Opened 15 months ago

Last modified 15 months ago

#15691 closed defect

ChimeraX bug report submission — at Initial Version

Reported by: chimerax-bug-report@… Owned by:
Priority: normal Milestone:
Component: Window Toolkit Version:
Keywords: Cc:
Blocked By: Blocking:
Notify when closed: Platform: all
Project: ChimeraX

Description

The following bug report has been submitted:
Platform:        macOS-11.6-arm64-arm-64bit
ChimeraX Version: 1.6.1 (2023-05-09 17:57:07 UTC)
Description
Last time you used ChimeraX it crashed.
Please describe steps that led to the crash here.
Process:               ChimeraX [68209]
Path:                  /Applications/ChimeraX-1.6.1.app/Contents/MacOS/ChimeraX
Identifier:            edu.ucsf.cgl.ChimeraX
Version:               1.6.1 (1.6.1.0)
Code Type:             ARM-64 (Native)
Parent Process:        ??? [1]
Responsible:           ChimeraX [68209]
User ID:               501

Date/Time:             2024-07-27 09:02:57.362 +0800
OS Version:            macOS 11.6 (20G165)
Report Version:        12
Anonymous UUID:        741F7448-3E61-1522-1CA4-8FCB78489E5F

Sleep/Wake UUID:       F2BC4221-A72B-4621-AFFD-FFDDA858389E

Time Awake Since Boot: 250000 seconds
Time Since Wake:       520 seconds

System Integrity Protection: enabled

Crashed Thread:        0  CrBrowserMain  Dispatch queue: com.apple.main-thread

Exception Type:        EXC_BREAKPOINT (SIGTRAP)
Exception Codes:       EXC_ARM_BREAKPOINT at 0x000000019a5e3cb0 (brk 1)
Exception Note:        EXC_CORPSE_NOTIFY

Termination Signal:    Trace/BPT trap: 5
Termination Reason:    Namespace SIGNAL, Code 0x5
Terminating Process:   exc handler [68209]

Application Specific Information:
Over-release of NSResponder or subclass.

Thread 0 Crashed:: CrBrowserMain  Dispatch queue: com.apple.main-thread
0   com.apple.AppKit              	0x000000019a5e3cb0 -[NSResponder release] + 324
1   com.apple.AppKit              	0x000000019a5e3cb0 -[NSResponder release] + 324
2   libobjc.A.dylib               	0x0000000197be680c AutoreleasePoolPage::releaseUntil(objc_object**) + 204
3   libobjc.A.dylib               	0x0000000197bc4e0c objc_autoreleasePoolPop + 212
4   com.apple.CoreFoundation      	0x0000000197de6ad4 _CFAutoreleasePoolPop + 32
5   com.apple.Foundation          	0x0000000198ba3d30 -[NSAutoreleasePool drain] + 136
6   QtCore                        	0x000000010f41ff30 QMacAutoReleasePool::~QMacAutoReleasePool() + 36
7   libqcocoa.dylib               	0x000000015f4cd86c 0x15f4b8000 + 88172
8   libqcocoa.dylib               	0x000000015f4ccff4 0x15f4b8000 + 86004
9   QtCore                        	0x000000010f2d62c0 QEventLoop::exec(QFlags) + 532
10  QtWidgets                     	0x000000011e220b20 QDialog::exec() + 476
11  QtWidgets.abi3.so             	0x000000010faa4510 meth_QDialog_exec(_object*, _object*) + 208
12  org.python.python             	0x0000000100b5f1dc cfunction_call + 172
13  org.python.python             	0x0000000100b1c870 _PyObject_MakeTpCall + 360
14  org.python.python             	0x0000000100bf2bc8 call_function + 512
15  org.python.python             	0x0000000100bf0208 _PyEval_EvalFrameDefault + 23108
16  org.python.python             	0x0000000100bf3a90 _PyEval_EvalCode + 2988
17  org.python.python             	0x0000000100b1cf80 _PyFunction_Vectorcall + 256
18  org.python.python             	0x0000000100bf2b68 call_function + 416
19  org.python.python             	0x0000000100bf0284 _PyEval_EvalFrameDefault + 23232
20  org.python.python             	0x0000000100bf3a90 _PyEval_EvalCode + 2988
21  org.python.python             	0x0000000100b1cf80 _PyFunction_Vectorcall + 256
22  org.python.python             	0x0000000100bf2b68 call_function + 416
23  org.python.python             	0x0000000100bf0300 _PyEval_EvalFrameDefault + 23356
24  org.python.python             	0x0000000100bf3a90 _PyEval_EvalCode + 2988
25  org.python.python             	0x0000000100b1cf80 _PyFunction_Vectorcall + 256
26  org.python.python             	0x0000000100bf2b68 call_function + 416
27  org.python.python             	0x0000000100bf0300 _PyEval_EvalFrameDefault + 23356
28  org.python.python             	0x0000000100bf3a90 _PyEval_EvalCode + 2988
29  org.python.python             	0x0000000100b1cf80 _PyFunction_Vectorcall + 256
30  org.python.python             	0x0000000100bf2b68 call_function + 416
31  org.python.python             	0x0000000100bf0208 _PyEval_EvalFrameDefault + 23108
32  org.python.python             	0x0000000100b1cffc function_code_fastcall + 112
33  org.python.python             	0x0000000100bf2b68 call_function + 416
34  org.python.python             	0x0000000100bf01e4 _PyEval_EvalFrameDefault + 23072
35  org.python.python             	0x0000000100b1cffc function_code_fastcall + 112
36  org.python.python             	0x0000000100bf2b68 call_function + 416
37  org.python.python             	0x0000000100bf01e4 _PyEval_EvalFrameDefault + 23072
38  org.python.python             	0x0000000100b1cffc function_code_fastcall + 112
39  org.python.python             	0x0000000100bf2b68 call_function + 416
40  org.python.python             	0x0000000100bf01e4 _PyEval_EvalFrameDefault + 23072
41  org.python.python             	0x0000000100bf3a90 _PyEval_EvalCode + 2988
42  org.python.python             	0x0000000100b1cf80 _PyFunction_Vectorcall + 256
43  org.python.python             	0x0000000100bf2b68 call_function + 416
44  org.python.python             	0x0000000100bf01e4 _PyEval_EvalFrameDefault + 23072
45  org.python.python             	0x0000000100b1cffc function_code_fastcall + 112
46  org.python.python             	0x0000000100bf2b68 call_function + 416
47  org.python.python             	0x0000000100bf01e4 _PyEval_EvalFrameDefault + 23072
48  org.python.python             	0x0000000100b1cffc function_code_fastcall + 112
49  org.python.python             	0x0000000100b1efd4 method_vectorcall + 284
50  QtCore.abi3.so                	0x000000010f032124 PyQtSlot::call(_object*, _object*) const + 68
51  QtCore.abi3.so                	0x000000010f031fac PyQtSlot::invoke(void**, _object*, void*, bool) const + 292
52  QtCore.abi3.so                	0x000000010f032fa0 PyQtSlotProxy::unislot(void**) + 92
53  QtCore.abi3.so                	0x000000010f032f10 PyQtSlotProxy::qt_metacall(QMetaObject::Call, int, void**) + 68
54  QtCore                        	0x000000010f316484 0x10f264000 + 730244
55  QtCore                        	0x000000010f329780 QTimer::timerEvent(QTimerEvent*) + 208
56  QtCore.abi3.so                	0x000000010ef13ad8 sipQTimer::timerEvent(QTimerEvent*) + 148
57  QtCore                        	0x000000010f30ecb4 QObject::event(QEvent*) + 88
58  QtCore.abi3.so                	0x000000010ef13924 sipQTimer::event(QEvent*) + 220
59  QtWidgets                     	0x000000011e00a710 QApplicationPrivate::notify_helper(QObject*, QEvent*) + 272
60  QtWidgets                     	0x000000011e00b6a8 QApplication::notify(QObject*, QEvent*) + 512
61  QtWidgets.abi3.so             	0x000000010f9a86b8 sipQApplication::notify(QObject*, QEvent*) + 248
62  QtCore                        	0x000000010f2cce9c QCoreApplication::notifyInternal2(QObject*, QEvent*) + 292
63  QtCore                        	0x000000010f433900 QTimerInfoList::activateTimers() + 948
64  libqcocoa.dylib               	0x000000015f4cc600 0x15f4b8000 + 83456
65  com.apple.CoreFoundation      	0x0000000197e29694 __CFRUNLOOP_IS_CALLING_OUT_TO_A_SOURCE0_PERFORM_FUNCTION__ + 28
66  com.apple.CoreFoundation      	0x0000000197e295e0 __CFRunLoopDoSource0 + 208
67  com.apple.CoreFoundation      	0x0000000197e29338 __CFRunLoopDoSources0 + 376
68  com.apple.CoreFoundation      	0x0000000197e27c54 __CFRunLoopRun + 820
69  com.apple.CoreFoundation      	0x0000000197e271a8 CFRunLoopRunSpecific + 600
70  com.apple.HIToolbox           	0x000000019fd4cb40 RunCurrentEventLoopInMode + 292
71  com.apple.HIToolbox           	0x000000019fd4c7cc ReceiveNextEventCommon + 320
72  com.apple.HIToolbox           	0x000000019fd4c674 _BlockUntilNextEventMatchingListInModeWithFilter + 72
73  com.apple.AppKit              	0x000000019a619660 _DPSNextEvent + 836
74  com.apple.AppKit              	0x000000019a618000 -[NSApplication(NSEvent) _nextEventMatchingEventMask:untilDate:inMode:dequeue:] + 1292
75  com.apple.AppKit              	0x000000019a609e4c -[NSApplication run] + 596
76  libqcocoa.dylib               	0x000000015f4cd010 0x15f4b8000 + 86032
77  QtCore                        	0x000000010f2d62c0 QEventLoop::exec(QFlags) + 532
78  QtCore                        	0x000000010f2cd538 QCoreApplication::exec() + 128
79  QtWidgets.abi3.so             	0x000000010faadeac meth_QApplication_exec(_object*, _object*) + 96
80  org.python.python             	0x0000000100b5f1dc cfunction_call + 172
81  org.python.python             	0x0000000100b1c870 _PyObject_MakeTpCall + 360
82  org.python.python             	0x0000000100bf2bc8 call_function + 512
83  org.python.python             	0x0000000100bf0208 _PyEval_EvalFrameDefault + 23108
84  org.python.python             	0x0000000100b1cffc function_code_fastcall + 112
85  org.python.python             	0x0000000100b1ef60 method_vectorcall + 168
86  org.python.python             	0x0000000100bf2b68 call_function + 416
87  org.python.python             	0x0000000100bf0208 _PyEval_EvalFrameDefault + 23108
88  org.python.python             	0x0000000100bf3a90 _PyEval_EvalCode + 2988
89  org.python.python             	0x0000000100b1cf80 _PyFunction_Vectorcall + 256
90  org.python.python             	0x0000000100bf2b68 call_function + 416
91  org.python.python             	0x0000000100bf0284 _PyEval_EvalFrameDefault + 23232
92  org.python.python             	0x0000000100bf3a90 _PyEval_EvalCode + 2988
93  org.python.python             	0x0000000100bea6fc PyEval_EvalCode + 80
94  org.python.python             	0x0000000100be74a4 builtin_exec + 672
95  org.python.python             	0x0000000100b5e98c cfunction_vectorcall_FASTCALL + 232
96  org.python.python             	0x0000000100bf2b68 call_function + 416
97  org.python.python             	0x0000000100bf0284 _PyEval_EvalFrameDefault + 23232
98  org.python.python             	0x0000000100bf3a90 _PyEval_EvalCode + 2988
99  org.python.python             	0x0000000100b1cf80 _PyFunction_Vectorcall + 256
100 org.python.python             	0x0000000100bf2b68 call_function + 416
101 org.python.python             	0x0000000100bf0284 _PyEval_EvalFrameDefault + 23232
102 org.python.python             	0x0000000100bf3a90 _PyEval_EvalCode + 2988
103 org.python.python             	0x0000000100b1cf80 _PyFunction_Vectorcall + 256
104 org.python.python             	0x0000000100c4dea4 pymain_run_module + 200
105 org.python.python             	0x0000000100c4d4e8 Py_RunMain + 764
106 org.python.python             	0x0000000100c4dd54 pymain_main + 340
107 org.python.python             	0x0000000100c4dbf4 Py_Main + 36
108 edu.ucsf.cgl.ChimeraX         	0x000000010070bd54 main + 128
109 libdyld.dylib                 	0x0000000197d49430 start + 4

Thread 1:
0   libsystem_kernel.dylib        	0x0000000197cf4548 __psynch_cvwait + 8
1   libsystem_pthread.dylib       	0x0000000197d2bdac _pthread_cond_wait + 1248
2   libopenblas64_.0.dylib        	0x0000000103d2db60 blas_thread_server + 360
3   libsystem_pthread.dylib       	0x0000000197d2b878 _pthread_start + 320
4   libsystem_pthread.dylib       	0x0000000197d265e0 thread_start + 8

Thread 2:
0   libsystem_kernel.dylib        	0x0000000197cf4548 __psynch_cvwait + 8
1   libsystem_pthread.dylib       	0x0000000197d2bdac _pthread_cond_wait + 1248
2   libopenblas64_.0.dylib        	0x0000000103d2db60 blas_thread_server + 360
3   libsystem_pthread.dylib       	0x0000000197d2b878 _pthread_start + 320
4   libsystem_pthread.dylib       	0x0000000197d265e0 thread_start + 8

