequence
    14775 alignment score = 1682.5 
    14776 RMSD between 243 pruned atom pairs is 1.007 angstroms; (across all 330 pairs:
    14777 2.793) 
    14778  
    14779 Matchmaker 0.pdb, chain B (#1) with 17.0.pdb, chain B (#86), sequence
    14780 alignment score = 1678.3 
    14781 RMSD between 226 pruned atom pairs is 0.907 angstroms; (across all 330 pairs:
    14782 3.657) 
    14783  
    14784 Matchmaker 0.pdb, chain B (#1) with 17.2.pdb, chain B (#87), sequence
    14785 alignment score = 1689.7 
    14786 RMSD between 243 pruned atom pairs is 0.929 angstroms; (across all 330 pairs:
    14787 2.102) 
    14788  
    14789 Matchmaker 0.pdb, chain B (#1) with 17.4.pdb, chain B (#88), sequence
    14790 alignment score = 1681.3 
    14791 RMSD between 234 pruned atom pairs is 0.879 angstroms; (across all 330 pairs:
    14792 2.120) 
    14793  
    14794 Matchmaker 0.pdb, chain B (#1) with 17.6.pdb, chain B (#89), sequence
    14795 alignment score = 1686.1 
    14796 RMSD between 244 pruned atom pairs is 1.087 angstroms; (across all 330 pairs:
    14797 1.886) 
    14798  
    14799 Matchmaker 0.pdb, chain B (#1) with 17.8.pdb, chain B (#90), sequence
    14800 alignment score = 1682.5 
    14801 RMSD between 225 pruned atom pairs is 1.019 angstroms; (across all 330 pairs:
    14802 2.011) 
    14803  
    14804 Matchmaker 0.pdb, chain B (#1) with 18.0.pdb, chain B (#91), sequence
    14805 alignment score = 1678.9 
    14806 RMSD between 229 pruned atom pairs is 0.966 angstroms; (across all 330 pairs:
    14807 2.689) 
    14808  
    14809 Matchmaker 0.pdb, chain B (#1) with 18.2.pdb, chain B (#92), sequence
    14810 alignment score = 1682.5 
    14811 RMSD between 232 pruned atom pairs is 0.970 angstroms; (across all 330 pairs:
    14812 3.655) 
    14813  
    14814 Matchmaker 0.pdb, chain B (#1) with 18.4.pdb, chain B (#93), sequence
    14815 alignment score = 1675.3 
    14816 RMSD between 217 pruned atom pairs is 0.942 angstroms; (across all 330 pairs:
    14817 3.603) 
    14818  
    14819 Matchmaker 0.pdb, chain B (#1) with 18.6.pdb, chain B (#94), sequence
    14820 alignment score = 1681.9 
    14821 RMSD between 258 pruned atom pairs is 0.988 angstroms; (across all 330 pairs:
    14822 2.929) 
    14823  
    14824 Matchmaker 0.pdb, chain B (#1) with 18.8.pdb, chain B (#95), sequence
    14825 alignment score = 1683.1 
    14826 RMSD between 241 pruned atom pairs is 0.978 angstroms; (across all 330 pairs:
    14827 3.659) 
    14828  
    14829 Matchmaker 0.pdb, chain B (#1) with 19.0.pdb, chain B (#96), sequence
    14830 alignment score = 1678.9 
    14831 RMSD between 224 pruned atom pairs is 1.009 angstroms; (across all 330 pairs:
    14832 2.838) 
    14833  
    14834 Matchmaker 0.pdb, chain B (#1) with 19.2.pdb, chain B (#97), sequence
    14835 alignment score = 1688.5 
    14836 RMSD between 234 pruned atom pairs is 1.034 angstroms; (across all 330 pairs:
    14837 2.853) 
    14838  
    14839 Matchmaker 0.pdb, chain A (#1) with 19.4.pdb, chain B (#98), sequence
    14840 alignment score = 1692.1 
    14841 RMSD between 220 pruned atom pairs is 1.044 angstroms; (across all 330 pairs:
    14842 3.404) 
    14843  
    14844 Matchmaker 0.pdb, chain A (#1) with 19.6.pdb, chain A (#99), sequence
    14845 alignment score = 1671.7 
    14846 RMSD between 223 pruned atom pairs is 0.951 angstroms; (across all 330 pairs:
    14847 4.275) 
    14848  
    14849 Matchmaker 0.pdb, chain B (#1) with 19.8.pdb, chain A (#100), sequence
    14850 alignment score = 1678.3 
    14851 RMSD between 213 pruned atom pairs is 0.921 angstroms; (across all 330 pairs:
    14852 4.110) 
    14853  
    14854 Matchmaker 0.pdb, chain B (#1) with 20.0.pdb, chain B (#101), sequence
    14855 alignment score = 1695.7 
    14856 RMSD between 200 pruned atom pairs is 0.948 angstroms; (across all 330 pairs:
    14857 2.855) 
    14858  
    14859 Matchmaker 0.pdb, chain B (#1) with 20.2.pdb, chain B (#102), sequence
    14860 alignment score = 1678.3 
    14861 RMSD between 207 pruned atom pairs is 0.973 angstroms; (across all 330 pairs:
    14862 2.533) 
    14863  
    14864 Matchmaker 0.pdb, chain B (#1) with 20.4.pdb, chain B (#103), sequence
    14865 alignment score = 1692.7 
    14866 RMSD between 212 pruned atom pairs is 0.953 angstroms; (across all 330 pairs:
    14867 3.644) 
    14868  
    14869 Matchmaker 0.pdb, chain B (#1) with 20.6.pdb, chain B (#104), sequence
    14870 alignment score = 1685.5 
    14871 RMSD between 204 pruned atom pairs is 0.907 angstroms; (across all 330 pairs:
    14872 2.796) 
    14873  
    14874 Matchmaker 0.pdb, chain B (#1) with 20.8.pdb, chain B (#105), sequence
    14875 alignment score = 1684.9 
    14876 RMSD between 239 pruned atom pairs is 1.107 angstroms; (across all 330 pairs:
    14877 2.232) 
    14878  
    14879 Matchmaker 0.pdb, chain B (#1) with 21.0.pdb, chain A (#106), sequence
    14880 alignment score = 1681.3 
    14881 RMSD between 240 pruned atom pairs is 1.016 angstroms; (across all 330 pairs:
    14882 2.753) 
    14883  
    14884 Matchmaker 0.pdb, chain B (#1) with 21.2.pdb, chain B (#107), sequence
    14885 alignment score = 1692.7 
    14886 RMSD between 222 pruned atom pairs is 0.984 angstroms; (across all 330 pairs:
    14887 3.784) 
    14888  
    14889 Matchmaker 0.pdb, chain A (#1) with 21.4.pdb, chain B (#108), sequence
    14890 alignment score = 1688.5 
    14891 RMSD between 220 pruned atom pairs is 0.983 angstroms; (across all 330 pairs:
    14892 3.809) 
    14893  
    14894 Matchmaker 0.pdb, chain B (#1) with 21.6.pdb, chain B (#109), sequence
    14895 alignment score = 1695.7 
    14896 RMSD between 219 pruned atom pairs is 1.004 angstroms; (across all 330 pairs:
    14897 3.219) 
    14898  
    14899 Matchmaker 0.pdb, chain B (#1) with 21.8.pdb, chain B (#110), sequence
    14900 alignment score = 1679.5 
    14901 RMSD between 211 pruned atom pairs is 0.977 angstroms; (across all 330 pairs:
    14902 4.044) 
    14903  
    14904 Matchmaker 0.pdb, chain B (#1) with 22.0.pdb, chain B (#111), sequence
    14905 alignment score = 1678.3 
    14906 RMSD between 219 pruned atom pairs is 0.989 angstroms; (across all 330 pairs:
    14907 3.022) 
    14908  
    14909 Matchmaker 0.pdb, chain B (#1) with 22.2.pdb, chain B (#112), sequence
    14910 alignment score = 1675.3 
    14911 RMSD between 225 pruned atom pairs is 0.933 angstroms; (across all 330 pairs:
    14912 3.284) 
    14913  
    14914 Matchmaker 0.pdb, chain B (#1) with 22.4.pdb, chain B (#113), sequence
    14915 alignment score = 1689.1 
    14916 RMSD between 209 pruned atom pairs is 0.959 angstroms; (across all 330 pairs:
    14917 3.661) 
    14918  
    14919 Matchmaker 0.pdb, chain B (#1) with 22.6.pdb, chain B (#114), sequence
    14920 alignment score = 1686.1 
    14921 RMSD between 223 pruned atom pairs is 0.962 angstroms; (across all 330 pairs:
    14922 2.911) 
    14923  
    14924 Matchmaker 0.pdb, chain B (#1) with 22.8.pdb, chain B (#115), sequence
    14925 alignment score = 1689.1 
    14926 RMSD between 225 pruned atom pairs is 0.965 angstroms; (across all 330 pairs:
    14927 2.796) 
    14928  
    14929 Matchmaker 0.pdb, chain B (#1) with 23.0.pdb, chain B (#116), sequence
    14930 alignment score = 1684.9 
    14931 RMSD between 207 pruned atom pairs is 0.882 angstroms; (across all 330 pairs:
    14932 2.870) 
    14933  
    14934 Matchmaker 0.pdb, chain B (#1) with 23.2.pdb, chain B (#117), sequence
    14935 alignment score = 1682.5 
    14936 RMSD between 230 pruned atom pairs is 0.968 angstroms; (across all 330 pairs:
    14937 3.077) 
    14938  
    14939 Matchmaker 0.pdb, chain A (#1) with 23.4.pdb, chain B (#118), sequence
    14940 alignment score = 1688.5 
    14941 RMSD between 215 pruned atom pairs is 0.924 angstroms; (across all 330 pairs:
    14942 2.490) 
    14943  
    14944 Matchmaker 0.pdb, chain B (#1) with 23.6.pdb, chain A (#119), sequence
    14945 alignment score = 1671.7 
    14946 RMSD between 223 pruned atom pairs is 0.987 angstroms; (across all 330 pairs:
    14947 3.239) 
    14948  
    14949 Matchmaker 0.pdb, chain B (#1) with 23.8.pdb, chain B (#120), sequence
    14950 alignment score = 1680.1 
    14951 RMSD between 228 pruned atom pairs is 0.970 angstroms; (across all 330 pairs:
    14952 2.299) 
    14953  
    14954 Matchmaker 0.pdb, chain B (#1) with 24.0.pdb, chain A (#121), sequence
    14955 alignment score = 1678.3 
    14956 RMSD between 208 pruned atom pairs is 0.986 angstroms; (across all 330 pairs:
    14957 3.924) 
    14958  
    14959 Matchmaker 0.pdb, chain B (#1) with 24.2.pdb, chain B (#122), sequence
    14960 alignment score = 1678.9 
    14961 RMSD between 220 pruned atom pairs is 0.880 angstroms; (across all 330 pairs:
    14962 3.164) 
    14963  
    14964 Matchmaker 0.pdb, chain B (#1) with 24.4.pdb, chain B (#123), sequence
    14965 alignment score = 1683.7 
    14966 RMSD between 231 pruned atom pairs is 1.001 angstroms; (across all 330 pairs:
    14967 2.620) 
    14968  
    14969 Matchmaker 0.pdb, chain B (#1) with 24.6.pdb, chain B (#124), sequence
    14970 alignment score = 1689.7 
    14971 RMSD between 190 pruned atom pairs is 0.856 angstroms; (across all 330 pairs:
    14972 3.918) 
    14973  
    14974 Matchmaker 0.pdb, chain B (#1) with 24.8.pdb, chain A (#125), sequence
    14975 alignment score = 1681.9 
    14976 RMSD between 203 pruned atom pairs is 0.989 angstroms; (across all 330 pairs:
    14977 6.001) 
    14978  
    14979 Matchmaker 0.pdb, chain B (#1) with 25.0.pdb, chain B (#126), sequence
    14980 alignment score = 1690.3 
    14981 RMSD between 239 pruned atom pairs is 0.934 angstroms; (across all 330 pairs:
    14982 3.370) 
    14983  
    14984 Matchmaker 0.pdb, chain A (#1) with 25.2.pdb, chain B (#127), sequence
    14985 alignment score = 1676.5 
    14986 RMSD between 234 pruned atom pairs is 0.996 angstroms; (across all 330 pairs:
    14987 2.772) 
    14988  
    14989 Matchmaker 0.pdb, chain B (#1) with 25.4.pdb, chain B (#128), sequence
    14990 alignment score = 1687.3 
    14991 RMSD between 243 pruned atom pairs is 0.915 angstroms; (across all 330 pairs:
    14992 2.846) 
    14993  
    14994 Matchmaker 0.pdb, chain B (#1) with 25.6.pdb, chain B (#129), sequence
    14995 alignment score = 1680.1 
    14996 RMSD between 235 pruned atom pairs is 0.898 angstroms; (across all 330 pairs:
    14997 4.212) 
    14998  
    14999 Matchmaker 0.pdb, chain B (#1) with 25.8.pdb, chain B (#130), sequence
    15000 alignment score = 1680.7 
    15001 RMSD between 226 pruned atom pairs is 0.891 angstroms; (across all 330 pairs:
    15002 3.492) 
    15003  
    15004 Matchmaker 0.pdb, chain B (#1) with 26.0.pdb, chain B (#131), sequence
    15005 alignment score = 1683.7 
    15006 RMSD between 227 pruned atom pairs is 0.946 angstroms; (across all 330 pairs:
    15007 3.447) 
    15008  
    15009 Matchmaker 0.pdb, chain B (#1) with 26.2.pdb, chain B (#132), sequence
    15010 alignment score = 1689.7 
    15011 RMSD between 228 pruned atom pairs is 0.930 angstroms; (across all 330 pairs:
    15012 2.896) 
    15013  
    15014 Matchmaker 0.pdb, chain B (#1) with 26.4.pdb, chain B (#133), sequence
    15015 alignment score = 1687.3 
    15016 RMSD between 229 pruned atom pairs is 0.992 angstroms; (across all 330 pairs:
    15017 3.020) 
    15018  
    15019 Matchmaker 0.pdb, chain B (#1) with 26.6.pdb, chain B (#134), sequence
    15020 alignment score = 1680.7 
    15021 RMSD between 195 pruned atom pairs is 0.921 angstroms; (across all 330 pairs:
    15022 4.042) 
    15023  
    15024 Matchmaker 0.pdb, chain B (#1) with 26.8.pdb, chain B (#135), sequence
    15025 alignment score = 1683.7 
    15026 RMSD between 199 pruned atom pairs is 0.927 angstroms; (across all 330 pairs:
    15027 5.008) 
    15028  
    15029 Matchmaker 0.pdb, chain B (#1) with 27.0.pdb, chain B (#136), sequence
    15030 alignment score = 1687.3 
    15031 RMSD between 212 pruned atom pairs is 0.913 angstroms; (across all 330 pairs:
    15032 5.224) 
    15033  
    15034 Matchmaker 0.pdb, chain B (#1) with 27.2.pdb, chain B (#137), sequence
    15035 alignment score = 1688.5 
    15036 RMSD between 208 pruned atom pairs is 0.927 angstroms; (across all 330 pairs:
    15037 4.937) 
    15038  
    15039 Matchmaker 0.pdb, chain B (#1) with 27.4.pdb, chain B (#138), sequence
    15040 alignment score = 1684.3 
    15041 RMSD between 216 pruned atom pairs is 0.943 angstroms; (across all 330 pairs:
    15042 5.338) 
    15043  
    15044 Matchmaker 0.pdb, chain B (#1) with 27.6.pdb, chain B (#139), sequence
    15045 alignment score = 1693.3 
    15046 RMSD between 209 pruned atom pairs is 0.901 angstroms; (across all 330 pairs:
    15047 5.433) 
    15048  
    15049 Matchmaker 0.pdb, chain B (#1) with 27.8.pdb, chain B (#140), sequence
    15050 alignment score = 1685.5 
    15051 RMSD between 210 pruned atom pairs is 0.904 angstroms; (across all 330 pairs:
    15052 5.928) 
    15053  
    15054 Matchmaker 0.pdb, chain B (#1) with 28.0.pdb, chain A (#141), sequence
    15055 alignment score = 1674.7 
    15056 RMSD between 208 pruned atom pairs is 1.060 angstroms; (across all 330 pairs:
    15057 4.839) 
    15058  
    15059 Matchmaker 0.pdb, chain B (#1) with 28.2.pdb, chain B (#142), sequence
    15060 alignment score = 1687.3 
    15061 RMSD between 208 pruned atom pairs is 0.980 angstroms; (across all 330 pairs:
    15062 5.851) 
    15063  
    15064 Matchmaker 0.pdb, chain B (#1) with 28.4.pdb, chain B (#143), sequence
    15065 alignment score = 1695.7 
    15066 RMSD between 199 pruned atom pairs is 0.874 angstroms; (across all 330 pairs:
    15067 6.836) 
    15068  
    15069 Matchmaker 0.pdb, chain B (#1) with 28.6.pdb, chain B (#144), sequence
    15070 alignment score = 1695.7 
    15071 RMSD between 197 pruned atom pairs is 0.849 angstroms; (across all 330 pairs:
    15072 6.486) 
    15073  
    15074 Matchmaker 0.pdb, chain B (#1) with 28.8.pdb, chain B (#145), sequence
    15075 alignment score = 1692.1 
    15076 RMSD between 195 pruned atom pairs is 0.808 angstroms; (across all 330 pairs:
    15077 5.341) 
    15078  
    15079 Matchmaker 0.pdb, chain B (#1) with 29.0.pdb, chain B (#146), sequence
    15080 alignment score = 1692.1 
    15081 RMSD between 194 pruned atom pairs is 0.891 angstroms; (across all 330 pairs:
    15082 5.060) 
    15083  
    15084 Matchmaker 0.pdb, chain B (#1) with 29.2.pdb, chain B (#147), sequence
    15085 alignment score = 1676.5 
    15086 RMSD between 203 pruned atom pairs is 0.941 angstroms; (across all 330 pairs:
    15087 5.190) 
    15088  
    15089 Matchmaker 0.pdb, chain B (#1) with 29.4.pdb, chain B (#148), sequence
    15090 alignment score = 1683.7 
    15091 RMSD between 199 pruned atom pairs is 0.978 angstroms; (across all 330 pairs:
    15092 4.148) 
    15093  
    15094 Matchmaker 0.pdb, chain B (#1) with 29.6.pdb, chain B (#149), sequence
    15095 alignment score = 1685.5 
    15096 RMSD between 192 pruned atom pairs is 0.888 angstroms; (across all 330 pairs:
    15097 3.840) 
    15098  
    15099 Matchmaker 0.pdb, chain B (#1) with 29.8.pdb, chain B (#150), sequence
    15100 alignment score = 1692.7 
    15101 RMSD between 182 pruned atom pairs is 0.875 angstroms; (across all 330 pairs:
    15102 5.110) 
    15103  
    15104 Matchmaker 0.pdb, chain B (#1) with 30.0.pdb, chain B (#151), sequence
    15105 alignment score = 1674.7 
    15106 RMSD between 178 pruned atom pairs is 0.752 angstroms; (across all 330 pairs:
    15107 5.922) 
    15108  
    15109 Matchmaker 0.pdb, chain B (#1) with 30.2.pdb, chain B (#152), sequence
    15110 alignment score = 1692.1 
    15111 RMSD between 182 pruned atom pairs is 0.842 angstroms; (across all 330 pairs:
    15112 5.920) 
    15113  
    15114 Matchmaker 0.pdb, chain B (#1) with 30.4.pdb, chain B (#153), sequence
    15115 alignment score = 1679.5 
    15116 RMSD between 208 pruned atom pairs is 0.882 angstroms; (across all 330 pairs:
    15117 4.671) 
    15118  
    15119 Matchmaker 0.pdb, chain B (#1) with 30.6.pdb, chain B (#154), sequence
    15120 alignment score = 1688.5 
    15121 RMSD between 206 pruned atom pairs is 0.857 angstroms; (across all 330 pairs:
    15122 5.292) 
    15123  
    15124 Matchmaker 0.pdb, chain B (#1) with 30.8.pdb, chain B (#155), sequence
    15125 alignment score = 1681.9 
    15126 RMSD between 195 pruned atom pairs is 0.884 angstroms; (across all 330 pairs:
    15127 5.445) 
    15128  
    15129 Matchmaker 0.pdb, chain B (#1) with 31.0.pdb, chain B (#156), sequence
    15130 alignment score = 1674.7 
    15131 RMSD between 198 pruned atom pairs is 0.849 angstroms; (across all 330 pairs:
    15132 5.729) 
    15133  
    15134 Matchmaker 0.pdb, chain B (#1) with 31.2.pdb, chain B (#157), sequence
    15135 alignment score = 1685.5 
    15136 RMSD between 192 pruned atom pairs is 0.828 angstroms; (across all 330 pairs:
    15137 5.658) 
    15138  
    15139 Matchmaker 0.pdb, chain B (#1) with 31.4.pdb, chain B (#158), sequence
    15140 alignment score = 1674.7 
    15141 RMSD between 198 pruned atom pairs is 0.950 angstroms; (across all 330 pairs:
    15142 5.524) 
    15143  
    15144 Matchmaker 0.pdb, chain B (#1) with 31.6.pdb, chain B (#159), sequence
    15145 alignment score = 1676.5 
    15146 RMSD between 208 pruned atom pairs is 0.871 angstroms; (across all 330 pairs:
    15147 6.566) 
    15148  
    15149 Matchmaker 0.pdb, chain B (#1) with 31.8.pdb, chain B (#160), sequence
    15150 alignment score = 1675.3 
    15151 RMSD between 209 pruned atom pairs is 0.939 angstroms; (across all 330 pairs:
    15152 6.261) 
    15153  
    15154 Matchmaker 0.pdb, chain B (#1) with 32.0.pdb, chain A (#161), sequence
    15155 alignment score = 1667.5 
    15156 RMSD between 217 pruned atom pairs is 1.104 angstroms; (across all 330 pairs:
    15157 3.340) 
    15158  
    15159 Matchmaker 0.pdb, chain B (#1) with 32.2.pdb, chain B (#162), sequence
    15160 alignment score = 1678.9 
    15161 RMSD between 196 pruned atom pairs is 0.870 angstroms; (across all 330 pairs:
    15162 7.071) 
    15163  
    15164 Matchmaker 0.pdb, chain A (#1) with 32.4.pdb, chain B (#163), sequence
    15165 alignment score = 1672.3 
    15166 RMSD between 197 pruned atom pairs is 1.001 angstroms; (across all 330 pairs:
    15167 5.431) 
    15168  
    15169 Matchmaker 0.pdb, chain B (#1) with 32.6.pdb, chain B (#164), sequence
    15170 alignment score = 1675.9 
    15171 RMSD between 194 pruned atom pairs is 0.882 angstroms; (across all 330 pairs:
    15172 6.194) 
    15173  
    15174 Matchmaker 0.pdb, chain B (#1) with 32.8.pdb, chain B (#165), sequence
    15175 alignment score = 1686.1 
    15176 RMSD between 206 pruned atom pairs is 0.891 angstroms; (across all 330 pairs:
    15177 5.928) 
    15178  
    15179 Matchmaker 0.pdb, chain B (#1) with 33.0.pdb, chain B (#166), sequence
    15180 alignment score = 1690.3 
    15181 RMSD between 210 pruned atom pairs is 0.940 angstroms; (across all 330 pairs:
    15182 5.641) 
    15183  
    15184 Matchmaker 0.pdb, chain B (#1) with 33.2.pdb, chain B (#167), sequence
    15185 alignment score = 1696.3 
    15186 RMSD between 200 pruned atom pairs is 0.830 angstroms; (across all 330 pairs:
    15187 5.268) 
    15188  
    15189 Matchmaker 0.pdb, chain B (#1) with 33.4.pdb, chain B (#168), sequence
    15190 alignment score = 1685.5 
    15191 RMSD between 176 pruned atom pairs is 0.841 angstroms; (across all 330 pairs:
    15192 5.333) 
    15193  
    15194 Matchmaker 0.pdb, chain B (#1) with 33.6.pdb, chain B (#169), sequence
    15195 alignment score = 1685.5 
    15196 RMSD between 207 pruned atom pairs is 0.890 angstroms; (across all 330 pairs:
    15197 3.585) 
    15198  
    15199 Matchmaker 0.pdb, chain B (#1) with 33.8.pdb, chain B (#170), sequence
    15200 alignment score = 1677.1 
    15201 RMSD between 209 pruned atom pairs is 0.954 angstroms; (across all 330 pairs:
    15202 3.845) 
    15203  
    15204 Matchmaker 0.pdb, chain B (#1) with 34.0.pdb, chain B (#171), sequence
    15205 alignment score = 1692.1 
    15206 RMSD between 232 pruned atom pairs is 0.987 angstroms; (across all 330 pairs:
    15207 3.700) 
    15208  
    15209 Matchmaker 0.pdb, chain B (#1) with 34.2.pdb, chain B (#172), sequence
    15210 alignment score = 1680.7 
    15211 RMSD between 219 pruned atom pairs is 1.072 angstroms; (across all 330 pairs:
    15212 2.757) 
    15213  
    15214 Matchmaker 0.pdb, chain B (#1) with 34.4.pdb, chain B (#173), sequence
    15215 alignment score = 1692.7 
    15216 RMSD between 204 pruned atom pairs is 1.013 angstroms; (across all 330 pairs:
    15217 2.943) 
    15218  
    15219 Matchmaker 0.pdb, chain B (#1) with 34.6.pdb, chain B (#174), sequence
    15220 alignment score = 1677.1 
    15221 RMSD between 230 pruned atom pairs is 1.072 angstroms; (across all 330 pairs:
    15222 2.452) 
    15223  
    15224 Matchmaker 0.pdb, chain B (#1) with 34.8.pdb, chain B (#175), sequence
    15225 alignment score = 1684.3 
    15226 RMSD between 225 pruned atom pairs is 1.025 angstroms; (across all 330 pairs:
    15227 2.301) 
    15228  
    15229 Matchmaker 0.pdb, chain B (#1) with 35.0.pdb, chain B (#176), sequence
    15230 alignment score = 1689.1 
    15231 RMSD between 208 pruned atom pairs is 0.971 angstroms; (across all 330 pairs:
    15232 3.052) 
    15233  
    15234 Matchmaker 0.pdb, chain B (#1) with 35.2.pdb, chain B (#177), sequence
    15235 alignment score = 1681.3 
    15236 RMSD between 217 pruned atom pairs is 0.994 angstroms; (across all 330 pairs:
    15237 2.722) 
    15238  
    15239 Matchmaker 0.pdb, chain B (#1) with 35.4.pdb, chain B (#178), sequence
    15240 alignment score = 1686.1 
    15241 RMSD between 211 pruned atom pairs is 1.033 angstroms; (across all 330 pairs:
    15242 2.560) 
    15243  
    15244 Matchmaker 0.pdb, chain A (#1) with 35.6.pdb, chain B (#179), sequence
    15245 alignment score = 1681.3 
    15246 RMSD between 251 pruned atom pairs is 1.167 angstroms; (across all 330 pairs:
    15247 2.476) 
    15248  
    15249 Matchmaker 0.pdb, chain B (#1) with 35.8.pdb, chain B (#180), sequence
    15250 alignment score = 1689.1 
    15251 RMSD between 233 pruned atom pairs is 1.088 angstroms; (across all 330 pairs:
    15252 3.225) 
    15253  
    15254 Matchmaker 0.pdb, chain B (#1) with 36.0.pdb, chain B (#181), sequence
    15255 alignment score = 1686.1 
    15256 RMSD between 207 pruned atom pairs is 1.024 angstroms; (across all 330 pairs:
    15257 2.918) 
    15258  
    15259 Matchmaker 0.pdb, chain B (#1) with 36.2.pdb, chain B (#182), sequence
    15260 alignment score = 1687.3 
    15261 RMSD between 222 pruned atom pairs is 1.034 angstroms; (across all 330 pairs:
    15262 3.096) 
    15263  
    15264 Matchmaker 0.pdb, chain B (#1) with 36.4.pdb, chain B (#183), sequence
    15265 alignment score = 1683.1 
    15266 RMSD between 228 pruned atom pairs is 1.106 angstroms; (across all 330 pairs:
    15267 1.967) 
    15268  
    15269 Matchmaker 0.pdb, chain B (#1) with 36.6.pdb, chain B (#184), sequence
    15270 alignment score = 1684.9 
    15271 RMSD between 238 pruned atom pairs is 0.927 angstroms; (across all 330 pairs:
    15272 2.779) 
    15273  
    15274 Matchmaker 0.pdb, chain A (#1) with 36.8.pdb, chain B (#185), sequence
    15275 alignment score = 1665.1 
    15276 RMSD between 249 pruned atom pairs is 1.015 angstroms; (across all 330 pairs:
    15277 1.899) 
    15278  
    15279 Matchmaker 0.pdb, chain B (#1) with 37.0.pdb, chain B (#186), sequence
    15280 alignment score = 1677.7 
    15281 RMSD between 220 pruned atom pairs is 1.105 angstroms; (across all 330 pairs:
    15282 2.557) 
    15283  
    15284 Matchmaker 0.pdb, chain B (#1) with 37.2.pdb, chain B (#187), sequence
    15285 alignment score = 1669.9 
    15286 RMSD between 236 pruned atom pairs is 1.062 angstroms; (across all 330 pairs:
    15287 2.318) 
    15288  
    15289 Matchmaker 0.pdb, chain B (#1) with 37.4.pdb, chain B (#188), sequence
    15290 alignment score = 1681.9 
    15291 RMSD between 209 pruned atom pairs is 1.144 angstroms; (across all 330 pairs:
    15292 2.431) 
    15293  
    15294 Matchmaker 0.pdb, chain B (#1) with 37.6.pdb, chain B (#189), sequence
    15295 alignment score = 1674.7 
    15296 RMSD between 200 pruned atom pairs is 0.881 angstroms; (across all 330 pairs:
    15297 4.033) 
    15298  
    15299 Matchmaker 0.pdb, chain B (#1) with 37.8.pdb, chain B (#190), sequence
    15300 alignment score = 1669.3 
    15301 RMSD between 206 pruned atom pairs is 0.968 angstroms; (across all 330 pairs:
    15302 3.961) 
    15303  
    15304 Matchmaker 0.pdb, chain B (#1) with 38.0.pdb, chain B (#191), sequence
    15305 alignment score = 1672.3 
    15306 RMSD between 185 pruned atom pairs is 0.792 angstroms; (across all 330 pairs:
    15307 3.396) 
    15308  
    15309 Matchmaker 0.pdb, chain B (#1) with 38.2.pdb, chain B (#192), sequence