Thread 3:
0   libsystem_kernel.dylib        	0x0000000197cf4548 __psynch_cvwait + 8
1   libsystem_pthread.dylib       	0x0000000197d2bdac _pthread_cond_wait + 1248
2   libopenblas64_.0.dylib        	0x0000000103d2db60 blas_thread_server + 360
3   libsystem_pthread.dylib       	0x0000000197d2b878 _pthread_start + 320
4   libsystem_pthread.dylib       	0x0000000197d265e0 thread_start + 8

Thread 4:
0   libsystem_kernel.dylib        	0x0000000197cf4548 __psynch_cvwait + 8
1   libsystem_pthread.dylib       	0x0000000197d2bdac _pthread_cond_wait + 1248
2   libopenblas64_.0.dylib        	0x0000000103d2db60 blas_thread_server + 360
3   libsystem_pthread.dylib       	0x0000000197d2b878 _pthread_start + 320
4   libsystem_pthread.dylib       	0x0000000197d265e0 thread_start + 8

Thread 5:
0   libsystem_kernel.dylib        	0x0000000197cf4548 __psynch_cvwait + 8
1   libsystem_pthread.dylib       	0x0000000197d2bdac _pthread_cond_wait + 1248
2   libopenblas64_.0.dylib        	0x0000000103d2db60 blas_thread_server + 360
3   libsystem_pthread.dylib       	0x0000000197d2b878 _pthread_start + 320
4   libsystem_pthread.dylib       	0x0000000197d265e0 thread_start + 8

Thread 6:
0   libsystem_kernel.dylib        	0x0000000197cf4548 __psynch_cvwait + 8
1   libsystem_pthread.dylib       	0x0000000197d2bdac _pthread_cond_wait + 1248
2   libopenblas64_.0.dylib        	0x0000000103d2db60 blas_thread_server + 360
3   libsystem_pthread.dylib       	0x0000000197d2b878 _pthread_start + 320
4   libsystem_pthread.dylib       	0x0000000197d265e0 thread_start + 8

Thread 7:
0   libsystem_kernel.dylib        	0x0000000197cf4548 __psynch_cvwait + 8
1   libsystem_pthread.dylib       	0x0000000197d2bdac _pthread_cond_wait + 1248
2   libopenblas64_.0.dylib        	0x0000000103d2db60 blas_thread_server + 360
3   libsystem_pthread.dylib       	0x0000000197d2b878 _pthread_start + 320
4   libsystem_pthread.dylib       	0x0000000197d265e0 thread_start + 8

Thread 8:: ThreadPoolServiceThread
0   libsystem_kernel.dylib        	0x0000000197cfbee8 kevent64 + 8
1   QtWebEngineCore               	0x0000000157fbdb50 0x154478000 + 62151504
2   QtWebEngineCore               	0x0000000157fbd9f0 0x154478000 + 62151152
3   QtWebEngineCore               	0x0000000157f659ec 0x154478000 + 61790700
4   QtWebEngineCore               	0x0000000157f27490 0x154478000 + 61535376
5   QtWebEngineCore               	0x0000000157f88514 0x154478000 + 61932820
6   QtWebEngineCore               	0x0000000157f70778 0x154478000 + 61835128
7   QtWebEngineCore               	0x0000000157f8868c 0x154478000 + 61933196
8   QtWebEngineCore               	0x0000000157fb17a8 0x154478000 + 62101416
9   libsystem_pthread.dylib       	0x0000000197d2b878 _pthread_start + 320
10  libsystem_pthread.dylib       	0x0000000197d265e0 thread_start + 8

Thread 9:: Chrome_IOThread
0   libsystem_kernel.dylib        	0x0000000197cfbee8 kevent64 + 8
1   QtWebEngineCore               	0x0000000157fbdb50 0x154478000 + 62151504
2   QtWebEngineCore               	0x0000000157fbd9f0 0x154478000 + 62151152
3   QtWebEngineCore               	0x0000000157f659ec 0x154478000 + 61790700
4   QtWebEngineCore               	0x0000000157f27490 0x154478000 + 61535376
5   QtWebEngineCore               	0x0000000157f88514 0x154478000 + 61932820
6   QtWebEngineCore               	0x0000000155c84000 0x154478000 + 25214976
7   QtWebEngineCore               	0x0000000157f8868c 0x154478000 + 61933196
8   QtWebEngineCore               	0x0000000157fb17a8 0x154478000 + 62101416
9   libsystem_pthread.dylib       	0x0000000197d2b878 _pthread_start + 320
10  libsystem_pthread.dylib       	0x0000000197d265e0 thread_start + 8

Thread 10:: NetworkConfigWatcher
0   libsystem_kernel.dylib        	0x0000000197cf0dd4 mach_msg_trap + 8
1   libsystem_kernel.dylib        	0x0000000197cf1184 mach_msg + 76
2   QtWebEngineCore               	0x0000000157fb786c 0x154478000 + 62126188
3   QtWebEngineCore               	0x0000000157fb7658 0x154478000 + 62125656
4   QtWebEngineCore               	0x0000000157ef81d4 0x154478000 + 61342164
5   QtWebEngineCore               	0x0000000157f659ec 0x154478000 + 61790700
6   QtWebEngineCore               	0x0000000157f27490 0x154478000 + 61535376
7   QtWebEngineCore               	0x0000000157f88514 0x154478000 + 61932820
8   QtWebEngineCore               	0x0000000157f8868c 0x154478000 + 61933196
9   QtWebEngineCore               	0x0000000157fb17a8 0x154478000 + 62101416
10  libsystem_pthread.dylib       	0x0000000197d2b878 _pthread_start + 320
11  libsystem_pthread.dylib       	0x0000000197d265e0 thread_start + 8

Thread 11:: ThreadPoolForegroundWorker
0   libsystem_kernel.dylib        	0x0000000197cf0dd4 mach_msg_trap + 8
1   libsystem_kernel.dylib        	0x0000000197cf1184 mach_msg + 76
2   QtWebEngineCore               	0x0000000157fb786c 0x154478000 + 62126188
3   QtWebEngineCore               	0x0000000157f7c2ec 0x154478000 + 61883116
4   QtWebEngineCore               	0x0000000157f7cdf8 0x154478000 + 61885944
5   QtWebEngineCore               	0x0000000157f7c990 0x154478000 + 61884816
6   QtWebEngineCore               	0x0000000157fb17a8 0x154478000 + 62101416
7   libsystem_pthread.dylib       	0x0000000197d2b878 _pthread_start + 320
8   libsystem_pthread.dylib       	0x0000000197d265e0 thread_start + 8

Thread 12:: Chrome_InProcGpuThread
0   libsystem_kernel.dylib        	0x0000000197cf0dd4 mach_msg_trap + 8
1   libsystem_kernel.dylib        	0x0000000197cf1184 mach_msg + 76
2   QtWebEngineCore               	0x0000000157fb786c 0x154478000 + 62126188
3   QtWebEngineCore               	0x0000000157fb7658 0x154478000 + 62125656
4   QtWebEngineCore               	0x0000000157ef81d4 0x154478000 + 61342164
5   QtWebEngineCore               	0x0000000157f659ec 0x154478000 + 61790700
6   QtWebEngineCore               	0x0000000157f27490 0x154478000 + 61535376
7   QtWebEngineCore               	0x0000000157f88514 0x154478000 + 61932820
8   QtWebEngineCore               	0x0000000157f8868c 0x154478000 + 61933196
9   QtWebEngineCore               	0x0000000157fb17a8 0x154478000 + 62101416
10  libsystem_pthread.dylib       	0x0000000197d2b878 _pthread_start + 320
11  libsystem_pthread.dylib       	0x0000000197d265e0 thread_start + 8

Thread 13:: Chrome_ChildIOThread
0   libsystem_kernel.dylib        	0x0000000197cfbee8 kevent64 + 8
1   QtWebEngineCore               	0x0000000157fbdb50 0x154478000 + 62151504
2   QtWebEngineCore               	0x0000000157fbd9f0 0x154478000 + 62151152
3   QtWebEngineCore               	0x0000000157f659ec 0x154478000 + 61790700
4   QtWebEngineCore               	0x0000000157f27490 0x154478000 + 61535376
5   QtWebEngineCore               	0x0000000157f88514 0x154478000 + 61932820
6   QtWebEngineCore               	0x000000015a5defd4 0x154478000 + 102133716
7   QtWebEngineCore               	0x0000000157f8868c 0x154478000 + 61933196
8   QtWebEngineCore               	0x0000000157fb17a8 0x154478000 + 62101416
9   libsystem_pthread.dylib       	0x0000000197d2b878 _pthread_start + 320
10  libsystem_pthread.dylib       	0x0000000197d265e0 thread_start + 8

Thread 14:: CompositorTileWorker1
0   libsystem_kernel.dylib        	0x0000000197cf4548 __psynch_cvwait + 8
1   libsystem_pthread.dylib       	0x0000000197d2bdac _pthread_cond_wait + 1248
2   QtWebEngineCore               	0x0000000157fb0344 0x154478000 + 62096196
3   QtWebEngineCore               	0x0000000159cff6a8 0x154478000 + 92829352
4   QtWebEngineCore               	0x0000000157fb17a8 0x154478000 + 62101416
5   libsystem_pthread.dylib       	0x0000000197d2b878 _pthread_start + 320
6   libsystem_pthread.dylib       	0x0000000197d265e0 thread_start + 8

Thread 15:: ThreadPoolSingleThreadSharedForeground0
0   libsystem_kernel.dylib        	0x0000000197cf0dd4 mach_msg_trap + 8
1   libsystem_kernel.dylib        	0x0000000197cf1184 mach_msg + 76
2   QtWebEngineCore               	0x0000000157fb786c 0x154478000 + 62126188
3   QtWebEngineCore               	0x0000000157f7c2ec 0x154478000 + 61883116
4   QtWebEngineCore               	0x0000000157f7cdf8 0x154478000 + 61885944
5   QtWebEngineCore               	0x0000000157f7c9bc 0x154478000 + 61884860
6   QtWebEngineCore               	0x0000000157fb17a8 0x154478000 + 62101416
7   libsystem_pthread.dylib       	0x0000000197d2b878 _pthread_start + 320
8   libsystem_pthread.dylib       	0x0000000197d265e0 thread_start + 8

Thread 16:: NetworkConfigWatcher
0   libsystem_kernel.dylib        	0x0000000197cf0dd4 mach_msg_trap + 8
1   libsystem_kernel.dylib        	0x0000000197cf1184 mach_msg + 76
2   QtWebEngineCore               	0x0000000157fb786c 0x154478000 + 62126188
3   QtWebEngineCore               	0x0000000157fb7658 0x154478000 + 62125656
4   QtWebEngineCore               	0x0000000157ef81d4 0x154478000 + 61342164
5   QtWebEngineCore               	0x0000000157f659ec 0x154478000 + 61790700
6   QtWebEngineCore               	0x0000000157f27490 0x154478000 + 61535376
7   QtWebEngineCore               	0x0000000157f88514 0x154478000 + 61932820
8   QtWebEngineCore               	0x0000000157f8868c 0x154478000 + 61933196
9   QtWebEngineCore               	0x0000000157fb17a8 0x154478000 + 62101416
10  libsystem_pthread.dylib       	0x0000000197d2b878 _pthread_start + 320
11  libsystem_pthread.dylib       	0x0000000197d265e0 thread_start + 8

Thread 17:: VizCompositorThread
0   libsystem_kernel.dylib        	0x0000000197cf0dd4 mach_msg_trap + 8
1   libsystem_kernel.dylib        	0x0000000197cf1184 mach_msg + 76
2   QtWebEngineCore               	0x0000000157fb786c 0x154478000 + 62126188
3   QtWebEngineCore               	0x0000000157fb7658 0x154478000 + 62125656
4   QtWebEngineCore               	0x0000000157ef81d4 0x154478000 + 61342164
5   QtWebEngineCore               	0x0000000157f659ec 0x154478000 + 61790700
6   QtWebEngineCore               	0x0000000157f27490 0x154478000 + 61535376
7   QtWebEngineCore               	0x0000000157f88514 0x154478000 + 61932820
8   QtWebEngineCore               	0x0000000157f8868c 0x154478000 + 61933196
9   QtWebEngineCore               	0x0000000157fb17a8 0x154478000 + 62101416
10  libsystem_pthread.dylib       	0x0000000197d2b878 _pthread_start + 320
11  libsystem_pthread.dylib       	0x0000000197d265e0 thread_start + 8

Thread 18:: NetworkService
0   libsystem_kernel.dylib        	0x0000000197cfbee8 kevent64 + 8
1   QtWebEngineCore               	0x0000000157fbdb50 0x154478000 + 62151504
2   QtWebEngineCore               	0x0000000157fbd9f0 0x154478000 + 62151152
3   QtWebEngineCore               	0x0000000157f659ec 0x154478000 + 61790700
4   QtWebEngineCore               	0x0000000157f27490 0x154478000 + 61535376
5   QtWebEngineCore               	0x0000000157f88514 0x154478000 + 61932820
6   QtWebEngineCore               	0x0000000157f8868c 0x154478000 + 61933196
7   QtWebEngineCore               	0x0000000157fb17a8 0x154478000 + 62101416
8   libsystem_pthread.dylib       	0x0000000197d2b878 _pthread_start + 320
9   libsystem_pthread.dylib       	0x0000000197d265e0 thread_start + 8

Thread 19:: NetworkConfigWatcher
0   libsystem_kernel.dylib        	0x0000000197cf0dd4 mach_msg_trap + 8
1   libsystem_kernel.dylib        	0x0000000197cf1184 mach_msg + 76
2   QtWebEngineCore               	0x0000000157fb786c 0x154478000 + 62126188
3   QtWebEngineCore               	0x0000000157fb7658 0x154478000 + 62125656
4   QtWebEngineCore               	0x0000000157ef81d4 0x154478000 + 61342164
5   QtWebEngineCore               	0x0000000157f659ec 0x154478000 + 61790700
6   QtWebEngineCore               	0x0000000157f27490 0x154478000 + 61535376
7   QtWebEngineCore               	0x0000000157f88514 0x154478000 + 61932820
8   QtWebEngineCore               	0x0000000157f8868c 0x154478000 + 61933196
9   QtWebEngineCore               	0x0000000157fb17a8 0x154478000 + 62101416
10  libsystem_pthread.dylib       	0x0000000197d2b878 _pthread_start + 320
11  libsystem_pthread.dylib       	0x0000000197d265e0 thread_start + 8

Thread 20:: ThreadPoolSingleThreadForegroundBlocking1
0   libsystem_kernel.dylib        	0x0000000197cf0dd4 mach_msg_trap + 8
1   libsystem_kernel.dylib        	0x0000000197cf1184 mach_msg + 76
2   QtWebEngineCore               	0x0000000157fb786c 0x154478000 + 62126188
3   QtWebEngineCore               	0x0000000157f7c2ec 0x154478000 + 61883116
4   QtWebEngineCore               	0x0000000157f7cdf8 0x154478000 + 61885944
5   QtWebEngineCore               	0x0000000157f7c9e8 0x154478000 + 61884904
6   QtWebEngineCore               	0x0000000157fb17a8 0x154478000 + 62101416
7   libsystem_pthread.dylib       	0x0000000197d2b878 _pthread_start + 320
8   libsystem_pthread.dylib       	0x0000000197d265e0 thread_start + 8

Thread 21:: NetworkConfigWatcher
0   libsystem_kernel.dylib        	0x0000000197cf0dd4 mach_msg_trap + 8
1   libsystem_kernel.dylib        	0x0000000197cf1184 mach_msg + 76
2   QtWebEngineCore               	0x0000000157fb786c 0x154478000 + 62126188
3   QtWebEngineCore               	0x0000000157fb7658 0x154478000 + 62125656
4   QtWebEngineCore               	0x0000000157ef81d4 0x154478000 + 61342164
5   QtWebEngineCore               	0x0000000157f659ec 0x154478000 + 61790700
6   QtWebEngineCore               	0x0000000157f27490 0x154478000 + 61535376
7   QtWebEngineCore               	0x0000000157f88514 0x154478000 + 61932820
8   QtWebEngineCore               	0x0000000157f8868c 0x154478000 + 61933196
9   QtWebEngineCore               	0x0000000157fb17a8 0x154478000 + 62101416
10  libsystem_pthread.dylib       	0x0000000197d2b878 _pthread_start + 320
11  libsystem_pthread.dylib       	0x0000000197d265e0 thread_start + 8

Thread 22:: ThreadPoolBackgroundWorker
0   libsystem_kernel.dylib        	0x0000000197cf0dd4 mach_msg_trap + 8
1   libsystem_kernel.dylib        	0x0000000197cf1184 mach_msg + 76
2   QtWebEngineCore               	0x0000000157fb786c 0x154478000 + 62126188
3   QtWebEngineCore               	0x0000000157f7c2ec 0x154478000 + 61883116
4   QtWebEngineCore               	0x0000000157f7cdf8 0x154478000 + 61885944
5   QtWebEngineCore               	0x0000000157f7c90c 0x154478000 + 61884684
6   QtWebEngineCore               	0x0000000157fb17a8 0x154478000 + 62101416
7   libsystem_pthread.dylib       	0x0000000197d2b878 _pthread_start + 320
8   libsystem_pthread.dylib       	0x0000000197d265e0 thread_start + 8

Thread 23:: MemoryInfra
0   libsystem_kernel.dylib        	0x0000000197cf0dd4 mach_msg_trap + 8
1   libsystem_kernel.dylib        	0x0000000197cf1184 mach_msg + 76
2   QtWebEngineCore               	0x0000000157fb786c 0x154478000 + 62126188
3   QtWebEngineCore               	0x0000000157fb7658 0x154478000 + 62125656
4   QtWebEngineCore               	0x0000000157ef81d4 0x154478000 + 61342164
5   QtWebEngineCore               	0x0000000157f659ec 0x154478000 + 61790700
6   QtWebEngineCore               	0x0000000157f27490 0x154478000 + 61535376
7   QtWebEngineCore               	0x0000000157f88514 0x154478000 + 61932820
8   QtWebEngineCore               	0x0000000157f8868c 0x154478000 + 61933196
9   QtWebEngineCore               	0x0000000157fb17a8 0x154478000 + 62101416
10  libsystem_pthread.dylib       	0x0000000197d2b878 _pthread_start + 320
11  libsystem_pthread.dylib       	0x0000000197d265e0 thread_start + 8

Thread 24:: ThreadPoolSingleThreadSharedBackgroundBlocking2
0   libsystem_kernel.dylib        	0x0000000197cf0dd4 mach_msg_trap + 8
1   libsystem_kernel.dylib        	0x0000000197cf1184 mach_msg + 76
2   QtWebEngineCore               	0x0000000157fb786c 0x154478000 + 62126188
3   QtWebEngineCore               	0x0000000157f7c2ec 0x154478000 + 61883116
4   QtWebEngineCore               	0x0000000157f7cb04 0x154478000 + 61885188
5   QtWebEngineCore               	0x0000000157f7c938 0x154478000 + 61884728
6   QtWebEngineCore               	0x0000000157fb17a8 0x154478000 + 62101416
7   libsystem_pthread.dylib       	0x0000000197d2b878 _pthread_start + 320
8   libsystem_pthread.dylib       	0x0000000197d265e0 thread_start + 8

Thread 25:: com.apple.NSEventThread
0   libsystem_kernel.dylib        	0x0000000197cf0dd4 mach_msg_trap + 8
1   libsystem_kernel.dylib        	0x0000000197cf1184 mach_msg + 76
2   com.apple.CoreFoundation      	0x0000000197e29910 __CFRunLoopServiceMachPort + 372
3   com.apple.CoreFoundation      	0x0000000197e27ddc __CFRunLoopRun + 1212
4   com.apple.CoreFoundation      	0x0000000197e271a8 CFRunLoopRunSpecific + 600
5   com.apple.AppKit              	0x000000019a798334 _NSEventThread + 196
6   libsystem_pthread.dylib       	0x0000000197d2b878 _pthread_start + 320
7   libsystem_pthread.dylib       	0x0000000197d265e0 thread_start + 8

Thread 26:
0   libsystem_pthread.dylib       	0x0000000197d265cc start_wqthread + 0

Thread 27:: Dispatch queue: NSCGSDisableUpdates
0   libsystem_kernel.dylib        	0x0000000197cf0e28 semaphore_timedwait_trap + 8
1   libdispatch.dylib             	0x0000000197b7c4a4 _dispatch_sema4_timedwait + 64
2   libdispatch.dylib             	0x0000000197b7cab4 _dispatch_semaphore_wait_slow + 76
3   com.apple.SkyLight            	0x000000019c6420e0 CGSUpdateManager::enable_updates_common() + 964
4   com.apple.SkyLight            	0x000000019c642c3c SLSReenableUpdateTokenWithSeed + 124
5   libdispatch.dylib             	0x0000000197b7a128 _dispatch_call_block_and_release + 32
6   libdispatch.dylib             	0x0000000197b7bec0 _dispatch_client_callout + 20
7   libdispatch.dylib             	0x0000000197b836a8 _dispatch_lane_serial_drain + 620
8   libdispatch.dylib             	0x0000000197b842a4 _dispatch_lane_invoke + 404
9   libdispatch.dylib             	0x0000000197b8eb74 _dispatch_workloop_worker_thread + 764
10  libsystem_pthread.dylib       	0x0000000197d2789c _pthread_wqthread + 276
11  libsystem_pthread.dylib       	0x0000000197d265d4 start_wqthread + 8

Thread 28:: Dispatch queue: com.apple.SkyLight.UpdateManager.SerialSema
0   libsystem_kernel.dylib        	0x0000000197cf0e10 semaphore_wait_trap + 8
1   com.apple.SkyLight            	0x000000019c6422b4 invocation function for block in (anonymous namespace)::InterprocessSerialSemaphore::asyncWait(void (int) block_pointer) + 40
2   libdispatch.dylib             	0x0000000197b7a128 _dispatch_call_block_and_release + 32
3   libdispatch.dylib             	0x0000000197b7bec0 _dispatch_client_callout + 20
4   libdispatch.dylib             	0x0000000197b836a8 _dispatch_lane_serial_drain + 620
5   libdispatch.dylib             	0x0000000197b842a4 _dispatch_lane_invoke + 404
6   libdispatch.dylib             	0x0000000197b8eb74 _dispatch_workloop_worker_thread + 764
7   libsystem_pthread.dylib       	0x0000000197d2789c _pthread_wqthread + 276
8   libsystem_pthread.dylib       	0x0000000197d265d4 start_wqthread + 8

Thread 29:: Thread (pooled)
0   libsystem_kernel.dylib        	0x0000000197cf4548 __psynch_cvwait + 8
1   libsystem_pthread.dylib       	0x0000000197d2bdac _pthread_cond_wait + 1248
2   QtCore                        	0x000000010f43ebe8 0x10f264000 + 1944552
3   QtCore                        	0x000000010f43e8a0 0x10f264000 + 1943712
4   QtCore                        	0x000000010f43e7cc QWaitCondition::wait(QMutex*, QDeadlineTimer) + 108
5   QtCore                        	0x000000010f438d98 0x10f264000 + 1920408
6   QtCore                        	0x000000010f434ad0 0x10f264000 + 1903312
7   libsystem_pthread.dylib       	0x0000000197d2b878 _pthread_start + 320
8   libsystem_pthread.dylib       	0x0000000197d265e0 thread_start + 8

Thread 30:: Thread (pooled)
0   libsystem_kernel.dylib        	0x0000000197cf4548 __psynch_cvwait + 8
1   libsystem_pthread.dylib       	0x0000000197d2bdac _pthread_cond_wait + 1248
2   QtCore                        	0x000000010f43ebe8 0x10f264000 + 1944552
3   QtCore                        	0x000000010f43e8a0 0x10f264000 + 1943712
4   QtCore                        	0x000000010f43e7cc QWaitCondition::wait(QMutex*, QDeadlineTimer) + 108
5   QtCore                        	0x000000010f438d98 0x10f264000 + 1920408
6   QtCore                        	0x000000010f434ad0 0x10f264000 + 1903312
7   libsystem_pthread.dylib       	0x0000000197d2b878 _pthread_start + 320
8   libsystem_pthread.dylib       	0x0000000197d265e0 thread_start + 8

Thread 31:
0   libsystem_pthread.dylib       	0x0000000197d265cc start_wqthread + 0

Thread 32:
0   libsystem_pthread.dylib       	0x0000000197d265cc start_wqthread + 0

Thread 33:: Thread (pooled)
0   libsystem_kernel.dylib        	0x0000000197cf4548 __psynch_cvwait + 8
1   libsystem_pthread.dylib       	0x0000000197d2bdac _pthread_cond_wait + 1248
2   QtCore                        	0x000000010f43ebe8 0x10f264000 + 1944552
3   QtCore                        	0x000000010f43e8a0 0x10f264000 + 1943712
4   QtCore                        	0x000000010f43e7cc QWaitCondition::wait(QMutex*, QDeadlineTimer) + 108
5   QtCore                        	0x000000010f438d98 0x10f264000 + 1920408
6   QtCore                        	0x000000010f434ad0 0x10f264000 + 1903312
7   libsystem_pthread.dylib       	0x0000000197d2b878 _pthread_start + 320
8   libsystem_pthread.dylib       	0x0000000197d265e0 thread_start + 8

Thread 0 crashed with ARM Thread State (64-bit):
    x0: 0x0000000000000000   x1: 0x0000000000000000   x2: 0x0000000000000000   x3: 0x0000000000000000
    x4: 0x0000000000000000   x5: 0x0000000000000000   x6: 0x0000000000000000   x7: 0x0000000000000000
    x8: 0x0000000000000000   x9: 0x00000002031810b0  x10: 0x0000020000000202  x11: 0x00000000fffffffd
   x12: 0x0000010000000000  x13: 0x0000000000000200  x14: 0x0000020000000000  x15: 0x0000000000000000
   x16: 0x0000000000000001  x17: 0x0000020000000202  x18: 0x000000049c0b3940  x19: 0x0000000295334f20
   x20: 0x000000010314ff58  x21: 0x0000000295334f20  x22: 0x00000000a1a1a1a1  x23: 0x0000000100a8be20
   x24: 0xa3a3a3a3a3a3a3a3  x25: 0x0000000000000001  x26: 0x000060000352fb30  x27: 0x000060000352fb10
   x28: 0x000060000352fb30   fp: 0x000000016f6f2530   lr: 0xae1e80019a5e3cb0
    sp: 0x000000016f6f2520   pc: 0x000000019a5e3cb0 cpsr: 0x60000000
   far: 0x000000016fc78000  esr: 0xf2000001