    15310 alignment score = 1682.5 
    15311 RMSD between 190 pruned atom pairs is 0.855 angstroms; (across all 330 pairs:
    15312 3.445) 
    15313  
    15314 Matchmaker 0.pdb, chain B (#1) with 38.4.pdb, chain B (#193), sequence
    15315 alignment score = 1676.5 
    15316 RMSD between 232 pruned atom pairs is 1.041 angstroms; (across all 330 pairs:
    15317 2.433) 
    15318  
    15319 Matchmaker 0.pdb, chain B (#1) with 38.6.pdb, chain B (#194), sequence
    15320 alignment score = 1682.5 
    15321 RMSD between 200 pruned atom pairs is 1.016 angstroms; (across all 330 pairs:
    15322 3.043) 
    15323  
    15324 Matchmaker 0.pdb, chain A (#1) with 38.8.pdb, chain B (#195), sequence
    15325 alignment score = 1679.5 
    15326 RMSD between 186 pruned atom pairs is 0.900 angstroms; (across all 330 pairs:
    15327 4.064) 
    15328  
    15329 Matchmaker 0.pdb, chain B (#1) with 39.0.pdb, chain A (#196), sequence
    15330 alignment score = 1663.9 
    15331 RMSD between 216 pruned atom pairs is 0.963 angstroms; (across all 330 pairs:
    15332 5.257) 
    15333  
    15334 Matchmaker 0.pdb, chain B (#1) with 39.2.pdb, chain A (#197), sequence
    15335 alignment score = 1674.1 
    15336 RMSD between 213 pruned atom pairs is 0.976 angstroms; (across all 330 pairs:
    15337 6.183) 
    15338  
    15339 Matchmaker 0.pdb, chain B (#1) with 39.4.pdb, chain B (#198), sequence
    15340 alignment score = 1679.5 
    15341 RMSD between 226 pruned atom pairs is 0.888 angstroms; (across all 330 pairs:
    15342 3.586) 
    15343  
    15344 Matchmaker 0.pdb, chain B (#1) with 39.6.pdb, chain B (#199), sequence
    15345 alignment score = 1677.1 
    15346 RMSD between 230 pruned atom pairs is 1.100 angstroms; (across all 330 pairs:
    15347 3.192) 
    15348  
    15349 Matchmaker 0.pdb, chain B (#1) with 39.8.pdb, chain B (#200), sequence
    15350 alignment score = 1679.5 
    15351 RMSD between 188 pruned atom pairs is 0.887 angstroms; (across all 330 pairs:
    15352 4.801) 
    15353  
    15354 Matchmaker 0.pdb, chain B (#1) with 40.0.pdb, chain B (#201), sequence
    15355 alignment score = 1675.9 
    15356 RMSD between 204 pruned atom pairs is 1.017 angstroms; (across all 330 pairs:
    15357 3.932) 
    15358  
    15359 Matchmaker 0.pdb, chain B (#1) with 40.2.pdb, chain B (#202), sequence
    15360 alignment score = 1683.7 
    15361 RMSD between 191 pruned atom pairs is 0.896 angstroms; (across all 330 pairs:
    15362 5.170) 
    15363  
    15364 Matchmaker 0.pdb, chain B (#1) with 40.4.pdb, chain B (#203), sequence
    15365 alignment score = 1689.1 
    15366 RMSD between 177 pruned atom pairs is 0.985 angstroms; (across all 330 pairs:
    15367 5.515) 
    15368  
    15369 Matchmaker 0.pdb, chain B (#1) with 40.6.pdb, chain B (#204), sequence
    15370 alignment score = 1672.9 
    15371 RMSD between 178 pruned atom pairs is 0.883 angstroms; (across all 330 pairs:
    15372 5.646) 
    15373  
    15374 Matchmaker 0.pdb, chain B (#1) with 40.8.pdb, chain B (#205), sequence
    15375 alignment score = 1679.5 
    15376 RMSD between 196 pruned atom pairs is 0.975 angstroms; (across all 330 pairs:
    15377 5.001) 
    15378  
    15379 Matchmaker 0.pdb, chain B (#1) with 41.0.pdb, chain A (#206), sequence
    15380 alignment score = 1678.9 
    15381 RMSD between 211 pruned atom pairs is 1.091 angstroms; (across all 330 pairs:
    15382 3.593) 
    15383  
    15384 Matchmaker 0.pdb, chain B (#1) with 41.2.pdb, chain B (#207), sequence
    15385 alignment score = 1681.9 
    15386 RMSD between 193 pruned atom pairs is 0.943 angstroms; (across all 330 pairs:
    15387 4.514) 
    15388  
    15389 Matchmaker 0.pdb, chain B (#1) with 41.4.pdb, chain B (#208), sequence
    15390 alignment score = 1672.9 
    15391 RMSD between 205 pruned atom pairs is 1.041 angstroms; (across all 330 pairs:
    15392 4.643) 
    15393  
    15394 Matchmaker 0.pdb, chain B (#1) with 41.6.pdb, chain B (#209), sequence
    15395 alignment score = 1677.1 
    15396 RMSD between 190 pruned atom pairs is 0.930 angstroms; (across all 330 pairs:
    15397 4.576) 
    15398  
    15399 Matchmaker 0.pdb, chain B (#1) with 41.8.pdb, chain A (#210), sequence
    15400 alignment score = 1678.3 
    15401 RMSD between 205 pruned atom pairs is 1.053 angstroms; (across all 330 pairs:
    15402 5.146) 
    15403  
    15404 Matchmaker 0.pdb, chain B (#1) with 42.0.pdb, chain B (#211), sequence
    15405 alignment score = 1680.1 
    15406 RMSD between 195 pruned atom pairs is 0.983 angstroms; (across all 330 pairs:
    15407 5.322) 
    15408  
    15409 Matchmaker 0.pdb, chain B (#1) with 42.2.pdb, chain A (#212), sequence
    15410 alignment score = 1678.9 
    15411 RMSD between 210 pruned atom pairs is 0.961 angstroms; (across all 330 pairs:
    15412 4.573) 
    15413  
    15414 Matchmaker 0.pdb, chain B (#1) with 42.4.pdb, chain A (#213), sequence
    15415 alignment score = 1681.3 
    15416 RMSD between 203 pruned atom pairs is 1.046 angstroms; (across all 330 pairs:
    15417 4.634) 
    15418  
    15419 Matchmaker 0.pdb, chain B (#1) with 42.6.pdb, chain A (#214), sequence
    15420 alignment score = 1681.3 
    15421 RMSD between 197 pruned atom pairs is 0.943 angstroms; (across all 330 pairs:
    15422 3.113) 
    15423  
    15424 Matchmaker 0.pdb, chain B (#1) with 42.8.pdb, chain A (#215), sequence
    15425 alignment score = 1671.7 
    15426 RMSD between 209 pruned atom pairs is 1.057 angstroms; (across all 330 pairs:
    15427 3.743) 
    15428  
    15429 Matchmaker 0.pdb, chain A (#1) with 43.0.pdb, chain A (#216), sequence
    15430 alignment score = 1673.5 
    15431 RMSD between 198 pruned atom pairs is 1.028 angstroms; (across all 330 pairs:
    15432 4.065) 
    15433  
    15434 Matchmaker 0.pdb, chain B (#1) with 43.2.pdb, chain A (#217), sequence
    15435 alignment score = 1667.5 
    15436 RMSD between 193 pruned atom pairs is 0.999 angstroms; (across all 330 pairs:
    15437 4.014) 
    15438  
    15439 Matchmaker 0.pdb, chain B (#1) with 43.4.pdb, chain A (#218), sequence
    15440 alignment score = 1678.3 
    15441 RMSD between 193 pruned atom pairs is 0.972 angstroms; (across all 330 pairs:
    15442 3.929) 
    15443  
    15444 Matchmaker 0.pdb, chain B (#1) with 43.6.pdb, chain B (#219), sequence
    15445 alignment score = 1681.3 
    15446 RMSD between 180 pruned atom pairs is 0.975 angstroms; (across all 330 pairs:
    15447 5.596) 
    15448  
    15449 Matchmaker 0.pdb, chain B (#1) with 43.8.pdb, chain A (#220), sequence
    15450 alignment score = 1678.3 
    15451 RMSD between 217 pruned atom pairs is 1.068 angstroms; (across all 330 pairs:
    15452 4.025) 
    15453  
    15454 Matchmaker 0.pdb, chain B (#1) with 44.0.pdb, chain B (#221), sequence
    15455 alignment score = 1681.9 
    15456 RMSD between 182 pruned atom pairs is 0.888 angstroms; (across all 330 pairs:
    15457 5.145) 
    15458  
    15459 Matchmaker 0.pdb, chain B (#1) with 44.2.pdb, chain B (#222), sequence
    15460 alignment score = 1682.5 
    15461 RMSD between 195 pruned atom pairs is 0.915 angstroms; (across all 330 pairs:
    15462 4.847) 
    15463  
    15464 Matchmaker 0.pdb, chain B (#1) with 44.4.pdb, chain A (#223), sequence
    15465 alignment score = 1674.7 
    15466 RMSD between 211 pruned atom pairs is 1.021 angstroms; (across all 330 pairs:
    15467 3.657) 
    15468  
    15469 Matchmaker 0.pdb, chain B (#1) with 44.6.pdb, chain B (#224), sequence
    15470 alignment score = 1672.3 
    15471 RMSD between 217 pruned atom pairs is 0.980 angstroms; (across all 330 pairs:
    15472 4.458) 
    15473  
    15474 Matchmaker 0.pdb, chain B (#1) with 44.8.pdb, chain B (#225), sequence
    15475 alignment score = 1678.3 
    15476 RMSD between 192 pruned atom pairs is 0.882 angstroms; (across all 330 pairs:
    15477 4.501) 
    15478  
    15479 Matchmaker 0.pdb, chain B (#1) with 45.0.pdb, chain A (#226), sequence
    15480 alignment score = 1677.7 
    15481 RMSD between 199 pruned atom pairs is 1.098 angstroms; (across all 330 pairs:
    15482 3.680) 
    15483  
    15484 Matchmaker 0.pdb, chain B (#1) with 45.2.pdb, chain A (#227), sequence
    15485 alignment score = 1677.7 
    15486 RMSD between 212 pruned atom pairs is 1.074 angstroms; (across all 330 pairs:
    15487 3.978) 
    15488  
    15489 Matchmaker 0.pdb, chain B (#1) with 45.4.pdb, chain A (#228), sequence
    15490 alignment score = 1667.5 
    15491 RMSD between 205 pruned atom pairs is 0.932 angstroms; (across all 330 pairs:
    15492 3.995) 
    15493  
    15494 Matchmaker 0.pdb, chain A (#1) with 45.6.pdb, chain A (#229), sequence
    15495 alignment score = 1674.7 
    15496 RMSD between 215 pruned atom pairs is 1.024 angstroms; (across all 330 pairs:
    15497 3.860) 
    15498  
    15499 Matchmaker 0.pdb, chain B (#1) with 45.8.pdb, chain B (#230), sequence
    15500 alignment score = 1681.9 
    15501 RMSD between 207 pruned atom pairs is 0.957 angstroms; (across all 330 pairs:
    15502 4.538) 
    15503  
    15504 Matchmaker 0.pdb, chain B (#1) with 46.0.pdb, chain A (#231), sequence
    15505 alignment score = 1672.3 
    15506 RMSD between 225 pruned atom pairs is 0.958 angstroms; (across all 330 pairs:
    15507 4.528) 
    15508  
    15509 Matchmaker 0.pdb, chain B (#1) with 46.2.pdb, chain A (#232), sequence
    15510 alignment score = 1674.7 
    15511 RMSD between 220 pruned atom pairs is 0.981 angstroms; (across all 330 pairs:
    15512 5.090) 
    15513  
    15514 Matchmaker 0.pdb, chain B (#1) with 46.4.pdb, chain A (#233), sequence
    15515 alignment score = 1668.7 
    15516 RMSD between 231 pruned atom pairs is 0.982 angstroms; (across all 330 pairs:
    15517 3.669) 
    15518  
    15519 Matchmaker 0.pdb, chain B (#1) with 46.6.pdb, chain A (#234), sequence
    15520 alignment score = 1678.3 
    15521 RMSD between 226 pruned atom pairs is 0.900 angstroms; (across all 330 pairs:
    15522 4.478) 
    15523  
    15524 Matchmaker 0.pdb, chain B (#1) with 46.8.pdb, chain B (#235), sequence
    15525 alignment score = 1666.9 
    15526 RMSD between 185 pruned atom pairs is 0.964 angstroms; (across all 330 pairs:
    15527 4.207) 
    15528  
    15529 Matchmaker 0.pdb, chain B (#1) with 47.0.pdb, chain A (#236), sequence
    15530 alignment score = 1674.7 
    15531 RMSD between 221 pruned atom pairs is 0.954 angstroms; (across all 330 pairs:
    15532 5.771) 
    15533  
    15534 Matchmaker 0.pdb, chain B (#1) with 47.2.pdb, chain A (#237), sequence
    15535 alignment score = 1681.9 
    15536 RMSD between 213 pruned atom pairs is 1.037 angstroms; (across all 330 pairs:
    15537 6.609) 
    15538  
    15539 Matchmaker 0.pdb, chain B (#1) with 47.4.pdb, chain A (#238), sequence
    15540 alignment score = 1681.9 
    15541 RMSD between 209 pruned atom pairs is 0.969 angstroms; (across all 330 pairs:
    15542 6.379) 
    15543  
    15544 Matchmaker 0.pdb, chain A (#1) with 47.6.pdb, chain A (#239), sequence
    15545 alignment score = 1678.3 
    15546 RMSD between 216 pruned atom pairs is 0.931 angstroms; (across all 330 pairs:
    15547 5.722) 
    15548  
    15549 Matchmaker 0.pdb, chain B (#1) with 47.8.pdb, chain B (#240), sequence
    15550 alignment score = 1681.9 
    15551 RMSD between 212 pruned atom pairs is 0.946 angstroms; (across all 330 pairs:
    15552 3.318) 
    15553  
    15554 Matchmaker 0.pdb, chain B (#1) with 48.0.pdb, chain A (#241), sequence
    15555 alignment score = 1668.7 
    15556 RMSD between 200 pruned atom pairs is 0.935 angstroms; (across all 330 pairs:
    15557 6.116) 
    15558  
    15559 Matchmaker 0.pdb, chain A (#1) with 48.2.pdb, chain A (#242), sequence
    15560 alignment score = 1672.3 
    15561 RMSD between 223 pruned atom pairs is 0.894 angstroms; (across all 330 pairs:
    15562 4.917) 
    15563  
    15564 Matchmaker 0.pdb, chain B (#1) with 48.4.pdb, chain A (#243), sequence
    15565 alignment score = 1664.5 
    15566 RMSD between 213 pruned atom pairs is 0.902 angstroms; (across all 330 pairs:
    15567 4.829) 
    15568  
    15569 Matchmaker 0.pdb, chain B (#1) with 48.6.pdb, chain A (#244), sequence
    15570 alignment score = 1678.9 
    15571 RMSD between 227 pruned atom pairs is 0.936 angstroms; (across all 330 pairs:
    15572 5.652) 
    15573  
    15574 Matchmaker 0.pdb, chain B (#1) with 48.8.pdb, chain A (#245), sequence
    15575 alignment score = 1678.9 