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External Modification Summary:
  Calls made by other processes targeting this process:
    task_for_pid: 0
    thread_create: 0
    thread_set_state: 0
  Calls made by this process:
    task_for_pid: 0
    thread_create: 0
    thread_set_state: 0
  Calls made by all processes on this machine:
    task_for_pid: 1
    thread_create: 0
    thread_set_state: 0

VM Region Summary:
ReadOnly portion of Libraries: Total=1.1G resident=0K(0%) swapped_out_or_unallocated=1.1G(100%)
Writable regions: Total=90.7G written=0K(0%) resident=0K(0%) swapped_out=0K(0%) unallocated=90.7G(100%)
 
                                VIRTUAL   REGION 
REGION TYPE                        SIZE    COUNT (non-coalesced) 
===========                     =======  ======= 
Accelerate framework               128K        1 
Activity Tracing                   256K        1 
CG backing stores                 5088K        6 
CG image                           192K        8 
CoreAnimation                      192K       12 
CoreGraphics                        32K        2 
CoreUI image data                 2496K       18 
Foundation                          16K        1 
Kernel Alloc Once                   32K        1 
MALLOC                            88.2G     1487 
MALLOC guard page                  192K       10 
MALLOC_MEDIUM (reserved)         808.0M        8         reserved VM address space (unallocated)
Mach message                        64K        3 
OpenGL GLSL                        384K        4 
STACK GUARD                       56.5M       34 
Stack                            152.8M       34 
VM_ALLOCATE                        1.4G     5497 
VM_ALLOCATE (reserved)           160.0M        2         reserved VM address space (unallocated)
__AUTH                            1018K      259 
__AUTH_CONST                      15.0M      450 
__DATA                            18.4M      588 
__DATA_CONST                      25.5M      591 
__DATA_DIRTY                      1799K      208 
__FONT_DATA                          4K        1 
__GLSLBUILTINS                    5176K        1 
__LINKEDIT                       518.7M      150 
__OBJC_CONST                      3269K      250 
__OBJC_RO                         75.1M        1 
__OBJC_RW                         2576K        1 
__TEXT                           580.5M      612 
__UNICODE                          588K        1 
mapped file                      590.3M       63 
shared memory                     3104K       20 
===========                     =======  ======= 
TOTAL                             92.6G    10325 
TOTAL, minus reserved VM space    91.6G    10325 



Log:
Startup Messages  
---  
warning | Replacing fetcher for 'pdb_nmr' and format NMRSTAR from NMRSTAR
bundle with that from NMRSTAR bundle  
  
UCSF ChimeraX version: 1.6.1 (2023-05-09)  
© 2016-2023 Regents of the University of California. All rights reserved.  
How to cite UCSF ChimeraX  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/chimera_movie.py

Total number of pdb files: 505  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/0.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/0.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
0.pdb title:  
Title t= 0.00000 step= 0 [more info...]  
  
Chain information for 0.pdb #1  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 0.pdb #1  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/0.2.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/0.2.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
0.2.pdb title:  
Title t= 200.00000 step= 100000 [more info...]  
  
Chain information for 0.2.pdb #2  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 0.2.pdb #2  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/0.4.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/0.4.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
0.4.pdb title:  
Title t= 400.00000 step= 200000 [more info...]  
  
Chain information for 0.4.pdb #3  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 0.4.pdb #3  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/0.6.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/0.6.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
0.6.pdb title:  
Title t= 600.00000 step= 300000 [more info...]  
  
Chain information for 0.6.pdb #4  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 0.6.pdb #4  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/0.8.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/0.8.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
0.8.pdb title:  
Title t= 800.00000 step= 400000 [more info...]  
  
Chain information for 0.8.pdb #5  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 0.8.pdb #5  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/1.0.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/1.0.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
1.0.pdb title:  
Title t= 1000.00000 step= 500000 [more info...]  
  
Chain information for 1.0.pdb #6  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 1.0.pdb #6  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/1.2.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/1.2.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
1.2.pdb title:  
Title t= 1200.00000 step= 600000 [more info...]  
  
Chain information for 1.2.pdb #7  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 1.2.pdb #7  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/1.4.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/1.4.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
1.4.pdb title:  
Title t= 1400.00000 step= 700000 [more info...]  
  
Chain information for 1.4.pdb #8  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 1.4.pdb #8  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/1.6.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/1.6.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
1.6.pdb title:  
Title t= 1600.00000 step= 800000 [more info...]  
  
Chain information for 1.6.pdb #9  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 1.6.pdb #9  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/1.8.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/1.8.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
1.8.pdb title:  
Title t= 1800.00000 step= 900000 [more info...]  
  
Chain information for 1.8.pdb #10  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 1.8.pdb #10  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/2.0.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/2.0.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
2.0.pdb title:  
Title t= 2000.00000 step= 1000000 [more info...]  
  
Chain information for 2.0.pdb #11  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 2.0.pdb #11  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/2.2.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/2.2.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
2.2.pdb title:  
Title t= 2200.00000 step= 1100000 [more info...]  
  
Chain information for 2.2.pdb #12  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 2.2.pdb #12  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/2.4.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/2.4.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
2.4.pdb title:  
Title t= 2400.00000 step= 1200000 [more info...]  
  
Chain information for 2.4.pdb #13  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 2.4.pdb #13  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/2.6.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/2.6.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
2.6.pdb title:  
Title t= 2600.00000 step= 1300000 [more info...]  
  
Chain information for 2.6.pdb #14  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 2.6.pdb #14  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/2.8.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/2.8.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
2.8.pdb title:  
Title t= 2800.00000 step= 1400000 [more info...]  
  
Chain information for 2.8.pdb #15  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 2.8.pdb #15  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/3.0.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/3.0.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
3.0.pdb title:  
Title t= 3000.00000 step= 1500000 [more info...]  
  
Chain information for 3.0.pdb #16  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 3.0.pdb #16  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/3.2.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/3.2.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
3.2.pdb title:  
Title t= 3200.00000 step= 1600000 [more info...]  
  
Chain information for 3.2.pdb #17  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 3.2.pdb #17  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/3.4.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/3.4.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
3.4.pdb title:  
Title t= 3400.00000 step= 1700000 [more info...]  
  
Chain information for 3.4.pdb #18  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 3.4.pdb #18  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/3.6.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/3.6.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
3.6.pdb title:  
Title t= 3600.00000 step= 1800000 [more info...]  
  
Chain information for 3.6.pdb #19  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 3.6.pdb #19  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/3.8.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/3.8.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
3.8.pdb title:  
Title t= 3800.00000 step= 1900000 [more info...]  
  
Chain information for 3.8.pdb #20  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 3.8.pdb #20  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/4.0.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/4.0.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
4.0.pdb title:  
Title t= 4000.00000 step= 2000000 [more info...]  
  
Chain information for 4.0.pdb #21  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 4.0.pdb #21  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/4.2.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/4.2.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
4.2.pdb title:  
Title t= 4200.00000 step= 2100000 [more info...]  
  
Chain information for 4.2.pdb #22  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 4.2.pdb #22  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/4.4.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/4.4.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
4.4.pdb title:  
Title t= 4400.00000 step= 2200000 [more info...]  
  
Chain information for 4.4.pdb #23  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 4.4.pdb #23  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/4.6.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/4.6.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
4.6.pdb title:  
Title t= 4600.00000 step= 2300000 [more info...]  
  
Chain information for 4.6.pdb #24  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 4.6.pdb #24  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/4.8.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/4.8.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
4.8.pdb title:  
Title t= 4800.00000 step= 2400000 [more info...]  
  
Chain information for 4.8.pdb #25  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 4.8.pdb #25  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/5.0.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/5.0.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
5.0.pdb title:  
Title t= 5000.00000 step= 2500000 [more info...]  
  
Chain information for 5.0.pdb #26  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 5.0.pdb #26  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/5.2.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/5.2.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
5.2.pdb title:  
Title t= 5200.00000 step= 2600000 [more info...]  
  
Chain information for 5.2.pdb #27  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 5.2.pdb #27  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/5.4.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/5.4.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
5.4.pdb title:  
Title t= 5400.00000 step= 2700000 [more info...]  
  
Chain information for 5.4.pdb #28  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 5.4.pdb #28  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/5.6.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/5.6.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
5.6.pdb title:  
Title t= 5600.00000 step= 2800000 [more info...]  
  
Chain information for 5.6.pdb #29  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 5.6.pdb #29  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/5.8.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/5.8.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
5.8.pdb title:  
Title t= 5800.00000 step= 2900000 [more info...]  
  
Chain information for 5.8.pdb #30  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 5.8.pdb #30  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/6.0.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/6.0.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
6.0.pdb title:  
Title t= 6000.00000 step= 3000000 [more info...]  
  
Chain information for 6.0.pdb #31  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 6.0.pdb #31  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/6.2.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/6.2.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
6.2.pdb title:  
Title t= 6200.00000 step= 3100000 [more info...]  
  
Chain information for 6.2.pdb #32  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 6.2.pdb #32  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/6.4.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/6.4.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
6.4.pdb title:  
Title t= 6400.00000 step= 3200000 [more info...]  
  
Chain information for 6.4.pdb #33  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 6.4.pdb #33  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/6.6.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/6.6.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
6.6.pdb title:  
Title t= 6600.00000 step= 3300000 [more info...]  
  
Chain information for 6.6.pdb #34  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 6.6.pdb #34  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/6.8.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/6.8.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
6.8.pdb title:  
Title t= 6800.00000 step= 3400000 [more info...]  
  
Chain information for 6.8.pdb #35  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 6.8.pdb #35  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/7.0.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/7.0.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
7.0.pdb title:  
Title t= 7000.00000 step= 3500000 [more info...]  
  
Chain information for 7.0.pdb #36  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 7.0.pdb #36  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/7.2.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/7.2.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
7.2.pdb title:  
Title t= 7200.00000 step= 3600000 [more info...]  
  
Chain information for 7.2.pdb #37  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 7.2.pdb #37  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/7.4.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/7.4.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
7.4.pdb title:  
Title t= 7400.00000 step= 3700000 [more info...]  
  
Chain information for 7.4.pdb #38  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 7.4.pdb #38  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/7.6.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/7.6.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
7.6.pdb title:  
Title t= 7600.00000 step= 3800000 [more info...]  
  
Chain information for 7.6.pdb #39  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 7.6.pdb #39  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/7.8.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/7.8.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
7.8.pdb title:  
Title t= 7800.00000 step= 3900000 [more info...]  
  
Chain information for 7.8.pdb #40  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 7.8.pdb #40  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/8.0.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/8.0.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
8.0.pdb title:  
Title t= 8000.00000 step= 4000000 [more info...]  
  
Chain information for 8.0.pdb #41  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 8.0.pdb #41  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/8.2.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/8.2.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
8.2.pdb title:  
Title t= 8200.00000 step= 4100000 [more info...]  
  
Chain information for 8.2.pdb #42  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 8.2.pdb #42  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/8.4.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/8.4.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
8.4.pdb title:  
Title t= 8400.00000 step= 4200000 [more info...]  
  
Chain information for 8.4.pdb #43  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 8.4.pdb #43  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/8.6.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/8.6.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
8.6.pdb title:  
Title t= 8600.00000 step= 4300000 [more info...]  
  
Chain information for 8.6.pdb #44  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 8.6.pdb #44  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/8.8.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/8.8.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
8.8.pdb title:  
Title t= 8800.00000 step= 4400000 [more info...]  
  
Chain information for 8.8.pdb #45  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 8.8.pdb #45  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/9.0.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/9.0.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
9.0.pdb title:  
Title t= 9000.00000 step= 4500000 [more info...]  
  
Chain information for 9.0.pdb #46  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 9.0.pdb #46  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/9.2.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/9.2.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
9.2.pdb title:  
Title t= 9200.00000 step= 4600000 [more info...]  
  
Chain information for 9.2.pdb #47  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 9.2.pdb #47  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/9.4.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/9.4.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
9.4.pdb title:  
Title t= 9400.00000 step= 4700000 [more info...]  
  
Chain information for 9.4.pdb #48  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 9.4.pdb #48  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/9.6.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/9.6.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
9.6.pdb title:  
Title t= 9600.00000 step= 4800000 [more info...]  
  
Chain information for 9.6.pdb #49  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 9.6.pdb #49  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/9.8.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/9.8.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
9.8.pdb title:  
Title t= 9800.00000 step= 4900000 [more info...]  
  
Chain information for 9.8.pdb #50  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 9.8.pdb #50  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/10.0.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/10.0.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
10.0.pdb title:  
Title t= 10000.00000 step= 5000000 [more info...]  
  
Chain information for 10.0.pdb #51  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 10.0.pdb #51  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/10.2.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/10.2.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
10.2.pdb title:  
Title t= 10200.00000 step= 5100000 [more info...]  
  
Chain information for 10.2.pdb #52  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 10.2.pdb #52  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/10.4.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/10.4.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
10.4.pdb title:  
Title t= 10400.00000 step= 5200000 [more info...]  
  
Chain information for 10.4.pdb #53  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 10.4.pdb #53  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/10.6.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/10.6.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
10.6.pdb title:  
Title t= 10600.00000 step= 5300000 [more info...]  
  
Chain information for 10.6.pdb #54  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 10.6.pdb #54  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/10.8.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/10.8.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
10.8.pdb title:  
Title t= 10800.00000 step= 5400000 [more info...]  
  
Chain information for 10.8.pdb #55  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 10.8.pdb #55  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/11.0.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/11.0.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
11.0.pdb title:  
Title t= 11000.00000 step= 5500000 [more info...]  
  
Chain information for 11.0.pdb #56  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 11.0.pdb #56  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/11.2.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/11.2.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
11.2.pdb title:  
Title t= 11200.00000 step= 5600000 [more info...]  
  
Chain information for 11.2.pdb #57  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 11.2.pdb #57  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/11.4.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/11.4.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
11.4.pdb title:  
Title t= 11400.00000 step= 5700000 [more info...]  
  
Chain information for 11.4.pdb #58  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 11.4.pdb #58  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/11.6.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/11.6.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
11.6.pdb title:  
Title t= 11600.00000 step= 5800000 [more info...]  
  
Chain information for 11.6.pdb #59  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 11.6.pdb #59  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/11.8.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/11.8.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
11.8.pdb title:  
Title t= 11800.00000 step= 5900000 [more info...]  
  
Chain information for 11.8.pdb #60  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 11.8.pdb #60  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/12.0.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/12.0.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
12.0.pdb title:  
Title t= 12000.00000 step= 6000000 [more info...]  
  
Chain information for 12.0.pdb #61  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 12.0.pdb #61  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/12.2.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/12.2.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
12.2.pdb title:  
Title t= 12200.00000 step= 6100000 [more info...]  
  
Chain information for 12.2.pdb #62  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 12.2.pdb #62  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/12.4.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/12.4.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
12.4.pdb title:  
Title t= 12400.00000 step= 6200000 [more info...]  
  
Chain information for 12.4.pdb #63  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 12.4.pdb #63  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/12.6.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/12.6.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
12.6.pdb title:  
Title t= 12600.00000 step= 6300000 [more info...]  
  
Chain information for 12.6.pdb #64  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 12.6.pdb #64  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/12.8.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/12.8.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
12.8.pdb title:  
Title t= 12800.00000 step= 6400000 [more info...]  
  
Chain information for 12.8.pdb #65  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 12.8.pdb #65  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/13.0.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/13.0.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
13.0.pdb title:  
Title t= 13000.00000 step= 6500000 [more info...]  
  
Chain information for 13.0.pdb #66  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 13.0.pdb #66  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/13.2.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/13.2.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
13.2.pdb title:  
Title t= 13200.00000 step= 6600000 [more info...]  
  
Chain information for 13.2.pdb #67  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 13.2.pdb #67  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/13.4.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/13.4.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
13.4.pdb title:  
Title t= 13400.00000 step= 6700000 [more info...]  
  
Chain information for 13.4.pdb #68  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 13.4.pdb #68  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/13.6.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/13.6.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
13.6.pdb title:  
Title t= 13600.00000 step= 6800000 [more info...]  
  
Chain information for 13.6.pdb #69  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 13.6.pdb #69  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/13.8.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/13.8.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
13.8.pdb title:  
Title t= 13800.00000 step= 6900000 [more info...]  
  
Chain information for 13.8.pdb #70  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 13.8.pdb #70  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/14.0.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/14.0.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
14.0.pdb title:  
Title t= 14000.00000 step= 7000000 [more info...]  
  
Chain information for 14.0.pdb #71  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 14.0.pdb #71  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/14.2.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/14.2.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
14.2.pdb title:  
Title t= 14200.00000 step= 7100000 [more info...]  
  
Chain information for 14.2.pdb #72  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 14.2.pdb #72  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/14.4.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/14.4.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
14.4.pdb title:  
Title t= 14400.00000 step= 7200000 [more info...]  
  
Chain information for 14.4.pdb #73  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 14.4.pdb #73  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/14.6.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/14.6.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
14.6.pdb title:  
Title t= 14600.00000 step= 7300000 [more info...]  
  
Chain information for 14.6.pdb #74  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 14.6.pdb #74  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/14.8.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/14.8.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
14.8.pdb title:  
Title t= 14800.00000 step= 7400000 [more info...]  
  
Chain information for 14.8.pdb #75  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 14.8.pdb #75  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/15.0.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/15.0.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
15.0.pdb title:  
Title t= 15000.00000 step= 7500000 [more info...]  
  
Chain information for 15.0.pdb #76  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 15.0.pdb #76  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/15.2.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/15.2.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
15.2.pdb title:  
Title t= 15200.00000 step= 7600000 [more info...]  
  
Chain information for 15.2.pdb #77  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 15.2.pdb #77  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/15.4.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/15.4.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
15.4.pdb title:  
Title t= 15400.00000 step= 7700000 [more info...]  
  
Chain information for 15.4.pdb #78  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 15.4.pdb #78  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/15.6.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/15.6.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
15.6.pdb title:  
Title t= 15600.00000 step= 7800000 [more info...]  
  
Chain information for 15.6.pdb #79  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 15.6.pdb #79  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/15.8.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/15.8.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
15.8.pdb title:  
Title t= 15800.00000 step= 7900000 [more info...]  
  
Chain information for 15.8.pdb #80  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 15.8.pdb #80  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/16.0.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/16.0.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
16.0.pdb title:  
Title t= 16000.00000 step= 8000000 [more info...]  
  
Chain information for 16.0.pdb #81  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 16.0.pdb #81  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/16.2.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/16.2.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
16.2.pdb title:  
Title t= 16200.00000 step= 8100000 [more info...]  
  
Chain information for 16.2.pdb #82  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 16.2.pdb #82  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/16.4.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/16.4.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
16.4.pdb title:  
Title t= 16400.00000 step= 8200000 [more info...]  
  
Chain information for 16.4.pdb #83  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 16.4.pdb #83  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/16.6.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/16.6.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
16.6.pdb title:  
Title t= 16600.00000 step= 8300000 [more info...]  
  
Chain information for 16.6.pdb #84  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 16.6.pdb #84  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/16.8.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/16.8.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
16.8.pdb title:  
Title t= 16800.00000 step= 8400000 [more info...]  
  
Chain information for 16.8.pdb #85  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 16.8.pdb #85  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/17.0.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/17.0.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
17.0.pdb title:  
Title t= 17000.00000 step= 8500000 [more info...]  
  
Chain information for 17.0.pdb #86  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 17.0.pdb #86  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/17.2.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/17.2.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
17.2.pdb title:  
Title t= 17200.00000 step= 8600000 [more info...]  
  
Chain information for 17.2.pdb #87  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 17.2.pdb #87  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/17.4.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/17.4.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
17.4.pdb title:  
Title t= 17400.00000 step= 8700000 [more info...]  
  
Chain information for 17.4.pdb #88  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 17.4.pdb #88  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/17.6.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/17.6.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
17.6.pdb title:  
Title t= 17600.00000 step= 8800000 [more info...]  
  
Chain information for 17.6.pdb #89  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 17.6.pdb #89  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/17.8.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/17.8.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
17.8.pdb title:  
Title t= 17800.00000 step= 8900000 [more info...]  
  
Chain information for 17.8.pdb #90  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 17.8.pdb #90  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/18.0.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/18.0.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
18.0.pdb title:  
Title t= 18000.00000 step= 9000000 [more info...]  
  
Chain information for 18.0.pdb #91  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 18.0.pdb #91  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/18.2.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/18.2.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
18.2.pdb title:  
Title t= 18200.00000 step= 9100000 [more info...]  
  
Chain information for 18.2.pdb #92  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 18.2.pdb #92  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/18.4.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/18.4.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
18.4.pdb title:  
Title t= 18400.00000 step= 9200000 [more info...]  
  
Chain information for 18.4.pdb #93  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 18.4.pdb #93  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/18.6.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/18.6.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
18.6.pdb title:  
Title t= 18600.00000 step= 9300000 [more info...]  
  
Chain information for 18.6.pdb #94  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 18.6.pdb #94  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/18.8.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/18.8.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
18.8.pdb title:  
Title t= 18800.00000 step= 9400000 [more info...]  
  
Chain information for 18.8.pdb #95  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 18.8.pdb #95  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/19.0.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/19.0.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
19.0.pdb title:  
Title t= 19000.00000 step= 9500000 [more info...]  
  
Chain information for 19.0.pdb #96  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 19.0.pdb #96  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/19.2.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/19.2.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
19.2.pdb title:  
Title t= 19200.00000 step= 9600000 [more info...]  
  
Chain information for 19.2.pdb #97  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 19.2.pdb #97  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/19.4.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/19.4.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
19.4.pdb title:  
Title t= 19400.00000 step= 9700000 [more info...]  
  
Chain information for 19.4.pdb #98  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 19.4.pdb #98  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/19.6.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/19.6.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
19.6.pdb title:  
Title t= 19600.00000 step= 9800000 [more info...]  
  
Chain information for 19.6.pdb #99  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 19.6.pdb #99  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/19.8.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/19.8.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
19.8.pdb title:  
Title t= 19800.00000 step= 9900000 [more info...]  
  
Chain information for 19.8.pdb #100  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 19.8.pdb #100  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/20.0.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/20.0.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
20.0.pdb title:  
Title t= 20000.00000 step= 10000000 [more info...]  
  
Chain information for 20.0.pdb #101  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 20.0.pdb #101  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/20.2.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/20.2.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
20.2.pdb title:  
Title t= 20200.00000 step= 10100000 [more info...]  
  
Chain information for 20.2.pdb #102  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 20.2.pdb #102  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/20.4.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/20.4.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
20.4.pdb title:  
Title t= 20400.00000 step= 10200000 [more info...]  
  
Chain information for 20.4.pdb #103  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 20.4.pdb #103  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/20.6.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/20.6.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
20.6.pdb title:  
Title t= 20600.00000 step= 10300000 [more info...]  
  
Chain information for 20.6.pdb #104  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 20.6.pdb #104  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/20.8.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/20.8.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
20.8.pdb title:  
Title t= 20800.00000 step= 10400000 [more info...]  
  
Chain information for 20.8.pdb #105  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 20.8.pdb #105  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/21.0.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/21.0.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
21.0.pdb title:  
Title t= 21000.00000 step= 10500000 [more info...]  
  
Chain information for 21.0.pdb #106  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 21.0.pdb #106  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/21.2.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/21.2.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
21.2.pdb title:  
Title t= 21200.00000 step= 10600000 [more info...]  
  
Chain information for 21.2.pdb #107  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 21.2.pdb #107  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/21.4.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/21.4.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
21.4.pdb title:  
Title t= 21400.00000 step= 10700000 [more info...]  
  
Chain information for 21.4.pdb #108  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 21.4.pdb #108  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/21.6.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/21.6.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
21.6.pdb title:  
Title t= 21600.00000 step= 10800000 [more info...]  
  
Chain information for 21.6.pdb #109  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 21.6.pdb #109  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/21.8.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/21.8.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
21.8.pdb title:  
Title t= 21800.00000 step= 10900000 [more info...]  
  
Chain information for 21.8.pdb #110  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 21.8.pdb #110  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/22.0.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/22.0.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
22.0.pdb title:  
Title t= 22000.00000 step= 11000000 [more info...]  
  
Chain information for 22.0.pdb #111  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 22.0.pdb #111  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/22.2.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/22.2.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
22.2.pdb title:  
Title t= 22200.00000 step= 11100000 [more info...]  
  
Chain information for 22.2.pdb #112  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 22.2.pdb #112  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/22.4.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/22.4.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
22.4.pdb title:  
Title t= 22400.00000 step= 11200000 [more info...]  
  
Chain information for 22.4.pdb #113  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 22.4.pdb #113  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/22.6.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/22.6.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
22.6.pdb title:  
Title t= 22600.00000 step= 11300000 [more info...]  
  
Chain information for 22.6.pdb #114  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 22.6.pdb #114  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/22.8.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/22.8.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
22.8.pdb title:  
Title t= 22800.00000 step= 11400000 [more info...]  
  
Chain information for 22.8.pdb #115  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 22.8.pdb #115  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/23.0.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/23.0.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
23.0.pdb title:  
Title t= 23000.00000 step= 11500000 [more info...]  
  
Chain information for 23.0.pdb #116  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 23.0.pdb #116  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/23.2.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/23.2.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
23.2.pdb title:  
Title t= 23200.00000 step= 11600000 [more info...]  
  
Chain information for 23.2.pdb #117  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 23.2.pdb #117  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/23.4.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/23.4.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
23.4.pdb title:  
Title t= 23400.00000 step= 11700000 [more info...]  
  
Chain information for 23.4.pdb #118  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 23.4.pdb #118  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/23.6.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/23.6.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
23.6.pdb title:  
Title t= 23600.00000 step= 11800000 [more info...]  
  
Chain information for 23.6.pdb #119  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 23.6.pdb #119  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/23.8.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/23.8.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
23.8.pdb title:  
Title t= 23800.00000 step= 11900000 [more info...]  
  