    15576 RMSD between 214 pruned atom pairs is 0.943 angstroms; (across all 330 pairs:
    15577 5.760) 
    15578  
    15579 Matchmaker 0.pdb, chain B (#1) with 49.0.pdb, chain A (#246), sequence
    15580 alignment score = 1671.7 
    15581 RMSD between 225 pruned atom pairs is 0.985 angstroms; (across all 330 pairs:
    15582 5.517) 
    15583  
    15584 Matchmaker 0.pdb, chain B (#1) with 49.2.pdb, chain A (#247), sequence
    15585 alignment score = 1671.7 
    15586 RMSD between 219 pruned atom pairs is 0.902 angstroms; (across all 330 pairs:
    15587 5.283) 
    15588  
    15589 Matchmaker 0.pdb, chain B (#1) with 49.4.pdb, chain A (#248), sequence
    15590 alignment score = 1681.3 
    15591 RMSD between 229 pruned atom pairs is 0.986 angstroms; (across all 330 pairs:
    15592 5.292) 
    15593  
    15594 Matchmaker 0.pdb, chain B (#1) with 49.6.pdb, chain B (#249), sequence
    15595 alignment score = 1669.9 
    15596 RMSD between 197 pruned atom pairs is 0.938 angstroms; (across all 330 pairs:
    15597 2.804) 
    15598  
    15599 Matchmaker 0.pdb, chain B (#1) with 49.8.pdb, chain A (#250), sequence
    15600 alignment score = 1678.3 
    15601 RMSD between 225 pruned atom pairs is 1.011 angstroms; (across all 330 pairs:
    15602 4.316) 
    15603  
    15604 Matchmaker 0.pdb, chain A (#1) with 50.0.pdb, chain A (#251), sequence
    15605 alignment score = 1674.7 
    15606 RMSD between 213 pruned atom pairs is 1.033 angstroms; (across all 330 pairs:
    15607 4.759) 
    15608  
    15609 Matchmaker 0.pdb, chain B (#1) with 50.2.pdb, chain A (#252), sequence
    15610 alignment score = 1674.7 
    15611 RMSD between 212 pruned atom pairs is 0.885 angstroms; (across all 330 pairs:
    15612 3.549) 
    15613  
    15614 Matchmaker 0.pdb, chain B (#1) with 50.4.pdb, chain A (#253), sequence
    15615 alignment score = 1674.7 
    15616 RMSD between 221 pruned atom pairs is 0.982 angstroms; (across all 330 pairs:
    15617 3.735) 
    15618  
    15619 Matchmaker 0.pdb, chain B (#1) with 50.6.pdb, chain A (#254), sequence
    15620 alignment score = 1681.3 
    15621 RMSD between 214 pruned atom pairs is 0.987 angstroms; (across all 330 pairs:
    15622 3.683) 
    15623  
    15624 Matchmaker 0.pdb, chain B (#1) with 50.8.pdb, chain B (#255), sequence
    15625 alignment score = 1674.7 
    15626 RMSD between 200 pruned atom pairs is 0.940 angstroms; (across all 330 pairs:
    15627 2.571) 
    15628  
    15629 Matchmaker 0.pdb, chain B (#1) with 51.0.pdb, chain A (#256), sequence
    15630 alignment score = 1681.9 
    15631 RMSD between 217 pruned atom pairs is 0.932 angstroms; (across all 330 pairs:
    15632 4.768) 
    15633  
    15634 Matchmaker 0.pdb, chain B (#1) with 51.2.pdb, chain B (#257), sequence
    15635 alignment score = 1672.3 
    15636 RMSD between 221 pruned atom pairs is 0.980 angstroms; (across all 330 pairs:
    15637 2.773) 
    15638  
    15639 Matchmaker 0.pdb, chain B (#1) with 51.4.pdb, chain A (#258), sequence
    15640 alignment score = 1674.7 
    15641 RMSD between 212 pruned atom pairs is 1.024 angstroms; (across all 330 pairs:
    15642 6.453) 
    15643  
    15644 Matchmaker 0.pdb, chain B (#1) with 51.6.pdb, chain B (#259), sequence
    15645 alignment score = 1678.3 
    15646 RMSD between 238 pruned atom pairs is 1.088 angstroms; (across all 330 pairs:
    15647 2.665) 
    15648  
    15649 Matchmaker 0.pdb, chain B (#1) with 51.8.pdb, chain B (#260), sequence
    15650 alignment score = 1671.1 
    15651 RMSD between 212 pruned atom pairs is 0.964 angstroms; (across all 330 pairs:
    15652 3.615) 
    15653  
    15654 Matchmaker 0.pdb, chain B (#1) with 52.0.pdb, chain A (#261), sequence
    15655 alignment score = 1668.1 
    15656 RMSD between 206 pruned atom pairs is 0.931 angstroms; (across all 330 pairs:
    15657 6.204) 
    15658  
    15659 Matchmaker 0.pdb, chain B (#1) with 52.2.pdb, chain A (#262), sequence
    15660 alignment score = 1681.9 
    15661 RMSD between 217 pruned atom pairs is 0.988 angstroms; (across all 330 pairs:
    15662 5.713) 
    15663  
    15664 Matchmaker 0.pdb, chain B (#1) with 52.4.pdb, chain A (#263), sequence
    15665 alignment score = 1681.9 
    15666 RMSD between 215 pruned atom pairs is 0.983 angstroms; (across all 330 pairs:
    15667 5.303) 
    15668  
    15669 Matchmaker 0.pdb, chain B (#1) with 52.6.pdb, chain A (#264), sequence
    15670 alignment score = 1681.9 
    15671 RMSD between 214 pruned atom pairs is 1.007 angstroms; (across all 330 pairs:
    15672 5.115) 
    15673  
    15674 Matchmaker 0.pdb, chain B (#1) with 52.8.pdb, chain A (#265), sequence
    15675 alignment score = 1675.9 
    15676 RMSD between 207 pruned atom pairs is 0.922 angstroms; (across all 330 pairs:
    15677 5.408) 
    15678  
    15679 Matchmaker 0.pdb, chain B (#1) with 53.0.pdb, chain B (#266), sequence
    15680 alignment score = 1671.7 
    15681 RMSD between 224 pruned atom pairs is 0.985 angstroms; (across all 330 pairs:
    15682 3.440) 
    15683  
    15684 Matchmaker 0.pdb, chain B (#1) with 53.2.pdb, chain A (#267), sequence
    15685 alignment score = 1675.3 
    15686 RMSD between 210 pruned atom pairs is 0.932 angstroms; (across all 330 pairs:
    15687 5.277) 
    15688  
    15689 Matchmaker 0.pdb, chain B (#1) with 53.4.pdb, chain B (#268), sequence
    15690 alignment score = 1671.7 
    15691 RMSD between 200 pruned atom pairs is 0.969 angstroms; (across all 330 pairs:
    15692 3.828) 
    15693  
    15694 Matchmaker 0.pdb, chain B (#1) with 53.6.pdb, chain B (#269), sequence
    15695 alignment score = 1674.7 
    15696 RMSD between 218 pruned atom pairs is 1.010 angstroms; (across all 330 pairs:
    15697 3.615) 
    15698  
    15699 Matchmaker 0.pdb, chain B (#1) with 53.8.pdb, chain B (#270), sequence
    15700 alignment score = 1675.9 
    15701 RMSD between 224 pruned atom pairs is 0.969 angstroms; (across all 330 pairs:
    15702 3.458) 
    15703  
    15704 Matchmaker 0.pdb, chain B (#1) with 54.0.pdb, chain B (#271), sequence
    15705 alignment score = 1671.7 
    15706 RMSD between 250 pruned atom pairs is 1.004 angstroms; (across all 330 pairs:
    15707 2.374) 
    15708  
    15709 Matchmaker 0.pdb, chain B (#1) with 54.2.pdb, chain A (#272), sequence
    15710 alignment score = 1675.3 
    15711 RMSD between 194 pruned atom pairs is 0.966 angstroms; (across all 330 pairs:
    15712 5.044) 
    15713  
    15714 Matchmaker 0.pdb, chain B (#1) with 54.4.pdb, chain A (#273), sequence
    15715 alignment score = 1684.9 
    15716 RMSD between 188 pruned atom pairs is 0.895 angstroms; (across all 330 pairs:
    15717 5.220) 
    15718  
    15719 Matchmaker 0.pdb, chain A (#1) with 54.6.pdb, chain A (#274), sequence
    15720 alignment score = 1671.1 
    15721 RMSD between 221 pruned atom pairs is 0.938 angstroms; (across all 330 pairs:
    15722 5.558) 
    15723  
    15724 Matchmaker 0.pdb, chain B (#1) with 54.8.pdb, chain B (#275), sequence
    15725 alignment score = 1662.7 
    15726 RMSD between 219 pruned atom pairs is 0.960 angstroms; (across all 330 pairs:
    15727 4.991) 
    15728  
    15729 Matchmaker 0.pdb, chain B (#1) with 55.0.pdb, chain A (#276), sequence
    15730 alignment score = 1664.5 
    15731 RMSD between 201 pruned atom pairs is 0.896 angstroms; (across all 330 pairs:
    15732 5.199) 
    15733  
    15734 Matchmaker 0.pdb, chain B (#1) with 55.2.pdb, chain A (#277), sequence
    15735 alignment score = 1663.9 
    15736 RMSD between 209 pruned atom pairs is 0.901 angstroms; (across all 330 pairs:
    15737 5.156) 
    15738  
    15739 Matchmaker 0.pdb, chain B (#1) with 55.4.pdb, chain B (#278), sequence
    15740 alignment score = 1669.3 
    15741 RMSD between 215 pruned atom pairs is 0.934 angstroms; (across all 330 pairs:
    15742 6.435) 
    15743  
    15744 Matchmaker 0.pdb, chain B (#1) with 55.6.pdb, chain A (#279), sequence
    15745 alignment score = 1656.7 
    15746 RMSD between 205 pruned atom pairs is 0.964 angstroms; (across all 330 pairs:
    15747 5.403) 
    15748  
    15749 Matchmaker 0.pdb, chain B (#1) with 55.8.pdb, chain B (#280), sequence
    15750 alignment score = 1662.7 
    15751 RMSD between 241 pruned atom pairs is 1.051 angstroms; (across all 330 pairs:
    15752 4.890) 
    15753  
    15754 Matchmaker 0.pdb, chain B (#1) with 56.0.pdb, chain A (#281), sequence
    15755 alignment score = 1666.9 
    15756 RMSD between 197 pruned atom pairs is 0.916 angstroms; (across all 330 pairs:
    15757 7.094) 
    15758  
    15759 Matchmaker 0.pdb, chain B (#1) with 56.2.pdb, chain B (#282), sequence
    15760 alignment score = 1674.1 
    15761 RMSD between 236 pruned atom pairs is 0.926 angstroms; (across all 330 pairs:
    15762 3.895) 
    15763  
    15764 Matchmaker 0.pdb, chain B (#1) with 56.4.pdb, chain A (#283), sequence
    15765 alignment score = 1667.5 
    15766 RMSD between 208 pruned atom pairs is 0.947 angstroms; (across all 330 pairs:
    15767 6.071) 
    15768  
    15769 Matchmaker 0.pdb, chain B (#1) with 56.6.pdb, chain A (#284), sequence
    15770 alignment score = 1671.1 
    15771 RMSD between 201 pruned atom pairs is 0.968 angstroms; (across all 330 pairs:
    15772 5.787) 
    15773  
    15774 Matchmaker 0.pdb, chain B (#1) with 56.8.pdb, chain B (#285), sequence
    15775 alignment score = 1659.1 
    15776 RMSD between 229 pruned atom pairs is 0.941 angstroms; (across all 330 pairs:
    15777 4.036) 
    15778  
    15779 Matchmaker 0.pdb, chain B (#1) with 57.0.pdb, chain B (#286), sequence
    15780 alignment score = 1662.7 
    15781 RMSD between 218 pruned atom pairs is 0.897 angstroms; (across all 330 pairs:
    15782 4.147) 
    15783  
    15784 Matchmaker 0.pdb, chain B (#1) with 57.2.pdb, chain B (#287), sequence
    15785 alignment score = 1669.3 
    15786 RMSD between 212 pruned atom pairs is 0.944 angstroms; (across all 330 pairs:
    15787 4.074) 
    15788  
    15789 Matchmaker 0.pdb, chain B (#1) with 57.4.pdb, chain A (#288), sequence
    15790 alignment score = 1671.1 
    15791 RMSD between 196 pruned atom pairs is 0.961 angstroms; (across all 330 pairs:
    15792 4.847) 
    15793  
    15794 Matchmaker 0.pdb, chain B (#1) with 57.6.pdb, chain B (#289), sequence
    15795 alignment score = 1664.5 
    15796 RMSD between 209 pruned atom pairs is 0.908 angstroms; (across all 330 pairs:
    15797 3.879) 
    15798  
    15799 Matchmaker 0.pdb, chain B (#1) with 57.8.pdb, chain B (#290), sequence
    15800 alignment score = 1669.3 
    15801 RMSD between 211 pruned atom pairs is 0.903 angstroms; (across all 330 pairs:
    15802 3.943) 
    15803  
    15804 Matchmaker 0.pdb, chain B (#1) with 58.0.pdb, chain B (#291), sequence
    15805 alignment score = 1668.7 
    15806 RMSD between 223 pruned atom pairs is 0.939 angstroms; (across all 330 pairs:
    15807 4.999) 
    15808  
    15809 Matchmaker 0.pdb, chain B (#1) with 58.2.pdb, chain A (#292), sequence
    15810 alignment score = 1671.1 
    15811 RMSD between 191 pruned atom pairs is 0.889 angstroms; (across all 330 pairs:
    15812 5.602) 
    15813  
    15814 Matchmaker 0.pdb, chain A (#1) with 58.4.pdb, chain A (#293), sequence
    15815 alignment score = 1669.9 
    15816 RMSD between 192 pruned atom pairs is 0.954 angstroms; (across all 330 pairs:
    15817 4.312) 
    15818  
    15819 Matchmaker 0.pdb, chain B (#1) with 58.6.pdb, chain B (#294), sequence
    15820 alignment score = 1671.7 
    15821 RMSD between 218 pruned atom pairs is 0.953 angstroms; (across all 330 pairs:
    15822 4.698) 
    15823  
    15824 Matchmaker 0.pdb, chain B (#1) with 58.8.pdb, chain B (#295), sequence
    15825 alignment score = 1668.7 
    15826 RMSD between 200 pruned atom pairs is 0.801 angstroms; (across all 330 pairs:
    15827 4.438) 
    15828  
    15829 Matchmaker 0.pdb, chain B (#1) with 59.0.pdb, chain B (#296), sequence
    15830 alignment score = 1659.1 
    15831 RMSD between 219 pruned atom pairs is 0.955 angstroms; (across all 330 pairs:
    15832 5.545) 
    15833  
    15834 Matchmaker 0.pdb, chain B (#1) with 59.2.pdb, chain B (#297), sequence
    15835 alignment score = 1672.3 
    15836 RMSD between 218 pruned atom pairs is 0.950 angstroms; (across all 330 pairs:
    15837 4.643) 
    15838  
    15839 Matchmaker 0.pdb, chain B (#1) with 59.4.pdb, chain A (#298), sequence
    15840 alignment score = 1671.7 
    15841 RMSD between 199 pruned atom pairs is 0.984 angstroms; (across all 330 pairs:
    15842 4.488) 
    15843  