Chain information for 23.8.pdb #120  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 23.8.pdb #120  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/24.0.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/24.0.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
24.0.pdb title:  
Title t= 24000.00000 step= 12000000 [more info...]  
  
Chain information for 24.0.pdb #121  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 24.0.pdb #121  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/24.2.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/24.2.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
24.2.pdb title:  
Title t= 24200.00000 step= 12100000 [more info...]  
  
Chain information for 24.2.pdb #122  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 24.2.pdb #122  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/24.4.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/24.4.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
24.4.pdb title:  
Title t= 24400.00000 step= 12200000 [more info...]  
  
Chain information for 24.4.pdb #123  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 24.4.pdb #123  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/24.6.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/24.6.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
24.6.pdb title:  
Title t= 24600.00000 step= 12300000 [more info...]  
  
Chain information for 24.6.pdb #124  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 24.6.pdb #124  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/24.8.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/24.8.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
24.8.pdb title:  
Title t= 24800.00000 step= 12400000 [more info...]  
  
Chain information for 24.8.pdb #125  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 24.8.pdb #125  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/25.0.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/25.0.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
25.0.pdb title:  
Title t= 25000.00000 step= 12500000 [more info...]  
  
Chain information for 25.0.pdb #126  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 25.0.pdb #126  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/25.2.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/25.2.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
25.2.pdb title:  
Title t= 25200.00000 step= 12600000 [more info...]  
  
Chain information for 25.2.pdb #127  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 25.2.pdb #127  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/25.4.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/25.4.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
25.4.pdb title:  
Title t= 25400.00000 step= 12700000 [more info...]  
  
Chain information for 25.4.pdb #128  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 25.4.pdb #128  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/25.6.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/25.6.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
25.6.pdb title:  
Title t= 25600.00000 step= 12800000 [more info...]  
  
Chain information for 25.6.pdb #129  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 25.6.pdb #129  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/25.8.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/25.8.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
25.8.pdb title:  
Title t= 25800.00000 step= 12900000 [more info...]  
  
Chain information for 25.8.pdb #130  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 25.8.pdb #130  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/26.0.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/26.0.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
26.0.pdb title:  
Title t= 26000.00000 step= 13000000 [more info...]  
  
Chain information for 26.0.pdb #131  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 26.0.pdb #131  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/26.2.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/26.2.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
26.2.pdb title:  
Title t= 26200.00000 step= 13100000 [more info...]  
  
Chain information for 26.2.pdb #132  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 26.2.pdb #132  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/26.4.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/26.4.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
26.4.pdb title:  
Title t= 26400.00000 step= 13200000 [more info...]  
  
Chain information for 26.4.pdb #133  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 26.4.pdb #133  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/26.6.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/26.6.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
26.6.pdb title:  
Title t= 26600.00000 step= 13300000 [more info...]  
  
Chain information for 26.6.pdb #134  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 26.6.pdb #134  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/26.8.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/26.8.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
26.8.pdb title:  
Title t= 26800.00000 step= 13400000 [more info...]  
  
Chain information for 26.8.pdb #135  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 26.8.pdb #135  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/27.0.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/27.0.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
27.0.pdb title:  
Title t= 27000.00000 step= 13500000 [more info...]  
  
Chain information for 27.0.pdb #136  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 27.0.pdb #136  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/27.2.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/27.2.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
27.2.pdb title:  
Title t= 27200.00000 step= 13600000 [more info...]  
  
Chain information for 27.2.pdb #137  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 27.2.pdb #137  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/27.4.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/27.4.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
27.4.pdb title:  
Title t= 27400.00000 step= 13700000 [more info...]  
  
Chain information for 27.4.pdb #138  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 27.4.pdb #138  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/27.6.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/27.6.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
27.6.pdb title:  
Title t= 27600.00000 step= 13800000 [more info...]  
  
Chain information for 27.6.pdb #139  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 27.6.pdb #139  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/27.8.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/27.8.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
27.8.pdb title:  
Title t= 27800.00000 step= 13900000 [more info...]  
  
Chain information for 27.8.pdb #140  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 27.8.pdb #140  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/28.0.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/28.0.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
28.0.pdb title:  
Title t= 28000.00000 step= 14000000 [more info...]  
  
Chain information for 28.0.pdb #141  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 28.0.pdb #141  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/28.2.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/28.2.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
28.2.pdb title:  
Title t= 28200.00000 step= 14100000 [more info...]  
  
Chain information for 28.2.pdb #142  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 28.2.pdb #142  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/28.4.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/28.4.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
28.4.pdb title:  
Title t= 28400.00000 step= 14200000 [more info...]  
  
Chain information for 28.4.pdb #143  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 28.4.pdb #143  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/28.6.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/28.6.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
28.6.pdb title:  
Title t= 28600.00000 step= 14300000 [more info...]  
  
Chain information for 28.6.pdb #144  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 28.6.pdb #144  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/28.8.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/28.8.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
28.8.pdb title:  
Title t= 28800.00000 step= 14400000 [more info...]  
  
Chain information for 28.8.pdb #145  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 28.8.pdb #145  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/29.0.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/29.0.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
29.0.pdb title:  
Title t= 29000.00000 step= 14500000 [more info...]  
  
Chain information for 29.0.pdb #146  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 29.0.pdb #146  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/29.2.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/29.2.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
29.2.pdb title:  
Title t= 29200.00000 step= 14600000 [more info...]  
  
Chain information for 29.2.pdb #147  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 29.2.pdb #147  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/29.4.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/29.4.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
29.4.pdb title:  
Title t= 29400.00000 step= 14700000 [more info...]  
  
Chain information for 29.4.pdb #148  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 29.4.pdb #148  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/29.6.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/29.6.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
29.6.pdb title:  
Title t= 29600.00000 step= 14800000 [more info...]  
  
Chain information for 29.6.pdb #149  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 29.6.pdb #149  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/29.8.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/29.8.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
29.8.pdb title:  
Title t= 29800.00000 step= 14900000 [more info...]  
  
Chain information for 29.8.pdb #150  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 29.8.pdb #150  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/30.0.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/30.0.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
30.0.pdb title:  
Title t= 30000.00000 step= 15000000 [more info...]  
  
Chain information for 30.0.pdb #151  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 30.0.pdb #151  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/30.2.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/30.2.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
30.2.pdb title:  
Title t= 30200.00000 step= 15100000 [more info...]  
  
Chain information for 30.2.pdb #152  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 30.2.pdb #152  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/30.4.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/30.4.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
30.4.pdb title:  
Title t= 30400.00000 step= 15200000 [more info...]  
  
Chain information for 30.4.pdb #153  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 30.4.pdb #153  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/30.6.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/30.6.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
30.6.pdb title:  
Title t= 30600.00000 step= 15300000 [more info...]  
  
Chain information for 30.6.pdb #154  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 30.6.pdb #154  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/30.8.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/30.8.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
30.8.pdb title:  
Title t= 30800.00000 step= 15400000 [more info...]  
  
Chain information for 30.8.pdb #155  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 30.8.pdb #155  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/31.0.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/31.0.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
31.0.pdb title:  
Title t= 31000.00000 step= 15500000 [more info...]  
  
Chain information for 31.0.pdb #156  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 31.0.pdb #156  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/31.2.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/31.2.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
31.2.pdb title:  
Title t= 31200.00000 step= 15600000 [more info...]  
  
Chain information for 31.2.pdb #157  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 31.2.pdb #157  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/31.4.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/31.4.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
31.4.pdb title:  
Title t= 31400.00000 step= 15700000 [more info...]  
  
Chain information for 31.4.pdb #158  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 31.4.pdb #158  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/31.6.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/31.6.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
31.6.pdb title:  
Title t= 31600.00000 step= 15800000 [more info...]  
  
Chain information for 31.6.pdb #159  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 31.6.pdb #159  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/31.8.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/31.8.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
31.8.pdb title:  
Title t= 31800.00000 step= 15900000 [more info...]  
  
Chain information for 31.8.pdb #160  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 31.8.pdb #160  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/32.0.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/32.0.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
32.0.pdb title:  
Title t= 32000.00000 step= 16000000 [more info...]  
  
Chain information for 32.0.pdb #161  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 32.0.pdb #161  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/32.2.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/32.2.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
32.2.pdb title:  
Title t= 32200.00000 step= 16100000 [more info...]  
  
Chain information for 32.2.pdb #162  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 32.2.pdb #162  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/32.4.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/32.4.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
32.4.pdb title:  
Title t= 32400.00000 step= 16200000 [more info...]  
  
Chain information for 32.4.pdb #163  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 32.4.pdb #163  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/32.6.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/32.6.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
32.6.pdb title:  
Title t= 32600.00000 step= 16300000 [more info...]  
  
Chain information for 32.6.pdb #164  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 32.6.pdb #164  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/32.8.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/32.8.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
32.8.pdb title:  
Title t= 32800.00000 step= 16400000 [more info...]  
  
Chain information for 32.8.pdb #165  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 32.8.pdb #165  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/33.0.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/33.0.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
33.0.pdb title:  
Title t= 33000.00000 step= 16500000 [more info...]  
  
Chain information for 33.0.pdb #166  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 33.0.pdb #166  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/33.2.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/33.2.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
33.2.pdb title:  
Title t= 33200.00000 step= 16600000 [more info...]  
  
Chain information for 33.2.pdb #167  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 33.2.pdb #167  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/33.4.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/33.4.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
33.4.pdb title:  
Title t= 33400.00000 step= 16700000 [more info...]  
  
Chain information for 33.4.pdb #168  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 33.4.pdb #168  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/33.6.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/33.6.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
33.6.pdb title:  
Title t= 33600.00000 step= 16800000 [more info...]  
  
Chain information for 33.6.pdb #169  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 33.6.pdb #169  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/33.8.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/33.8.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
33.8.pdb title:  
Title t= 33800.00000 step= 16900000 [more info...]  
  
Chain information for 33.8.pdb #170  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 33.8.pdb #170  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/34.0.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/34.0.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
34.0.pdb title:  
Title t= 34000.00000 step= 17000000 [more info...]  
  
Chain information for 34.0.pdb #171  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 34.0.pdb #171  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/34.2.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/34.2.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
34.2.pdb title:  
Title t= 34200.00000 step= 17100000 [more info...]  
  
Chain information for 34.2.pdb #172  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 34.2.pdb #172  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/34.4.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/34.4.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
34.4.pdb title:  
Title t= 34400.00000 step= 17200000 [more info...]  
  
Chain information for 34.4.pdb #173  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 34.4.pdb #173  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/34.6.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/34.6.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
34.6.pdb title:  
Title t= 34600.00000 step= 17300000 [more info...]  
  
Chain information for 34.6.pdb #174  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 34.6.pdb #174  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/34.8.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/34.8.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
34.8.pdb title:  
Title t= 34800.00000 step= 17400000 [more info...]  
  
Chain information for 34.8.pdb #175  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 34.8.pdb #175  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/35.0.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/35.0.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
35.0.pdb title:  
Title t= 35000.00000 step= 17500000 [more info...]  
  
Chain information for 35.0.pdb #176  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 35.0.pdb #176  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/35.2.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/35.2.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
35.2.pdb title:  
Title t= 35200.00000 step= 17600000 [more info...]  
  
Chain information for 35.2.pdb #177  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 35.2.pdb #177  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/35.4.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/35.4.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
35.4.pdb title:  
Title t= 35400.00000 step= 17700000 [more info...]  
  
Chain information for 35.4.pdb #178  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 35.4.pdb #178  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/35.6.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/35.6.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
35.6.pdb title:  
Title t= 35600.00000 step= 17800000 [more info...]  
  
Chain information for 35.6.pdb #179  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 35.6.pdb #179  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/35.8.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/35.8.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
35.8.pdb title:  
Title t= 35800.00000 step= 17900000 [more info...]  
  
Chain information for 35.8.pdb #180  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 35.8.pdb #180  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/36.0.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/36.0.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
36.0.pdb title:  
Title t= 36000.00000 step= 18000000 [more info...]  
  
Chain information for 36.0.pdb #181  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 36.0.pdb #181  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/36.2.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/36.2.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
36.2.pdb title:  
Title t= 36200.00000 step= 18100000 [more info...]  
  
Chain information for 36.2.pdb #182  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 36.2.pdb #182  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/36.4.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/36.4.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
36.4.pdb title:  
Title t= 36400.00000 step= 18200000 [more info...]  
  
Chain information for 36.4.pdb #183  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 36.4.pdb #183  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/36.6.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/36.6.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
36.6.pdb title:  
Title t= 36600.00000 step= 18300000 [more info...]  
  
Chain information for 36.6.pdb #184  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 36.6.pdb #184  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/36.8.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/36.8.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
36.8.pdb title:  
Title t= 36800.00000 step= 18400000 [more info...]  
  
Chain information for 36.8.pdb #185  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 36.8.pdb #185  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/37.0.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/37.0.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
37.0.pdb title:  
Title t= 37000.00000 step= 18500000 [more info...]  
  
Chain information for 37.0.pdb #186  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 37.0.pdb #186  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/37.2.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/37.2.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
37.2.pdb title:  
Title t= 37200.00000 step= 18600000 [more info...]  
  
Chain information for 37.2.pdb #187  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 37.2.pdb #187  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/37.4.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/37.4.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
37.4.pdb title:  
Title t= 37400.00000 step= 18700000 [more info...]  
  
Chain information for 37.4.pdb #188  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 37.4.pdb #188  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/37.6.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/37.6.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
37.6.pdb title:  
Title t= 37600.00000 step= 18800000 [more info...]  
  
Chain information for 37.6.pdb #189  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 37.6.pdb #189  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/37.8.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/37.8.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
37.8.pdb title:  
Title t= 37800.00000 step= 18900000 [more info...]  
  
Chain information for 37.8.pdb #190  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 37.8.pdb #190  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/38.0.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/38.0.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
38.0.pdb title:  
Title t= 38000.00000 step= 19000000 [more info...]  
  
Chain information for 38.0.pdb #191  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 38.0.pdb #191  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/38.2.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/38.2.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
38.2.pdb title:  
Title t= 38200.00000 step= 19100000 [more info...]  
  
Chain information for 38.2.pdb #192  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 38.2.pdb #192  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/38.4.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/38.4.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
38.4.pdb title:  
Title t= 38400.00000 step= 19200000 [more info...]  
  
Chain information for 38.4.pdb #193  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 38.4.pdb #193  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/38.6.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/38.6.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
38.6.pdb title:  
Title t= 38600.00000 step= 19300000 [more info...]  
  
Chain information for 38.6.pdb #194  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 38.6.pdb #194  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/38.8.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/38.8.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
38.8.pdb title:  
Title t= 38800.00000 step= 19400000 [more info...]  
  
Chain information for 38.8.pdb #195  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 38.8.pdb #195  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/39.0.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/39.0.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
39.0.pdb title:  
Title t= 39000.00000 step= 19500000 [more info...]  
  
Chain information for 39.0.pdb #196  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 39.0.pdb #196  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/39.2.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/39.2.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
39.2.pdb title:  
Title t= 39200.00000 step= 19600000 [more info...]  
  
Chain information for 39.2.pdb #197  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 39.2.pdb #197  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/39.4.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/39.4.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
39.4.pdb title:  
Title t= 39400.00000 step= 19700000 [more info...]  
  
Chain information for 39.4.pdb #198  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 39.4.pdb #198  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/39.6.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/39.6.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
39.6.pdb title:  
Title t= 39600.00000 step= 19800000 [more info...]  
  
Chain information for 39.6.pdb #199  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 39.6.pdb #199  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/39.8.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/39.8.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
39.8.pdb title:  
Title t= 39800.00000 step= 19900000 [more info...]  
  
Chain information for 39.8.pdb #200  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 39.8.pdb #200  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/40.0.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/40.0.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
40.0.pdb title:  
Title t= 40000.00000 step= 20000000 [more info...]  
  
Chain information for 40.0.pdb #201  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 40.0.pdb #201  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/40.2.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/40.2.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
40.2.pdb title:  
Title t= 40200.00000 step= 20100000 [more info...]  
  
Chain information for 40.2.pdb #202  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 40.2.pdb #202  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/40.4.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/40.4.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
40.4.pdb title:  
Title t= 40400.00000 step= 20200000 [more info...]  
  
Chain information for 40.4.pdb #203  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 40.4.pdb #203  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/40.6.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/40.6.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
40.6.pdb title:  
Title t= 40600.00000 step= 20300000 [more info...]  
  
Chain information for 40.6.pdb #204  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 40.6.pdb #204  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/40.8.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/40.8.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
40.8.pdb title:  
Title t= 40800.00000 step= 20400000 [more info...]  
  
Chain information for 40.8.pdb #205  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 40.8.pdb #205  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/41.0.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/41.0.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
41.0.pdb title:  
Title t= 41000.00000 step= 20500000 [more info...]  
  
Chain information for 41.0.pdb #206  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 41.0.pdb #206  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/41.2.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/41.2.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
41.2.pdb title:  
Title t= 41200.00000 step= 20600000 [more info...]  
  
Chain information for 41.2.pdb #207  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 41.2.pdb #207  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/41.4.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/41.4.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
41.4.pdb title:  
Title t= 41400.00000 step= 20700000 [more info...]  
  
Chain information for 41.4.pdb #208  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 41.4.pdb #208  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/41.6.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/41.6.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
41.6.pdb title:  
Title t= 41600.00000 step= 20800000 [more info...]  
  
Chain information for 41.6.pdb #209  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 41.6.pdb #209  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/41.8.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/41.8.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
41.8.pdb title:  
Title t= 41800.00000 step= 20900000 [more info...]  
  
Chain information for 41.8.pdb #210  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 41.8.pdb #210  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/42.0.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/42.0.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
42.0.pdb title:  
Title t= 42000.00000 step= 21000000 [more info...]  
  
Chain information for 42.0.pdb #211  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 42.0.pdb #211  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/42.2.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/42.2.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
42.2.pdb title:  
Title t= 42200.00000 step= 21100000 [more info...]  
  
Chain information for 42.2.pdb #212  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 42.2.pdb #212  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/42.4.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/42.4.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
42.4.pdb title:  
Title t= 42400.00000 step= 21200000 [more info...]  
  
Chain information for 42.4.pdb #213  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 42.4.pdb #213  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/42.6.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/42.6.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
42.6.pdb title:  
Title t= 42600.00000 step= 21300000 [more info...]  
  
Chain information for 42.6.pdb #214  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 42.6.pdb #214  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/42.8.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/42.8.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
42.8.pdb title:  
Title t= 42800.00000 step= 21400000 [more info...]  
  
Chain information for 42.8.pdb #215  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 42.8.pdb #215  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/43.0.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/43.0.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
43.0.pdb title:  
Title t= 43000.00000 step= 21500000 [more info...]  
  
Chain information for 43.0.pdb #216  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 43.0.pdb #216  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/43.2.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/43.2.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
43.2.pdb title:  
Title t= 43200.00000 step= 21600000 [more info...]  
  
Chain information for 43.2.pdb #217  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 43.2.pdb #217  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/43.4.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/43.4.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
43.4.pdb title:  
Title t= 43400.00000 step= 21700000 [more info...]  
  
Chain information for 43.4.pdb #218  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 43.4.pdb #218  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/43.6.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/43.6.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
43.6.pdb title:  
Title t= 43600.00000 step= 21800000 [more info...]  
  
Chain information for 43.6.pdb #219  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 43.6.pdb #219  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/43.8.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/43.8.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
43.8.pdb title:  
Title t= 43800.00000 step= 21900000 [more info...]  
  
Chain information for 43.8.pdb #220  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 43.8.pdb #220  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/44.0.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/44.0.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
44.0.pdb title:  
Title t= 44000.00000 step= 22000000 [more info...]  
  
Chain information for 44.0.pdb #221  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 44.0.pdb #221  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/44.2.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/44.2.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
44.2.pdb title:  
Title t= 44200.00000 step= 22100000 [more info...]  
  
Chain information for 44.2.pdb #222  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 44.2.pdb #222  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/44.4.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/44.4.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
44.4.pdb title:  
Title t= 44400.00000 step= 22200000 [more info...]  
  
Chain information for 44.4.pdb #223  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 44.4.pdb #223  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/44.6.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/44.6.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
44.6.pdb title:  
Title t= 44600.00000 step= 22300000 [more info...]  
  
Chain information for 44.6.pdb #224  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 44.6.pdb #224  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/44.8.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/44.8.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
44.8.pdb title:  
Title t= 44800.00000 step= 22400000 [more info...]  
  
Chain information for 44.8.pdb #225  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 44.8.pdb #225  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/45.0.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/45.0.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
45.0.pdb title:  
Title t= 45000.00000 step= 22500000 [more info...]  
  
Chain information for 45.0.pdb #226  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 45.0.pdb #226  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/45.2.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/45.2.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
45.2.pdb title:  
Title t= 45200.00000 step= 22600000 [more info...]  
  
Chain information for 45.2.pdb #227  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 45.2.pdb #227  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/45.4.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/45.4.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
45.4.pdb title:  
Title t= 45400.00000 step= 22700000 [more info...]  
  
Chain information for 45.4.pdb #228  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 45.4.pdb #228  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/45.6.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/45.6.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
45.6.pdb title:  
Title t= 45600.00000 step= 22800000 [more info...]  
  
Chain information for 45.6.pdb #229  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 45.6.pdb #229  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/45.8.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/45.8.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
45.8.pdb title:  
Title t= 45800.00000 step= 22900000 [more info...]  
  
Chain information for 45.8.pdb #230  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 45.8.pdb #230  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/46.0.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/46.0.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
46.0.pdb title:  
Title t= 46000.00000 step= 23000000 [more info...]  
  
Chain information for 46.0.pdb #231  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 46.0.pdb #231  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/46.2.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/46.2.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
46.2.pdb title:  
Title t= 46200.00000 step= 23100000 [more info...]  
  
Chain information for 46.2.pdb #232  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 46.2.pdb #232  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/46.4.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/46.4.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
46.4.pdb title:  
Title t= 46400.00000 step= 23200000 [more info...]  
  
Chain information for 46.4.pdb #233  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 46.4.pdb #233  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/46.6.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/46.6.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
46.6.pdb title:  
Title t= 46600.00000 step= 23300000 [more info...]  
  
Chain information for 46.6.pdb #234  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 46.6.pdb #234  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/46.8.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/46.8.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
46.8.pdb title:  
Title t= 46800.00000 step= 23400000 [more info...]  
  
Chain information for 46.8.pdb #235  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 46.8.pdb #235  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/47.0.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/47.0.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
47.0.pdb title:  
Title t= 47000.00000 step= 23500000 [more info...]  
  
Chain information for 47.0.pdb #236  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 47.0.pdb #236  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/47.2.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/47.2.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
47.2.pdb title:  
Title t= 47200.00000 step= 23600000 [more info...]  
  
Chain information for 47.2.pdb #237  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 47.2.pdb #237  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/47.4.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/47.4.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
47.4.pdb title:  
Title t= 47400.00000 step= 23700000 [more info...]  
  
Chain information for 47.4.pdb #238  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 47.4.pdb #238  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/47.6.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/47.6.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
47.6.pdb title:  
Title t= 47600.00000 step= 23800000 [more info...]  
  
Chain information for 47.6.pdb #239  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 47.6.pdb #239  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/47.8.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/47.8.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
47.8.pdb title:  
Title t= 47800.00000 step= 23900000 [more info...]  
  
Chain information for 47.8.pdb #240  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 47.8.pdb #240  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/48.0.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/48.0.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
48.0.pdb title:  
Title t= 48000.00000 step= 24000000 [more info...]  
  
Chain information for 48.0.pdb #241  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 48.0.pdb #241  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/48.2.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/48.2.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
48.2.pdb title:  
Title t= 48200.00000 step= 24100000 [more info...]  
  
Chain information for 48.2.pdb #242  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 48.2.pdb #242  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/48.4.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/48.4.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
48.4.pdb title:  
Title t= 48400.00000 step= 24200000 [more info...]  
  
Chain information for 48.4.pdb #243  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 48.4.pdb #243  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/48.6.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/48.6.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
48.6.pdb title:  
Title t= 48600.00000 step= 24300000 [more info...]  
  
Chain information for 48.6.pdb #244  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 48.6.pdb #244  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/48.8.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/48.8.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
48.8.pdb title:  
Title t= 48800.00000 step= 24400000 [more info...]  
  
Chain information for 48.8.pdb #245  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 48.8.pdb #245  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/49.0.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/49.0.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
49.0.pdb title:  
Title t= 49000.00000 step= 24500000 [more info...]  
  
Chain information for 49.0.pdb #246  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 49.0.pdb #246  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/49.2.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/49.2.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
49.2.pdb title:  
Title t= 49200.00000 step= 24600000 [more info...]  
  
Chain information for 49.2.pdb #247  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 49.2.pdb #247  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/49.4.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/49.4.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
49.4.pdb title:  
Title t= 49400.00000 step= 24700000 [more info...]  
  
Chain information for 49.4.pdb #248  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 49.4.pdb #248  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/49.6.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/49.6.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
49.6.pdb title:  
Title t= 49600.00000 step= 24800000 [more info...]  
  
Chain information for 49.6.pdb #249  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 49.6.pdb #249  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/49.8.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/49.8.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
49.8.pdb title:  
Title t= 49800.00000 step= 24900000 [more info...]  
  
Chain information for 49.8.pdb #250  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 49.8.pdb #250  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/50.0.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/50.0.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
50.0.pdb title:  
Title t= 50000.00000 step= 25000000 [more info...]  
  
Chain information for 50.0.pdb #251  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 50.0.pdb #251  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/50.2.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/50.2.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
50.2.pdb title:  
Title t= 50200.00000 step= 25100000 [more info...]  
  
Chain information for 50.2.pdb #252  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 50.2.pdb #252  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/50.4.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/50.4.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
50.4.pdb title:  
Title t= 50400.00000 step= 25200000 [more info...]  
  
Chain information for 50.4.pdb #253  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 50.4.pdb #253  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/50.6.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/50.6.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
50.6.pdb title:  
Title t= 50600.00000 step= 25300000 [more info...]  
  
Chain information for 50.6.pdb #254  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 50.6.pdb #254  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/50.8.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/50.8.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
50.8.pdb title:  
Title t= 50800.00000 step= 25400000 [more info...]  
  
Chain information for 50.8.pdb #255  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 50.8.pdb #255  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/51.0.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/51.0.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
51.0.pdb title:  
Title t= 51000.00000 step= 25500000 [more info...]  
  