    15844 Matchmaker 0.pdb, chain B (#1) with 59.6.pdb, chain B (#299), sequence
    15845 alignment score = 1652.5 
    15846 RMSD between 205 pruned atom pairs is 0.947 angstroms; (across all 330 pairs:
    15847 4.728) 
    15848  
    15849 Matchmaker 0.pdb, chain B (#1) with 59.8.pdb, chain B (#300), sequence
    15850 alignment score = 1666.3 
    15851 RMSD between 221 pruned atom pairs is 0.950 angstroms; (across all 330 pairs:
    15852 4.820) 
    15853  
    15854 Matchmaker 0.pdb, chain B (#1) with 60.0.pdb, chain B (#301), sequence
    15855 alignment score = 1674.7 
    15856 RMSD between 215 pruned atom pairs is 0.966 angstroms; (across all 330 pairs:
    15857 4.515) 
    15858  
    15859 Matchmaker 0.pdb, chain B (#1) with 60.2.pdb, chain A (#302), sequence
    15860 alignment score = 1667.5 
    15861 RMSD between 194 pruned atom pairs is 0.983 angstroms; (across all 330 pairs:
    15862 5.103) 
    15863  
    15864 Matchmaker 0.pdb, chain B (#1) with 60.4.pdb, chain B (#303), sequence
    15865 alignment score = 1675.9 
    15866 RMSD between 187 pruned atom pairs is 0.879 angstroms; (across all 330 pairs:
    15867 5.889) 
    15868  
    15869 Matchmaker 0.pdb, chain B (#1) with 60.6.pdb, chain B (#304), sequence
    15870 alignment score = 1672.3 
    15871 RMSD between 206 pruned atom pairs is 0.892 angstroms; (across all 330 pairs:
    15872 4.141) 
    15873  
    15874 Matchmaker 0.pdb, chain B (#1) with 60.8.pdb, chain B (#305), sequence
    15875 alignment score = 1672.3 
    15876 RMSD between 207 pruned atom pairs is 0.948 angstroms; (across all 330 pairs:
    15877 3.502) 
    15878  
    15879 Matchmaker 0.pdb, chain B (#1) with 61.0.pdb, chain A (#306), sequence
    15880 alignment score = 1656.7 
    15881 RMSD between 197 pruned atom pairs is 0.977 angstroms; (across all 330 pairs:
    15882 4.738) 
    15883  
    15884 Matchmaker 0.pdb, chain B (#1) with 61.2.pdb, chain B (#307), sequence
    15885 alignment score = 1678.3 
    15886 RMSD between 200 pruned atom pairs is 0.902 angstroms; (across all 330 pairs:
    15887 4.075) 
    15888  
    15889 Matchmaker 0.pdb, chain B (#1) with 61.4.pdb, chain A (#308), sequence
    15890 alignment score = 1671.1 
    15891 RMSD between 197 pruned atom pairs is 0.872 angstroms; (across all 330 pairs:
    15892 3.434) 
    15893  
    15894 Matchmaker 0.pdb, chain B (#1) with 61.6.pdb, chain B (#309), sequence
    15895 alignment score = 1668.1 
    15896 RMSD between 217 pruned atom pairs is 0.944 angstroms; (across all 330 pairs:
    15897 4.153) 
    15898  
    15899 Matchmaker 0.pdb, chain B (#1) with 61.8.pdb, chain A (#310), sequence
    15900 alignment score = 1663.9 
    15901 RMSD between 206 pruned atom pairs is 0.948 angstroms; (across all 330 pairs:
    15902 5.163) 
    15903  
    15904 Matchmaker 0.pdb, chain B (#1) with 62.0.pdb, chain B (#311), sequence
    15905 alignment score = 1665.7 
    15906 RMSD between 195 pruned atom pairs is 0.847 angstroms; (across all 330 pairs:
    15907 4.741) 
    15908  
    15909 Matchmaker 0.pdb, chain B (#1) with 62.2.pdb, chain A (#312), sequence
    15910 alignment score = 1663.9 
    15911 RMSD between 195 pruned atom pairs is 0.929 angstroms; (across all 330 pairs:
    15912 3.945) 
    15913  
    15914 Matchmaker 0.pdb, chain B (#1) with 62.4.pdb, chain B (#313), sequence
    15915 alignment score = 1675.3 
    15916 RMSD between 220 pruned atom pairs is 0.851 angstroms; (across all 330 pairs:
    15917 4.336) 
    15918  
    15919 Matchmaker 0.pdb, chain B (#1) with 62.6.pdb, chain B (#314), sequence
    15920 alignment score = 1674.7 
    15921 RMSD between 207 pruned atom pairs is 0.797 angstroms; (across all 330 pairs:
    15922 4.325) 
    15923  
    15924 Matchmaker 0.pdb, chain A (#1) with 62.8.pdb, chain A (#315), sequence
    15925 alignment score = 1663.9 
    15926 RMSD between 204 pruned atom pairs is 0.836 angstroms; (across all 330 pairs:
    15927 4.108) 
    15928  
    15929 Matchmaker 0.pdb, chain B (#1) with 63.0.pdb, chain B (#316), sequence
    15930 alignment score = 1678.9 
    15931 RMSD between 224 pruned atom pairs is 0.960 angstroms; (across all 330 pairs:
    15932 3.537) 
    15933  
    15934 Matchmaker 0.pdb, chain B (#1) with 63.2.pdb, chain B (#317), sequence
    15935 alignment score = 1665.7 
    15936 RMSD between 233 pruned atom pairs is 0.973 angstroms; (across all 330 pairs:
    15937 3.420) 
    15938  
    15939 Matchmaker 0.pdb, chain B (#1) with 63.4.pdb, chain B (#318), sequence
    15940 alignment score = 1668.1 
    15941 RMSD between 247 pruned atom pairs is 1.018 angstroms; (across all 330 pairs:
    15942 2.820) 
    15943  
    15944 Matchmaker 0.pdb, chain B (#1) with 63.6.pdb, chain A (#319), sequence
    15945 alignment score = 1663.9 
    15946 RMSD between 216 pruned atom pairs is 0.934 angstroms; (across all 330 pairs:
    15947 4.177) 
    15948  
    15949 Matchmaker 0.pdb, chain B (#1) with 63.8.pdb, chain A (#320), sequence
    15950 alignment score = 1671.1 
    15951 RMSD between 199 pruned atom pairs is 0.957 angstroms; (across all 330 pairs:
    15952 3.485) 
    15953  
    15954 Matchmaker 0.pdb, chain B (#1) with 64.0.pdb, chain B (#321), sequence
    15955 alignment score = 1669.3 
    15956 RMSD between 226 pruned atom pairs is 0.903 angstroms; (across all 330 pairs:
    15957 3.686) 
    15958  
    15959 Matchmaker 0.pdb, chain B (#1) with 64.2.pdb, chain A (#322), sequence
    15960 alignment score = 1674.7 
    15961 RMSD between 203 pruned atom pairs is 0.974 angstroms; (across all 330 pairs:
    15962 2.685) 
    15963  
    15964 Matchmaker 0.pdb, chain B (#1) with 64.4.pdb, chain A (#323), sequence
    15965 alignment score = 1670.5 
    15966 RMSD between 224 pruned atom pairs is 0.979 angstroms; (across all 330 pairs:
    15967 2.669) 
    15968  
    15969 Matchmaker 0.pdb, chain B (#1) with 64.6.pdb, chain A (#324), sequence
    15970 alignment score = 1663.3 
    15971 RMSD between 217 pruned atom pairs is 1.044 angstroms; (across all 330 pairs:
    15972 2.681) 
    15973  
    15974 Matchmaker 0.pdb, chain B (#1) with 64.8.pdb, chain B (#325), sequence
    15975 alignment score = 1674.1 
    15976 RMSD between 264 pruned atom pairs is 1.016 angstroms; (across all 330 pairs:
    15977 2.258) 
    15978  
    15979 Matchmaker 0.pdb, chain B (#1) with 65.0.pdb, chain A (#326), sequence
    15980 alignment score = 1664.5 
    15981 RMSD between 208 pruned atom pairs is 0.942 angstroms; (across all 330 pairs:
    15982 3.731) 
    15983  
    15984 Matchmaker 0.pdb, chain B (#1) with 65.2.pdb, chain A (#327), sequence
    15985 alignment score = 1671.1 
    15986 RMSD between 185 pruned atom pairs is 0.829 angstroms; (across all 330 pairs:
    15987 3.479) 
    15988  
    15989 Matchmaker 0.pdb, chain B (#1) with 65.4.pdb, chain A (#328), sequence
    15990 alignment score = 1667.5 
    15991 RMSD between 208 pruned atom pairs is 0.961 angstroms; (across all 330 pairs:
    15992 4.088) 
    15993  
    15994 Matchmaker 0.pdb, chain B (#1) with 65.6.pdb, chain A (#329), sequence
    15995 alignment score = 1663.9 
    15996 RMSD between 211 pruned atom pairs is 0.936 angstroms; (across all 330 pairs:
    15997 3.768) 
    15998  
    15999 Matchmaker 0.pdb, chain B (#1) with 65.8.pdb, chain A (#330), sequence
    16000 alignment score = 1670.5 
    16001 RMSD between 195 pruned atom pairs is 0.971 angstroms; (across all 330 pairs:
    16002 5.435) 
    16003  
    16004 Matchmaker 0.pdb, chain B (#1) with 66.0.pdb, chain A (#331), sequence
    16005 alignment score = 1668.1 
    16006 RMSD between 208 pruned atom pairs is 0.972 angstroms; (across all 330 pairs:
    16007 4.401) 
    16008  
    16009 Matchmaker 0.pdb, chain B (#1) with 66.2.pdb, chain B (#332), sequence
    16010 alignment score = 1668.1 
    16011 RMSD between 206 pruned atom pairs is 0.988 angstroms; (across all 330 pairs:
    16012 5.635) 
    16013  
    16014 Matchmaker 0.pdb, chain B (#1) with 66.4.pdb, chain A (#333), sequence
    16015 alignment score = 1663.3 
    16016 RMSD between 233 pruned atom pairs is 1.069 angstroms; (across all 330 pairs:
    16017 3.994) 
    16018  
    16019 Matchmaker 0.pdb, chain A (#1) with 66.6.pdb, chain B (#334), sequence
    16020 alignment score = 1668.7 
    16021 RMSD between 229 pruned atom pairs is 0.905 angstroms; (across all 330 pairs:
    16022 5.348) 
    16023  
    16024 Matchmaker 0.pdb, chain B (#1) with 66.8.pdb, chain B (#335), sequence
    16025 alignment score = 1666.9 
    16026 RMSD between 242 pruned atom pairs is 0.945 angstroms; (across all 330 pairs:
    16027 4.935) 
    16028  
    16029 Matchmaker 0.pdb, chain B (#1) with 67.0.pdb, chain B (#336), sequence
    16030 alignment score = 1662.7 
    16031 RMSD between 235 pruned atom pairs is 0.936 angstroms; (across all 330 pairs:
    16032 4.406) 
    16033  
    16034 Matchmaker 0.pdb, chain B (#1) with 67.2.pdb, chain A (#337), sequence
    16035 alignment score = 1671.1 
    16036 RMSD between 198 pruned atom pairs is 1.049 angstroms; (across all 330 pairs:
    16037 3.000) 
    16038  
    16039 Matchmaker 0.pdb, chain B (#1) with 67.4.pdb, chain B (#338), sequence
    16040 alignment score = 1672.3 
    16041 RMSD between 215 pruned atom pairs is 0.889 angstroms; (across all 330 pairs:
    16042 5.976) 
    16043  
    16044 Matchmaker 0.pdb, chain B (#1) with 67.6.pdb, chain A (#339), sequence
    16045 alignment score = 1667.5 
    16046 RMSD between 192 pruned atom pairs is 0.869 angstroms; (across all 330 pairs:
    16047 2.962) 
    16048  
    16049 Matchmaker 0.pdb, chain B (#1) with 67.8.pdb, chain A (#340), sequence
    16050 alignment score = 1671.1 
    16051 RMSD between 216 pruned atom pairs is 0.961 angstroms; (across all 330 pairs:
    16052 2.852) 
    16053  
    16054 Matchmaker 0.pdb, chain B (#1) with 68.0.pdb, chain B (#341), sequence
    16055 alignment score = 1668.7 
    16056 RMSD between 216 pruned atom pairs is 0.813 angstroms; (across all 330 pairs:
    16057 5.823) 
    16058  
    16059 Matchmaker 0.pdb, chain B (#1) with 68.2.pdb, chain B (#342), sequence
    16060 alignment score = 1670.5 
    16061 RMSD between 219 pruned atom pairs is 0.876 angstroms; (across all 330 pairs:
    16062 5.383) 
    16063  
    16064 Matchmaker 0.pdb, chain B (#1) with 68.4.pdb, chain A (#343), sequence
    16065 alignment score = 1659.7 
    16066 RMSD between 196 pruned atom pairs is 0.858 angstroms; (across all 330 pairs:
    16067 2.843) 
    16068  
    16069 Matchmaker 0.pdb, chain B (#1) with 68.6.pdb, chain A (#344), sequence
    16070 alignment score = 1674.7 
    16071 RMSD between 203 pruned atom pairs is 1.034 angstroms; (across all 330 pairs:
    16072 3.160) 
    16073  
    16074 Matchmaker 0.pdb, chain B (#1) with 68.8.pdb, chain A (#345), sequence
    16075 alignment score = 1671.1 
    16076 RMSD between 213 pruned atom pairs is 1.054 angstroms; (across all 330 pairs:
    16077 3.582) 
    16078  
    16079 Matchmaker 0.pdb, chain B (#1) with 69.0.pdb, chain B (#346), sequence
    16080 alignment score = 1671.1 
    16081 RMSD between 228 pruned atom pairs is 0.956 angstroms; (across all 330 pairs:
    16082 4.720) 
    16083  
    16084 Matchmaker 0.pdb, chain B (#1) with 69.2.pdb, chain B (#347), sequence
    16085 alignment score = 1660.9 
    16086 RMSD between 230 pruned atom pairs is 1.024 angstroms; (across all 330 pairs:
    16087 4.644) 
    16088  
    16089 Matchmaker 0.pdb, chain A (#1) with 69.4.pdb, chain B (#348), sequence
    16090 alignment score = 1668.1 
    16091 RMSD between 217 pruned atom pairs is 0.998 angstroms; (across all 330 pairs:
    16092 3.983) 
    16093  
    16094 Matchmaker 0.pdb, chain B (#1) with 69.6.pdb, chain B (#349), sequence
    16095 alignment score = 1672.3 
    16096 RMSD between 235 pruned atom pairs is 0.949 angstroms; (across all 330 pairs:
    16097 3.695) 
    16098  
    16099 Matchmaker 0.pdb, chain B (#1) with 69.8.pdb, chain A (#350), sequence
    16100 alignment score = 1670.5 
    16101 RMSD between 203 pruned atom pairs is 1.065 angstroms; (across all 330 pairs:
    16102 3.634) 
    16103  
    16104 Matchmaker 0.pdb, chain B (#1) with 70.0.pdb, chain B (#351), sequence
    16105 alignment score = 1677.7 
    16106 RMSD between 216 pruned atom pairs is 0.886 angstroms; (across all 330 pairs:
    16107 5.052) 
    16108  
    16109 Matchmaker 0.pdb, chain B (#1) with 70.2.pdb, chain A (#352), sequence
    16110 alignment score = 1674.7 
    16111 RMSD between 227 pruned atom pairs is 1.129 angstroms; (across all 330 pairs:
    16112 3.349) 
    16113  
    16114 Matchmaker 0.pdb, chain B (#1) with 70.4.pdb, chain B (#353), sequence
    16115 alignment score = 1681.3 
    16116 RMSD between 212 pruned atom pairs is 1.007 angstroms; (across all 330 pairs:
    16117 4.733) 
    16118  
    16119 Matchmaker 0.pdb, chain B (#1) with 70.6.pdb, chain B (#354), sequence
    16120 alignment score = 1672.3 
    16121 RMSD between 231 pruned atom pairs is 1.031 angstroms; (across all 330 pairs:
    16122 3.702) 
    16123  
    16124 Matchmaker 0.pdb, chain B (#1) with 70.8.pdb, chain A (#355), sequence
    16125 alignment score = 1671.1 
    16126 RMSD between 208 pruned atom pairs is 0.972 angstroms; (across all 330 pairs:
    16127 3.378) 
    16128  
    16129 Matchmaker 0.pdb, chain B (#1) with 71.0.pdb, chain A (#356), sequence
    16130 alignment score = 1671.1 
    16131 RMSD between 204 pruned atom pairs is 1.042 angstroms; (across all 330 pairs:
    16132 5.002) 
    16133  
    16134 Matchmaker 0.pdb, chain B (#1) with 71.2.pdb, chain B (#357), sequence
    16135 alignment score = 1677.7 
    16136 RMSD between 229 pruned atom pairs is 0.924 angstroms; (across all 330 pairs:
    16137 4.263) 
    16138  
    16139 Matchmaker 0.pdb, chain B (#1) with 71.4.pdb, chain A (#358), sequence
    16140 alignment score = 1671.1 
    16141 RMSD between 195 pruned atom pairs is 0.886 angstroms; (across all 330 pairs:
    16142 4.327) 
    16143  
    16144 Matchmaker 0.pdb, chain B (#1) with 71.6.pdb, chain A (#359), sequence
    16145 alignment score = 1671.1 
    16146 RMSD between 232 pruned atom pairs is 1.080 angstroms; (across all 330 pairs:
    16147 3.222) 
    16148  
    16149 Matchmaker 0.pdb, chain B (#1) with 71.8.pdb, chain B (#360), sequence
    16150 alignment score = 1671.7 
    16151 RMSD between 208 pruned atom pairs is 0.935 angstroms; (across all 330 pairs:
    16152 3.499) 
    16153  
    16154 Matchmaker 0.pdb, chain B (#1) with 72.0.pdb, chain B (#361), sequence
    16155 alignment score = 1671.7 
    16156 RMSD between 211 pruned atom pairs is 0.917 angstroms; (across all 330 pairs:
    16157 4.146) 
    16158  
    16159 Matchmaker 0.pdb, chain B (#1) with 72.2.pdb, chain B (#362), sequence
    16160 alignment score = 1677.7 
    16161 RMSD between 224 pruned atom pairs is 0.983 angstroms; (across all 330 pairs:
    16162 3.600) 
    16163  
    16164 Matchmaker 0.pdb, chain B (#1) with 72.4.pdb, chain B (#363), sequence
    16165 alignment score = 1671.1 
    16166 RMSD between 217 pruned atom pairs is 0.920 angstroms; (across all 330 pairs:
    16167 3.403) 
    16168  
    16169 Matchmaker 0.pdb, chain B (#1) with 72.6.pdb, chain B (#364), sequence
    16170 alignment score = 1681.9 
    16171 RMSD between 219 pruned atom pairs is 0.920 angstroms; (across all 330 pairs:
    16172 2.550) 
    16173  
    16174 Matchmaker 0.pdb, chain B (#1) with 72.8.pdb, chain B (#365), sequence
    16175 alignment score = 1678.3 
    16176 RMSD between 229 pruned atom pairs is 0.926 angstroms; (across all 330 pairs:
    16177 2.858) 
    16178  
    16179 Matchmaker 0.pdb, chain B (#1) with 73.0.pdb, chain B (#366), sequence
    16180 alignment score = 1674.7 
    16181 RMSD between 265 pruned atom pairs is 1.132 angstroms; (across all 330 pairs:
    16182 2.300) 
    16183  
    16184 Matchmaker 0.pdb, chain B (#1) with 73.2.pdb, chain B (#367), sequence
    16185 alignment score = 1666.9 
    16186 RMSD between 233 pruned atom pairs is 0.928 angstroms; (across all 330 pairs:
    16187 3.879) 
    16188  
    16189 Matchmaker 0.pdb, chain B (#1) with 73.4.pdb, chain A (#368), sequence
    16190 alignment score = 1674.7 
    16191 RMSD between 204 pruned atom pairs is 0.930 angstroms; (across all 330 pairs:
    16192 2.823) 
    16193  
    16194 Matchmaker 0.pdb, chain B (#1) with 73.6.pdb, chain B (#369), sequence
    16195 alignment score = 1671.7 
    16196 RMSD between 239 pruned atom pairs is 1.103 angstroms; (across all 330 pairs:
    16197 2.731) 
    16198  
    16199 Matchmaker 0.pdb, chain A (#1) with 73.8.pdb, chain A (#370), sequence
    16200 alignment score = 1671.1 
    16201 RMSD between 191 pruned atom pairs is 0.911 angstroms; (across all 330 pairs:
    16202 3.012) 
    16203  
    16204 Matchmaker 0.pdb, chain B (#1) with 74.0.pdb, chain A (#371), sequence
    16205 alignment score = 1671.1 
    16206 RMSD between 228 pruned atom pairs is 1.067 angstroms; (across all 330 pairs:
    16207 2.353) 
    16208  
    16209 Matchmaker 0.pdb, chain B (#1) with 74.2.pdb, chain B (#372), sequence
    16210 alignment score = 1671.1 
    16211 RMSD between 250 pruned atom pairs is 1.012 angstroms; (across all 330 pairs:
    16212 2.672) 
    16213  
    16214 Matchmaker 0.pdb, chain B (#1) with 74.4.pdb, chain A (#373), sequence
    16215 alignment score = 1668.7 
    16216 RMSD between 210 pruned atom pairs is 0.960 angstroms; (across all 330 pairs:
    16217 2.839) 
    16218  
    16219 Matchmaker 0.pdb, chain B (#1) with 74.6.pdb, chain A (#374), sequence
    16220 alignment score = 1675.3 
    16221 RMSD between 213 pruned atom pairs is 1.028 angstroms; (across all 330 pairs:
    16222 3.078) 
    16223  
    16224 Matchmaker 0.pdb, chain A (#1) with 74.8.pdb, chain A (#375), sequence
    16225 alignment score = 1674.1 
    16226 RMSD between 215 pruned atom pairs is 1.100 angstroms; (across all 330 pairs:
    16227 2.495) 
    16228  
    16229 Matchmaker 0.pdb, chain B (#1) with 75.0.pdb, chain A (#376), sequence
    16230 alignment score = 1678.3 
    16231 RMSD between 226 pruned atom pairs is 0.981 angstroms; (across all 330 pairs:
    16232 3.016) 
    16233  
    16234 Matchmaker 0.pdb, chain B (#1) with 75.2.pdb, chain A (#377), sequence
    16235 alignment score = 1665.1 
    16236 RMSD between 205 pruned atom pairs is 0.936 angstroms; (across all 330 pairs:
    16237 3.323) 
    16238  
    16239 Matchmaker 0.pdb, chain A (#1) with 75.4.pdb, chain A (#378), sequence
    16240 alignment score = 1677.7 
    16241 RMSD between 210 pruned atom pairs is 1.042 angstroms; (across all 330 pairs:
    16242 3.084) 
    16243  
    16244 Matchmaker 0.pdb, chain B (#1) with 75.6.pdb, chain A (#379), sequence
    16245 alignment score = 1668.7 
    16246 RMSD between 191 pruned atom pairs is 0.926 angstroms; (across all 330 pairs:
    16247 3.489) 
    16248  
    16249 Matchmaker 0.pdb, chain B (#1) with 75.8.pdb, chain A (#380), sequence
    16250 alignment score = 1671.1 
    16251 RMSD between 186 pruned atom pairs is 0.928 angstroms; (across all 330 pairs:
    16252 3.224) 
    16253  
    16254 Matchmaker 0.pdb, chain B (#1) with 76.0.pdb, chain A (#381), sequence
    16255 alignment score = 1674.7 
    16256 RMSD between 210 pruned atom pairs is 0.998 angstroms; (across all 330 pairs:
    16257 3.226) 
    16258  
    16259 Matchmaker 0.pdb, chain A (#1) with 76.2.pdb, chain A (#382), sequence
    16260 alignment score = 1674.7 
    16261 RMSD between 215 pruned atom pairs is 0.964 angstroms; (across all 330 pairs:
    16262 3.489) 
    16263  
    16264 Matchmaker 0.pdb, chain B (#1) with 76.4.pdb, chain A (#383), sequence
    16265 alignment score = 1672.3 
    16266 RMSD between 218 pruned atom pairs is 1.039 angstroms; (across all 330 pairs:
    16267 3.771) 
    16268  
    16269 Matchmaker 0.pdb, chain B (#1) with 76.6.pdb, chain A (#384), sequence
    16270 alignment score = 1675.3 
    16271 RMSD between 212 pruned atom pairs is 1.032 angstroms; (across all 330 pairs:
    16272 4.281) 
    16273  
    16274 Matchmaker 0.pdb, chain B (#1) with 76.8.pdb, chain A (#385), sequence
    16275 alignment score = 1675.3 
    16276 RMSD between 217 pruned atom pairs is 1.062 angstroms; (across all 330 pairs:
    16277 4.667) 
    16278  
    16279 Matchmaker 0.pdb, chain B (#1) with 77.0.pdb, chain B (#386), sequence
    16280 alignment score = 1675.9 
    16281 RMSD between 233 pruned atom pairs is 0.862 angstroms; (across all 330 pairs:
    16282 2.494) 
    16283  
    16284 Matchmaker 0.pdb, chain B (#1) with 77.2.pdb, chain A (#387), sequence
    16285 alignment score = 1675.3 
    16286 RMSD between 217 pruned atom pairs is 0.980 angstroms; (across all 330 pairs:
    16287 3.743) 
    16288  
    16289 Matchmaker 0.pdb, chain B (#1) with 77.4.pdb, chain B (#388), sequence
    16290 alignment score = 1671.1 
    16291 RMSD between 226 pruned atom pairs is 0.883 angstroms; (across all 330 pairs:
    16292 3.332) 
    16293  
    16294 Matchmaker 0.pdb, chain B (#1) with 77.6.pdb, chain A (#389), sequence
    16295 alignment score = 1671.7 
    16296 RMSD between 225 pruned atom pairs is 1.076 angstroms; (across all 330 pairs:
    16297 3.370) 
    16298  
    16299 Matchmaker 0.pdb, chain B (#1) with 77.8.pdb, chain B (#390), sequence
    16300 alignment score = 1668.7 
    16301 RMSD between 223 pruned atom pairs is 0.900 angstroms; (across all 330 pairs:
    16302 3.226) 
    16303  
    16304 Matchmaker 0.pdb, chain B (#1) with 78.0.pdb, chain A (#391), sequence
    16305 alignment score = 1677.7 
    16306 RMSD between 223 pruned atom pairs is 1.071 angstroms; (across all 330 pairs:
    16307 2.751) 
    16308  
    16309 Matchmaker 0.pdb, chain B (#1) with 78.2.pdb, chain B (#392), sequence
    16310 alignment score = 1675.3 
    16311 RMSD between 224 pruned atom pairs is 0.864 angstroms; (across all 330 pairs:
    16312 3.647) 
    16313  
    16314 Matchmaker 0.pdb, chain B (#1) with 78.4.pdb, chain A (#393), sequence
    16315 alignment score = 1675.3 
    16316 RMSD between 221 pruned atom pairs is 1.088 angstroms; (across all 330 pairs:
    16317 2.758) 
    16318  
    16319 Matchmaker 0.pdb, chain A (#1) with 78.6.pdb, chain A (#394), sequence
    16320 alignment score = 1674.7 
    16321 RMSD between 214 pruned atom pairs is 1.081 angstroms; (across all 330 pairs:
    16322 2.704) 
    16323  
    16324 Matchmaker 0.pdb, chain B (#1) with 78.8.pdb, chain A (#395), sequence
    16325 alignment score = 1671.1 
    16326 RMSD between 218 pruned atom pairs is 1.037 angstroms; (across all 330 pairs:
    16327 3.026) 
    16328  
    16329 Matchmaker 0.pdb, chain B (#1) with 79.0.pdb, chain B (#396), sequence
    16330 alignment score = 1672.9 
    16331 RMSD between 215 pruned atom pairs is 0.886 angstroms; (across all 330 pairs:
    16332 3.154) 
    16333  
    16334 Matchmaker 0.pdb, chain B (#1) with 79.2.pdb, chain A (#397), sequence
    16335 alignment score = 1671.1 
    16336 RMSD between 199 pruned atom pairs is 0.960 angstroms; (across all 330 pairs:
    16337 3.335) 
    16338  
    16339 Matchmaker 0.pdb, chain B (#1) with 79.4.pdb, chain B (#398), sequence
    16340 alignment score = 1674.7 
    16341 RMSD between 214 pruned atom pairs is 0.917 angstroms; (across all 330 pairs:
    16342 2.848) 
    16343  
    16344 Matchmaker 0.pdb, chain B (#1) with 79.6.pdb, chain A (#399), sequence
    16345 alignment score = 1678.3 
    16346 RMSD between 217 pruned atom pairs is 1.024 angstroms; (across all 330 pairs:
    16347 3.665) 
    16348  
    16349 Matchmaker 0.pdb, chain B (#1) with 79.8.pdb, chain B (#400), sequence
    16350 alignment score = 1684.9 
    16351 RMSD between 222 pruned atom pairs is 0.859 angstroms; (across all 330 pairs:
    16352 3.094) 
    16353  
    16354 Matchmaker 0.pdb, chain B (#1) with 80.0.pdb, chain A (#401), sequence
    16355 alignment score = 1674.1 
    16356 RMSD between 194 pruned atom pairs is 0.962 angstroms; (across all 330 pairs:
    16357 3.757) 
    16358  
    16359 Matchmaker 0.pdb, chain B (#1) with 80.2.pdb, chain A (#402), sequence
    16360 alignment score = 1668.1 
    16361 RMSD between 212 pruned atom pairs is 0.971 angstroms; (across all 330 pairs:
    16362 3.701) 
    16363  
    16364 Matchmaker 0.pdb, chain B (#1) with 80.4.pdb, chain A (#403), sequence
    16365 alignment score = 1674.1 
    16366 RMSD between 197 pruned atom pairs is 0.948 angstroms; (across all 330 pairs:
    16367 4.163) 
    16368  
    16369 Matchmaker 0.pdb, chain B (#1) with 80.6.pdb, chain A (#404), sequence
    16370 alignment score = 1662.1 
    16371 RMSD between 210 pruned atom pairs is 0.979 angstroms; (across all 330 pairs:
    16372 4.167) 
    16373  
    16374 Matchmaker 0.pdb, chain A (#1) with 80.8.pdb, chain B (#405), sequence
    16375 alignment score = 1668.1 
    16376 RMSD between 205 pruned atom pairs is 1.023 angstroms; (across all 330 pairs:
    16377 2.981) 
    16378  
    16379 Matchmaker 0.pdb, chain B (#1) with 81.0.pdb, chain B (#406), sequence
    16380 alignment score = 1671.1 
    16381 RMSD between 229 pruned atom pairs is 0.975 angstroms; (across all 330 pairs:
    16382 2.812) 
    16383  
    16384 Matchmaker 0.pdb, chain B (#1) with 81.2.pdb, chain A (#407), sequence
    16385 alignment score = 1671.1 
    16386 RMSD between 209 pruned atom pairs is 0.946 angstroms; (across all 330 pairs:
    16387 3.070) 
    16388  
    16389 Matchmaker 0.pdb, chain B (#1) with 81.4.pdb, chain A (#408), sequence
    16390 alignment score = 1674.7 
    16391 RMSD between 208 pruned atom pairs is 0.961 angstroms; (across all 330 pairs:
    16392 3.262) 
    16393  
    16394 Matchmaker 0.pdb, chain A (#1) with 81.6.pdb, chain A (#409), sequence
    16395 alignment score = 1671.1 
    16396 RMSD between 196 pruned atom pairs is 0.973 angstroms; (across all 330 pairs:
    16397 4.021) 
    16398  
    16399 Matchmaker 0.pdb, chain B (#1) with 81.8.pdb, chain A (#410), sequence
    16400 alignment score = 1668.7 
    16401 RMSD between 201 pruned atom pairs is 0.968 angstroms; (across all 330 pairs:
    16402 3.628) 
    16403  
    16404 Matchmaker 0.pdb, chain B (#1) with 82.0.pdb, chain A (#411), sequence
    16405 alignment score = 1672.3 
    16406 RMSD between 205 pruned atom pairs is 1.070 angstroms; (across all 330 pairs:
    16407 3.489) 
    16408  
    16409 Matchmaker 0.pdb, chain B (#1) with 82.2.pdb, chain A (#412), sequence
    16410 alignment score = 1674.1 
    16411 RMSD between 204 pruned atom pairs is 1.034 angstroms; (across all 330 pairs:
    16412 2.999) 
    16413  
    16414 Matchmaker 0.pdb, chain B (#1) with 82.4.pdb, chain A (#413), sequence
    16415 alignment score = 1668.1 
    16416 RMSD between 203 pruned atom pairs is 1.006 angstroms; (across all 330 pairs:
    16417 3.901) 
    16418  
    16419 Matchmaker 0.pdb, chain B (#1) with 82.6.pdb, chain A (#414), sequence
    16420 alignment score = 1674.7 
    16421 RMSD between 208 pruned atom pairs is 0.959 angstroms; (across all 330 pairs:
    16422 4.596) 
    16423  
    16424 Matchmaker 0.pdb, chain B (#1) with 82.8.pdb, chain A (#415), sequence
    16425 alignment score = 1674.7 
    16426 RMSD between 209 pruned atom pairs is 0.990 angstroms; (across all 330 pairs:
    16427 4.355) 
    16428  
    16429 Matchmaker 0.pdb, chain B (#1) with 83.0.pdb, chain B (#416), sequence
    16430 alignment score = 1670.5 
    16431 RMSD between 229 pruned atom pairs is 0.985 angstroms; (across all 330 pairs:
    16432 3.104) 
    16433  
    16434 Matchmaker 0.pdb, chain B (#1) with 83.2.pdb, chain A (#417), sequence
    16435 alignment score = 1677.7 
    16436 RMSD between 207 pruned atom pairs is 0.988 angstroms; (across all 330 pairs:
    16437 3.828) 
    16438  
    16439 Matchmaker 0.pdb, chain B (#1) with 83.4.pdb, chain A (#418), sequence
    16440 alignment score = 1668.1 
    16441 RMSD between 199 pruned atom pairs is 1.093 angstroms; (across all 330 pairs:
    16442 4.027) 
    16443  
    16444 Matchmaker 0.pdb, chain B (#1) with 83.6.pdb, chain A (#419), sequence
    16445 alignment score = 1678.3 
    16446 RMSD between 225 pruned atom pairs is 1.130 angstroms; (across all 330 pairs:
    16447 2.945) 
    16448  
    16449 Matchmaker 0.pdb, chain B (#1) with 83.8.pdb, chain A (#420), sequence
    16450 alignment score = 1674.7 
    16451 RMSD between 259 pruned atom pairs is 1.083 angstroms; (across all 330 pairs:
    16452 2.109) 
    16453  
    16454 Matchmaker 0.pdb, chain B (#1) with 84.0.pdb, chain B (#421), sequence
    16455 alignment score = 1675.3 
    16456 RMSD between 237 pruned atom pairs is 0.954 angstroms; (across all 330 pairs:
    16457 3.192) 
    16458  
    16459 Matchmaker 0.pdb, chain B (#1) with 84.2.pdb, chain A (#422), sequence
    16460 alignment score = 1675.3 
    16461 RMSD between 226 pruned atom pairs is 0.984 angstroms; (across all 330 pairs:
    16462 3.010) 
    16463  
    16464 Matchmaker 0.pdb, chain A (#1) with 84.4.pdb, chain A (#423), sequence
    16465 alignment score = 1671.1 
    16466 RMSD between 244 pruned atom pairs is 0.975 angstroms; (across all 330 pairs:
    16467 3.284) 
    16468  
    16469 Matchmaker 0.pdb, chain B (#1) with 84.6.pdb, chain B (#424), sequence
    16470 alignment score = 1675.3 
    16471 RMSD between 252 pruned atom pairs is 1.025 angstroms; (across all 330 pairs:
    16472 2.357) 
    16473  
    16474 Matchmaker 0.pdb, chain B (#1) with 84.8.pdb, chain A (#425), sequence
    16475 alignment score = 1660.9 
    16476 RMSD between 226 pruned atom pairs is 0.950 angstroms; (across all 330 pairs:
    16477 3.405) 
    16478  
    16479 Matchmaker 0.pdb, chain B (#1) with 85.0.pdb, chain B (#426), sequence
    16480 alignment score = 1665.7 
    16481 RMSD between 243 pruned atom pairs is 0.900 angstroms; (across all 330 pairs:
    16482 2.818) 
    16483  
    16484 Matchmaker 0.pdb, chain B (#1) with 85.2.pdb, chain A (#427), sequence
    16485 alignment score = 1671.1 
    16486 RMSD between 244 pruned atom pairs is 1.036 angstroms; (across all 330 pairs:
    16487 2.282) 
    16488  
    16489 Matchmaker 0.pdb, chain B (#1) with 85.4.pdb, chain A (#428), sequence
    16490 alignment score = 1667.5 
    16491 RMSD between 234 pruned atom pairs is 0.989 angstroms; (across all 330 pairs:
    16492 2.853) 
    16493  
    16494 Matchmaker 0.pdb, chain B (#1) with 85.6.pdb, chain B (#429), sequence
    16495 alignment score = 1675.3 
    16496 RMSD between 252 pruned atom pairs is 0.894 angstroms; (across all 330 pairs:
    16497 2.683) 
    16498  
    16499 Matchmaker 0.pdb, chain B (#1) with 85.8.pdb, chain B (#430), sequence
    16500 alignment score = 1671.7 
    16501 RMSD between 230 pruned atom pairs is 0.994 angstroms; (across all 330 pairs:
    16502 3.101) 
    16503  
    16504 Matchmaker 0.pdb, chain B (#1) with 86.0.pdb, chain B (#431), sequence
    16505 alignment score = 1681.3 
    16506 RMSD between 219 pruned atom pairs is 0.958 angstroms; (across all 330 pairs:
    16507 3.599) 
    16508  
    16509 Matchmaker 0.pdb, chain B (#1) with 86.2.pdb, chain B (#432), sequence
    16510 alignment score = 1672.3 
    16511 RMSD between 228 pruned atom pairs is 0.954 angstroms; (across all 330 pairs:
    16512 4.432) 
    16513  
    16514 Matchmaker 0.pdb, chain B (#1) with 86.4.pdb, chain B (#433), sequence
    16515 alignment score = 1678.9 
    16516 RMSD between 220 pruned atom pairs is 0.999 angstroms; (across all 330 pairs:
    16517 4.311) 
    16518  
    16519 Matchmaker 0.pdb, chain B (#1) with 86.6.pdb, chain B (#434), sequence
    16520 alignment score = 1668.7 
    16521 RMSD between 223 pruned atom pairs is 0.992 angstroms; (across all 330 pairs:
    16522 4.246) 
    16523  
    16524 Matchmaker 0.pdb, chain B (#1) with 86.8.pdb, chain B (#435), sequence
    16525 alignment score = 1681.9 
    16526 RMSD between 216 pruned atom pairs is 0.948 angstroms; (across all 330 pairs:
    16527 4.027) 
    16528  
    16529 Matchmaker 0.pdb, chain B (#1) with 87.0.pdb, chain B (#436), sequence
    16530 alignment score = 1671.7 
    16531 RMSD between 218 pruned atom pairs is 0.897 angstroms; (across all 330 pairs:
    16532 3.847) 
    16533  
    16534 Matchmaker 0.pdb, chain B (#1) with 87.2.pdb, chain B (#437), sequence
    16535 alignment score = 1675.3 
    16536 RMSD between 232 pruned atom pairs is 0.966 angstroms; (across all 330 pairs:
    16537 4.165) 
    16538  
    16539 Matchmaker 0.pdb, chain B (#1) with 87.4.pdb, chain A (#438), sequence
    16540 alignment score = 1678.3 
    16541 RMSD between 225 pruned atom pairs is 0.982 angstroms; (across all 330 pairs:
    16542 2.660) 
    16543  
    16544 Matchmaker 0.pdb, chain B (#1) with 87.6.pdb, chain B (#439), sequence
    16545 alignment score = 1674.7 
    16546 RMSD between 230 pruned atom pairs is 0.952 angstroms; (across all 330 pairs:
    16547 4.323) 
    16548  
    16549 Matchmaker 0.pdb, chain B (#1) with 87.8.pdb, chain B (#440), sequence
    16550 alignment score = 1674.7 
    16551 RMSD between 233 pruned atom pairs is 0.957 angstroms; (across all 330 pairs:
    16552 3.729) 
    16553  
    16554 Matchmaker 0.pdb, chain B (#1) with 88.0.pdb, chain A (#441), sequence
    16555 alignment score = 1671.1 
    16556 RMSD between 239 pruned atom pairs is 0.991 angstroms; (across all 330 pairs:
    16557 2.507) 
    16558  
    16559 Matchmaker 0.pdb, chain B (#1) with 88.2.pdb, chain B (#442), sequence
    16560 alignment score = 1671.7 
    16561 RMSD between 224 pruned atom pairs is 0.905 angstroms; (across all 330 pairs:
    16562 6.143) 
    16563  
    16564 Matchmaker 0.pdb, chain B (#1) with 88.4.pdb, chain B (#443), sequence
    16565 alignment score = 1671.1 
    16566 RMSD between 216 pruned atom pairs is 0.929 angstroms; (across all 330 pairs:
    16567 4.736) 
    16568  
    16569 Matchmaker 0.pdb, chain B (#1) with 88.6.pdb, chain A (#444), sequence
    16570 alignment score = 1672.3 
    16571 RMSD between 225 pruned atom pairs is 0.997 angstroms; (across all 330 pairs:
    16572 3.842) 
    16573  
    16574 Matchmaker 0.pdb, chain B (#1) with 88.8.pdb, chain A (#445), sequence
    16575 alignment score = 1664.5 
    16576 RMSD between 219 pruned atom pairs is 1.035 angstroms; (across all 330 pairs:
    16577 3.404) 
    16578  
    16579 Matchmaker 0.pdb, chain B (#1) with 89.0.pdb, chain A (#446), sequence
    16580 alignment score = 1668.1 
    16581 RMSD between 209 pruned atom pairs is 0.978 angstroms; (across all 330 pairs:
    16582 3.510) 
    16583  
    16584 Matchmaker 0.pdb, chain B (#1) with 89.2.pdb, chain B (#447), sequence
    16585 alignment score = 1671.1 
    16586 RMSD between 213 pruned atom pairs is 0.939 angstroms; (across all 330 pairs:
    16587 5.563) 
    16588  
    16589 Matchmaker 0.pdb, chain B (#1) with 89.4.pdb, chain A (#448), sequence
    16590 alignment score = 1674.1 
    16591 RMSD between 224 pruned atom pairs is 1.048 angstroms; (across all 330 pairs:
    16592 3.370) 
    16593  
    16594 Matchmaker 0.pdb, chain A (#1) with 89.6.pdb, chain B (#449), sequence
    16595 alignment score = 1674.7 
    16596 RMSD between 210 pruned atom pairs is 0.961 angstroms; (across all 330 pairs:
    16597 6.496) 
    16598  
    16599 Matchmaker 0.pdb, chain A (#1) with 89.8.pdb, chain A (#450), sequence
    16600 alignment score = 1671.1 
    16601 RMSD between 214 pruned atom pairs is 1.016 angstroms; (across all 330 pairs:
    16602 3.088) 
    16603  
    16604 Matchmaker 0.pdb, chain B (#1) with 90.0.pdb, chain A (#451), sequence
    16605 alignment score = 1677.7 
    16606 RMSD between 233 pruned atom pairs is 1.030 angstroms; (across all 330 pairs:
    16607 2.669) 
    16608  
    16609 Matchmaker 0.pdb, chain A (#1) with 90.2.pdb, chain A (#452), sequence
    16610 alignment score = 1677.1 
    16611 RMSD between 239 pruned atom pairs is 0.996 angstroms; (across all 330 pairs:
    16612 2.574) 
    16613  
    16614 Matchmaker 0.pdb, chain B (#1) with 90.4.pdb, chain B (#453), sequence
    16615 alignment score = 1665.7 
    16616 RMSD between 225 pruned atom pairs is 1.004 angstroms; (across all 330 pairs:
    16617 5.015) 
    16618  
    16619 Matchmaker 0.pdb, chain B (#1) with 90.6.pdb, chain A (#454), sequence
    16620 alignment score = 1671.1 
    16621 RMSD between 233 pruned atom pairs is 0.965 angstroms; (across all 330 pairs:
    16622 3.305) 
    16623  
    16624 Matchmaker 0.pdb, chain B (#1) with 90.8.pdb, chain B (#455), sequence
    16625 alignment score = 1669.3 
    16626 RMSD between 220 pruned atom pairs is 0.968 angstroms; (across all 330 pairs:
    16627 5.233) 
    16628  
    16629 Matchmaker 0.pdb, chain B (#1) with 91.0.pdb, chain B (#456), sequence
    16630 alignment score = 1668.1 
    16631 RMSD between 205 pruned atom pairs is 0.964 angstroms; (across all 330 pairs:
    16632 6.244) 
    16633  
    16634 Matchmaker 0.pdb, chain B (#1) with 91.2.pdb, chain A (#457), sequence
    16635 alignment score = 1675.3 
    16636 RMSD between 225 pruned atom pairs is 0.941 angstroms; (across all 330 pairs:
    16637 2.924) 
    16638  
    16639 Matchmaker 0.pdb, chain B (#1) with 91.4.pdb, chain A (#458), sequence
    16640 alignment score = 1667.5 
    16641 RMSD between 241 pruned atom pairs is 1.047 angstroms; (across all 330 pairs:
    16642 2.666) 
    16643  
    16644 Matchmaker 0.pdb, chain B (#1) with 91.6.pdb, chain A (#459), sequence
    16645 alignment score = 1671.1 
    16646 RMSD between 223 pruned atom pairs is 0.975 angstroms; (across all 330 pairs:
    16647 3.275) 
    16648  
    16649 Matchmaker 0.pdb, chain B (#1) with 91.8.pdb, chain B (#460), sequence
    16650 alignment score = 1671.7 
    16651 RMSD between 208 pruned atom pairs is 0.880 angstroms; (across all 330 pairs:
    16652 3.505) 
    16653  
    16654 Matchmaker 0.pdb, chain B (#1) with 92.0.pdb, chain A (#461), sequence
    16655 alignment score = 1667.5 
    16656 RMSD between 218 pruned atom pairs is 0.945 angstroms; (across all 330 pairs:
    16657 3.643) 
    16658  
    16659 Matchmaker 0.pdb, chain B (#1) with 92.2.pdb, chain A (#462), sequence
    16660 alignment score = 1674.7 
    16661 RMSD between 242 pruned atom pairs is 1.003 angstroms; (across all 330 pairs:
    16662 2.506) 
    16663  
    16664 Matchmaker 0.pdb, chain B (#1) with 92.4.pdb, chain B (#463), sequence
    16665 alignment score = 1675.3 
    16666 RMSD between 228 pruned atom pairs is 1.035 angstroms; (across all 330 pairs:
    16667 3.393) 
    16668  
    16669 Matchmaker 0.pdb, chain B (#1) with 92.6.pdb, chain B (#464), sequence
    16670 alignment score = 1675.3 
    16671 RMSD between 220 pruned atom pairs is 1.008 angstroms; (across all 330 pairs:
    16672 4.376) 
    16673  
    16674 Matchmaker 0.pdb, chain A (#1) with 92.8.pdb, chain A (#465), sequence
    16675 alignment score = 1668.1 
    16676 RMSD between 235 pruned atom pairs is 1.011 angstroms; (across all 330 pairs:
    16677 3.340) 
    16678  
    16679 Matchmaker 0.pdb, chain B (#1) with 93.0.pdb, chain B (#466), sequence
    16680 alignment score = 1668.1 
    16681 RMSD between 205 pruned atom pairs is 0.943 angstroms; (across all 330 pairs:
    16682 4.922) 
    16683  
    16684 Matchmaker 0.pdb, chain B (#1) with 93.2.pdb, chain A (#467), sequence
    16685 alignment score = 1668.7 
    16686 RMSD between 226 pruned atom pairs is 0.939 angstroms; (across all 330 pairs:
    16687 3.614) 
    16688  
    16689 Matchmaker 0.pdb, chain B (#1) with 93.4.pdb, chain B (#468), sequence
    16690 alignment score = 1672.3 
    16691 RMSD between 216 pruned atom pairs is 1.018 angstroms; (across all 330 pairs:
    16692 4.713) 
    16693  
    16694 Matchmaker 0.pdb, chain B (#1) with 93.6.pdb, chain A (#469), sequence
    16695 alignment score = 1668.1 
    16696 RMSD between 231 pruned atom pairs is 1.051 angstroms; (across all 330 pairs:
    16697 3.489) 
    16698  
    16699 Matchmaker 0.pdb, chain B (#1) with 93.8.pdb, chain B (#470), sequence
    16700 alignment score = 1671.7 
    16701 RMSD between 226 pruned atom pairs is 1.047 angstroms; (across all 330 pairs:
    16702 4.307) 
    16703  
    16704 Matchmaker 0.pdb, chain B (#1) with 94.0.pdb, chain B (#471), sequence
    16705 alignment score = 1671.7 
    16706 RMSD between 241 pruned atom pairs is 1.022 angstroms; (across all 330 pairs:
    16707 4.119) 
    16708  
    16709 Matchmaker 0.pdb, chain B (#1) with 94.2.pdb, chain A (#472), sequence
    16710 alignment score = 1667.5 
    16711 RMSD between 234 pruned atom pairs is 1.000 angstroms; (across all 330 pairs:
    16712 3.166) 
    16713  
    16714 Matchmaker 0.pdb, chain A (#1) with 94.4.pdb, chain A (#473), sequence
    16715 alignment score = 1671.1 
    16716 RMSD between 242 pruned atom pairs is 0.958 angstroms; (across all 330 pairs:
    16717 3.324) 
    16718  
    16719 Matchmaker 0.pdb, chain B (#1) with 94.6.pdb, chain B (#474), sequence
    16720 alignment score = 1669.3 
    16721 RMSD between 222 pruned atom pairs is 0.961 angstroms; (across all 330 pairs:
    16722 5.151) 
    16723  
    16724 Matchmaker 0.pdb, chain B (#1) with 94.8.pdb, chain A (#475), sequence
    16725 alignment score = 1667.5 
    16726 RMSD between 229 pruned atom pairs is 1.123 angstroms; (across all 330 pairs:
    16727 3.008) 
    16728  
    16729 Matchmaker 0.pdb, chain B (#1) with 95.0.pdb, chain B (#476), sequence
    16730 alignment score = 1661.5 
    16731 RMSD between 235 pruned atom pairs is 1.033 angstroms; (across all 330 pairs:
    16732 3.915) 
    16733  
    16734 Matchmaker 0.pdb, chain B (#1) with 95.2.pdb, chain B (#477), sequence
    16735 alignment score = 1669.3 
    16736 RMSD between 224 pruned atom pairs is 1.057 angstroms; (across all 330 pairs:
    16737 4.164) 
    16738  
    16739 Matchmaker 0.pdb, chain B (#1) with 95.4.pdb, chain A (#478), sequence
    16740 alignment score = 1671.7 
    16741 RMSD between 230 pruned atom pairs is 0.966 angstroms; (across all 330 pairs:
    16742 2.750) 
    16743  
    16744 Matchmaker 0.pdb, chain B (#1) with 95.6.pdb, chain B (#479), sequence
    16745 alignment score = 1672.3 
    16746 RMSD between 233 pruned atom pairs is 1.044 angstroms; (across all 330 pairs:
    16747 3.767) 
    16748  
    16749 Matchmaker 0.pdb, chain B (#1) with 95.8.pdb, chain A (#480), sequence
    16750 alignment score = 1675.3 
    16751 RMSD between 238 pruned atom pairs is 1.038 angstroms; (across all 330 pairs:
    16752 2.962) 
    16753  
    16754 Matchmaker 0.pdb, chain B (#1) with 96.0.pdb, chain A (#481), sequence
    16755 alignment score = 1666.9 
    16756 RMSD between 225 pruned atom pairs is 0.959 angstroms; (across all 330 pairs:
    16757 2.880) 
    16758  
    16759 Matchmaker 0.pdb, chain B (#1) with 96.2.pdb, chain A (#482), sequence
    16760 alignment score = 1671.7 
    16761 RMSD between 239 pruned atom pairs is 0.992 angstroms; (across all 330 pairs:
    16762 2.794) 
    16763  
    16764 Matchmaker 0.pdb, chain B (#1) with 96.4.pdb, chain B (#483), sequence
    16765 alignment score = 1669.3 
    16766 RMSD between 247 pruned atom pairs is 1.102 angstroms; (across all 330 pairs:
    16767 4.728) 
    16768  
    16769 Matchmaker 0.pdb, chain B (#1) with 96.6.pdb, chain A (#484), sequence
    16770 alignment score = 1671.1 
    16771 RMSD between 234 pruned atom pairs is 0.954 angstroms; (across all 330 pairs:
    16772 2.722) 
    16773  
    16774 Matchmaker 0.pdb, chain B (#1) with 96.8.pdb, chain A (#485), sequence
    16775 alignment score = 1657.9 
    16776 RMSD between 227 pruned atom pairs is 1.060 angstroms; (across all 330 pairs:
    16777 2.597) 
    16778  
    16779 Matchmaker 0.pdb, chain B (#1) with 97.0.pdb, chain B (#486), sequence
    16780 alignment score = 1671.7 
    16781 RMSD between 220 pruned atom pairs is 1.029 angstroms; (across all 330 pairs:
    16782 5.616) 
    16783  
    16784 Matchmaker 0.pdb, chain B (#1) with 97.2.pdb, chain A (#487), sequence
    16785 alignment score = 1675.3 
    16786 RMSD between 219 pruned atom pairs is 0.998 angstroms; (across all 330 pairs:
    16787 2.699) 
    16788  
    16789 Matchmaker 0.pdb, chain B (#1) with 97.4.pdb, chain B (#488), sequence
    16790 alignment score = 1674.7 
    16791 RMSD between 209 pruned atom pairs is 1.083 angstroms; (across all 330 pairs:
    16792 7.129) 
    16793  
    16794 Matchmaker 0.pdb, chain B (#1) with 97.6.pdb, chain B (#489), sequence
    16795 alignment score = 1669.3 
    16796 RMSD between 226 pruned atom pairs is 1.042 angstroms; (across all 330 pairs:
    16797 6.547) 
    16798  
    16799 Matchmaker 0.pdb, chain B (#1) with 97.8.pdb, chain A (#490), sequence
    16800 alignment score = 1672.3 
    16801 RMSD between 224 pruned atom pairs is 1.081 angstroms; (across all 330 pairs:
    16802 2.779) 
    16803  
    16804 Matchmaker 0.pdb, chain B (#1) with 98.0.pdb, chain B (#491), sequence
    16805 alignment score = 1672.3 
    16806 RMSD between 214 pruned atom pairs is 1.043 angstroms; (across all 330 pairs:
    16807 5.949) 
    16808  
    16809 Matchmaker 0.pdb, chain B (#1) with 98.2.pdb, chain B (#492), sequence
    16810 alignment score = 1672.9 
    16811 RMSD between 202 pruned atom pairs is 1.040 angstroms; (across all 330 pairs:
    16812 6.306) 
    16813  
    16814 Matchmaker 0.pdb, chain B (#1) with 98.4.pdb, chain B (#493), sequence
    16815 alignment score = 1665.1 
    16816 RMSD between 215 pruned atom pairs is 0.959 angstroms; (across all 330 pairs:
    16817 6.080) 
    16818  
    16819 Matchmaker 0.pdb, chain B (#1) with 98.6.pdb, chain B (#494), sequence
    16820 alignment score = 1662.7 
    16821 RMSD between 216 pruned atom pairs is 0.974 angstroms; (across all 330 pairs:
    16822 6.215) 
    16823  
    16824 Matchmaker 0.pdb, chain A (#1) with 98.8.pdb, chain A (#495), sequence
    16825 alignment score = 1674.1 
    16826 RMSD between 237 pruned atom pairs is 1.023 angstroms; (across all 330 pairs:
    16827 2.907) 
    16828  
    16829 Matchmaker 0.pdb, chain B (#1) with 99.0.pdb, chain A (#496), sequence
    16830 alignment score = 1668.1 
    16831 RMSD between 229 pruned atom pairs is 0.987 angstroms; (across all 330 pairs:
    16832 3.138) 
    16833  
    16834 Matchmaker 0.pdb, chain B (#1) with 99.2.pdb, chain A (#497), sequence
    16835 alignment score = 1678.3 
    16836 RMSD between 214 pruned atom pairs is 0.978 angstroms; (across all 330 pairs:
    16837 4.116) 
    16838  
    16839 Matchmaker 0.pdb, chain B (#1) with 99.4.pdb, chain B (#498), sequence
    16840 alignment score = 1671.7 
    16841 RMSD between 215 pruned atom pairs is 0.919 angstroms; (across all 330 pairs:
    16842 5.701) 
    16843  
    16844 Matchmaker 0.pdb, chain B (#1) with 99.6.pdb, chain A (#499), sequence
    16845 alignment score = 1681.3 
    16846 RMSD between 220 pruned atom pairs is 0.933 angstroms; (across all 330 pairs:
    16847 4.143) 
    16848  
    16849 Matchmaker 0.pdb, chain B (#1) with 99.8.pdb, chain B (#500), sequence
    16850 alignment score = 1671.1 
    16851 RMSD between 215 pruned atom pairs is 0.957 angstroms; (across all 330 pairs:
    16852 5.949) 
    16853  
    16854 Matchmaker 0.pdb, chain B (#1) with 100.0.pdb, chain A (#501), sequence
    16855 alignment score = 1675.3 
    16856 RMSD between 196 pruned atom pairs is 0.876 angstroms; (across all 330 pairs:
    16857 3.534) 
    16858  
    16859 Matchmaker 0.pdb, chain B (#1) with 100.2.pdb, chain A (#502), sequence
    16860 alignment score = 1671.7 
    16861 RMSD between 219 pruned atom pairs is 0.931 angstroms; (across all 330 pairs:
    16862 3.836) 
    16863  
    16864 Matchmaker 0.pdb, chain B (#1) with 100.4.pdb, chain B (#503), sequence
    16865 alignment score = 1662.1 
    16866 RMSD between 208 pruned atom pairs is 0.933 angstroms; (across all 330 pairs:
    16867 7.571) 
    16868  
    16869 Matchmaker 0.pdb, chain B (#1) with 100.6.pdb, chain B (#504), sequence
    16870 alignment score = 1674.1 
    16871 RMSD between 215 pruned atom pairs is 0.952 angstroms; (across all 330 pairs:
    16872 6.961) 
    16873  
    16874 Matchmaker 0.pdb, chain B (#1) with 100.8.pdb, chain B (#505), sequence
    16875 alignment score = 1665.7 
    16876 RMSD between 221 pruned atom pairs is 0.924 angstroms; (across all 330 pairs:
    16877 5.929) 
    16878  
    16879 
    16880 > color protein gray
    16881 
    16882 > show :TIP3 atoms
    16883 
    16884 > transparency protein 95 cartoons
    16885 
    16886 > transparency :TIP3 50 atoms
    16887 
    16888 > select :POT
    16889 
    16890 208565 atoms, 3 pseudobonds, 208565 residues, 508 models selected 
    16891 
    16892 > color sel medium purple
    16893 
    16894 > transparency :POT 50 atoms
    16895 
    16896 > select :157-160,266-269
    16897 
    16898 121320 atoms, 121280 bonds, 8120 residues, 505 models selected 
    16899 
    16900 > show sel atoms
    16901 
    16902 > color sel byelement
    16903 
    16904 > hide sel cartoons
    16905 
    16906 > select intersect sideonly
    16907 
    16908 70700 atoms, 66660 bonds, 6060 residues, 505 models selected 
    16909 
    16910 > hide sel atoms
    16911 
    16912 > view orient
    16913 
    16914 > turn y 90
    16915 
    16916 > turn z 90
    16917 
    16918 > turn y 11
    16919 
    16920 > label :TIP3 attribute number offset -0.6,-0.3,0 height 0.3 font Arial
    16921 
    16922 > label :POT attribute number offset -0.6,-0.3,0
    16923 
    16924 > hide target m
    16925 
    16926 > zoom 8.0
    16927 
    16928 > move x -2
    16929 
    16930 > move y -10
    16931 
    16932 executed new_setting.cxc 
    16933 
    16934 > movie record
    16935 
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     787[deleted to fit within ticket limits]
    18620788> hide #281 models
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