Chain information for 51.0.pdb #256  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 51.0.pdb #256  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/51.2.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/51.2.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
51.2.pdb title:  
Title t= 51200.00000 step= 25600000 [more info...]  
  
Chain information for 51.2.pdb #257  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 51.2.pdb #257  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/51.4.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/51.4.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
51.4.pdb title:  
Title t= 51400.00000 step= 25700000 [more info...]  
  
Chain information for 51.4.pdb #258  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 51.4.pdb #258  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/51.6.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/51.6.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
51.6.pdb title:  
Title t= 51600.00000 step= 25800000 [more info...]  
  
Chain information for 51.6.pdb #259  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 51.6.pdb #259  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/51.8.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/51.8.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
51.8.pdb title:  
Title t= 51800.00000 step= 25900000 [more info...]  
  
Chain information for 51.8.pdb #260  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 51.8.pdb #260  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/52.0.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/52.0.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
52.0.pdb title:  
Title t= 52000.00000 step= 26000000 [more info...]  
  
Chain information for 52.0.pdb #261  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 52.0.pdb #261  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/52.2.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/52.2.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
52.2.pdb title:  
Title t= 52200.00000 step= 26100000 [more info...]  
  
Chain information for 52.2.pdb #262  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 52.2.pdb #262  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/52.4.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/52.4.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
52.4.pdb title:  
Title t= 52400.00000 step= 26200000 [more info...]  
  
Chain information for 52.4.pdb #263  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 52.4.pdb #263  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/52.6.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/52.6.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
52.6.pdb title:  
Title t= 52600.00000 step= 26300000 [more info...]  
  
Chain information for 52.6.pdb #264  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 52.6.pdb #264  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/52.8.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/52.8.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
52.8.pdb title:  
Title t= 52800.00000 step= 26400000 [more info...]  
  
Chain information for 52.8.pdb #265  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 52.8.pdb #265  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/53.0.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/53.0.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
53.0.pdb title:  
Title t= 53000.00000 step= 26500000 [more info...]  
  
Chain information for 53.0.pdb #266  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 53.0.pdb #266  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/53.2.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/53.2.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
53.2.pdb title:  
Title t= 53200.00000 step= 26600000 [more info...]  
  
Chain information for 53.2.pdb #267  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 53.2.pdb #267  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/53.4.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/53.4.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
53.4.pdb title:  
Title t= 53400.00000 step= 26700000 [more info...]  
  
Chain information for 53.4.pdb #268  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 53.4.pdb #268  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/53.6.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/53.6.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
53.6.pdb title:  
Title t= 53600.00000 step= 26800000 [more info...]  
  
Chain information for 53.6.pdb #269  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 53.6.pdb #269  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/53.8.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/53.8.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
53.8.pdb title:  
Title t= 53800.00000 step= 26900000 [more info...]  
  
Chain information for 53.8.pdb #270  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 53.8.pdb #270  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/54.0.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/54.0.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
54.0.pdb title:  
Title t= 54000.00000 step= 27000000 [more info...]  
  
Chain information for 54.0.pdb #271  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 54.0.pdb #271  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/54.2.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/54.2.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
54.2.pdb title:  
Title t= 54200.00000 step= 27100000 [more info...]  
  
Chain information for 54.2.pdb #272  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 54.2.pdb #272  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/54.4.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/54.4.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
54.4.pdb title:  
Title t= 54400.00000 step= 27200000 [more info...]  
  
Chain information for 54.4.pdb #273  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 54.4.pdb #273  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/54.6.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/54.6.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
54.6.pdb title:  
Title t= 54600.00000 step= 27300000 [more info...]  
  
Chain information for 54.6.pdb #274  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 54.6.pdb #274  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/54.8.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/54.8.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
54.8.pdb title:  
Title t= 54800.00000 step= 27400000 [more info...]  
  
Chain information for 54.8.pdb #275  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 54.8.pdb #275  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/55.0.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/55.0.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
55.0.pdb title:  
Title t= 55000.00000 step= 27500000 [more info...]  
  
Chain information for 55.0.pdb #276  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 55.0.pdb #276  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/55.2.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/55.2.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
55.2.pdb title:  
Title t= 55200.00000 step= 27600000 [more info...]  
  
Chain information for 55.2.pdb #277  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 55.2.pdb #277  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/55.4.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/55.4.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
55.4.pdb title:  
Title t= 55400.00000 step= 27700000 [more info...]  
  
Chain information for 55.4.pdb #278  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 55.4.pdb #278  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/55.6.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/55.6.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
55.6.pdb title:  
Title t= 55600.00000 step= 27800000 [more info...]  
  
Chain information for 55.6.pdb #279  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 55.6.pdb #279  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/55.8.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/55.8.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
55.8.pdb title:  
Title t= 55800.00000 step= 27900000 [more info...]  
  
Chain information for 55.8.pdb #280  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 55.8.pdb #280  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/56.0.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/56.0.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
56.0.pdb title:  
Title t= 56000.00000 step= 28000000 [more info...]  
  
Chain information for 56.0.pdb #281  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 56.0.pdb #281  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/56.2.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/56.2.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
56.2.pdb title:  
Title t= 56200.00000 step= 28100000 [more info...]  
  
Chain information for 56.2.pdb #282  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 56.2.pdb #282  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/56.4.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/56.4.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
56.4.pdb title:  
Title t= 56400.00000 step= 28200000 [more info...]  
  
Chain information for 56.4.pdb #283  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 56.4.pdb #283  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/56.6.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/56.6.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
56.6.pdb title:  
Title t= 56600.00000 step= 28300000 [more info...]  
  
Chain information for 56.6.pdb #284  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 56.6.pdb #284  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/56.8.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/56.8.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
56.8.pdb title:  
Title t= 56800.00000 step= 28400000 [more info...]  
  
Chain information for 56.8.pdb #285  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 56.8.pdb #285  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/57.0.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/57.0.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
57.0.pdb title:  
Title t= 57000.00000 step= 28500000 [more info...]  
  
Chain information for 57.0.pdb #286  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 57.0.pdb #286  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/57.2.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/57.2.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
57.2.pdb title:  
Title t= 57200.00000 step= 28600000 [more info...]  
  
Chain information for 57.2.pdb #287  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 57.2.pdb #287  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/57.4.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/57.4.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
57.4.pdb title:  
Title t= 57400.00000 step= 28700000 [more info...]  
  
Chain information for 57.4.pdb #288  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 57.4.pdb #288  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/57.6.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/57.6.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
57.6.pdb title:  
Title t= 57600.00000 step= 28800000 [more info...]  
  
Chain information for 57.6.pdb #289  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 57.6.pdb #289  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/57.8.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/57.8.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
57.8.pdb title:  
Title t= 57800.00000 step= 28900000 [more info...]  
  
Chain information for 57.8.pdb #290  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 57.8.pdb #290  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/58.0.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/58.0.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
58.0.pdb title:  
Title t= 58000.00000 step= 29000000 [more info...]  
  
Chain information for 58.0.pdb #291  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 58.0.pdb #291  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/58.2.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/58.2.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
58.2.pdb title:  
Title t= 58200.00000 step= 29100000 [more info...]  
  
Chain information for 58.2.pdb #292  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 58.2.pdb #292  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/58.4.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/58.4.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
58.4.pdb title:  
Title t= 58400.00000 step= 29200000 [more info...]  
  
Chain information for 58.4.pdb #293  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 58.4.pdb #293  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/58.6.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/58.6.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
58.6.pdb title:  
Title t= 58600.00000 step= 29300000 [more info...]  
  
Chain information for 58.6.pdb #294  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 58.6.pdb #294  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/58.8.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/58.8.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
58.8.pdb title:  
Title t= 58800.00000 step= 29400000 [more info...]  
  
Chain information for 58.8.pdb #295  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 58.8.pdb #295  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/59.0.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/59.0.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
59.0.pdb title:  
Title t= 59000.00000 step= 29500000 [more info...]  
  
Chain information for 59.0.pdb #296  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 59.0.pdb #296  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/59.2.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/59.2.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
59.2.pdb title:  
Title t= 59200.00000 step= 29600000 [more info...]  
  
Chain information for 59.2.pdb #297  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 59.2.pdb #297  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/59.4.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/59.4.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
59.4.pdb title:  
Title t= 59400.00000 step= 29700000 [more info...]  
  
Chain information for 59.4.pdb #298  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 59.4.pdb #298  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/59.6.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/59.6.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
59.6.pdb title:  
Title t= 59600.00000 step= 29800000 [more info...]  
  
Chain information for 59.6.pdb #299  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 59.6.pdb #299  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/59.8.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/59.8.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
59.8.pdb title:  
Title t= 59800.00000 step= 29900000 [more info...]  
  
Chain information for 59.8.pdb #300  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 59.8.pdb #300  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/60.0.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/60.0.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
60.0.pdb title:  
Title t= 60000.00000 step= 30000000 [more info...]  
  
Chain information for 60.0.pdb #301  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 60.0.pdb #301  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/60.2.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/60.2.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
60.2.pdb title:  
Title t= 60200.00000 step= 30100000 [more info...]  
  
Chain information for 60.2.pdb #302  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 60.2.pdb #302  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/60.4.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/60.4.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
60.4.pdb title:  
Title t= 60400.00000 step= 30200000 [more info...]  
  
Chain information for 60.4.pdb #303  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 60.4.pdb #303  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/60.6.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/60.6.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
60.6.pdb title:  
Title t= 60600.00000 step= 30300000 [more info...]  
  
Chain information for 60.6.pdb #304  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 60.6.pdb #304  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/60.8.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/60.8.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
60.8.pdb title:  
Title t= 60800.00000 step= 30400000 [more info...]  
  
Chain information for 60.8.pdb #305  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 60.8.pdb #305  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/61.0.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/61.0.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
61.0.pdb title:  
Title t= 61000.00000 step= 30500000 [more info...]  
  
Chain information for 61.0.pdb #306  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 61.0.pdb #306  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/61.2.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/61.2.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
61.2.pdb title:  
Title t= 61200.00000 step= 30600000 [more info...]  
  
Chain information for 61.2.pdb #307  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 61.2.pdb #307  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/61.4.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/61.4.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
61.4.pdb title:  
Title t= 61400.00000 step= 30700000 [more info...]  
  
Chain information for 61.4.pdb #308  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 61.4.pdb #308  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/61.6.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/61.6.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
61.6.pdb title:  
Title t= 61600.00000 step= 30800000 [more info...]  
  
Chain information for 61.6.pdb #309  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 61.6.pdb #309  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/61.8.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/61.8.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
61.8.pdb title:  
Title t= 61800.00000 step= 30900000 [more info...]  
  
Chain information for 61.8.pdb #310  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 61.8.pdb #310  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/62.0.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/62.0.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
62.0.pdb title:  
Title t= 62000.00000 step= 31000000 [more info...]  
  
Chain information for 62.0.pdb #311  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 62.0.pdb #311  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/62.2.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/62.2.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
62.2.pdb title:  
Title t= 62200.00000 step= 31100000 [more info...]  
  
Chain information for 62.2.pdb #312  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 62.2.pdb #312  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/62.4.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/62.4.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
62.4.pdb title:  
Title t= 62400.00000 step= 31200000 [more info...]  
  
Chain information for 62.4.pdb #313  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 62.4.pdb #313  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/62.6.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/62.6.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
62.6.pdb title:  
Title t= 62600.00000 step= 31300000 [more info...]  
  
Chain information for 62.6.pdb #314  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 62.6.pdb #314  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/62.8.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/62.8.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
62.8.pdb title:  
Title t= 62800.00000 step= 31400000 [more info...]  
  
Chain information for 62.8.pdb #315  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 62.8.pdb #315  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/63.0.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/63.0.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
63.0.pdb title:  
Title t= 63000.00000 step= 31500000 [more info...]  
  
Chain information for 63.0.pdb #316  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 63.0.pdb #316  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/63.2.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/63.2.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
63.2.pdb title:  
Title t= 63200.00000 step= 31600000 [more info...]  
  
Chain information for 63.2.pdb #317  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 63.2.pdb #317  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/63.4.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/63.4.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
63.4.pdb title:  
Title t= 63400.00000 step= 31700000 [more info...]  
  
Chain information for 63.4.pdb #318  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 63.4.pdb #318  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/63.6.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/63.6.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
63.6.pdb title:  
Title t= 63600.00000 step= 31800000 [more info...]  
  
Chain information for 63.6.pdb #319  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 63.6.pdb #319  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/63.8.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/63.8.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
63.8.pdb title:  
Title t= 63800.00000 step= 31900000 [more info...]  
  
Chain information for 63.8.pdb #320  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 63.8.pdb #320  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/64.0.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/64.0.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
64.0.pdb title:  
Title t= 64000.00000 step= 32000000 [more info...]  
  
Chain information for 64.0.pdb #321  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 64.0.pdb #321  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/64.2.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/64.2.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
64.2.pdb title:  
Title t= 64200.00000 step= 32100000 [more info...]  
  
Chain information for 64.2.pdb #322  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 64.2.pdb #322  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/64.4.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/64.4.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
64.4.pdb title:  
Title t= 64400.00000 step= 32200000 [more info...]  
  
Chain information for 64.4.pdb #323  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 64.4.pdb #323  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/64.6.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/64.6.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
64.6.pdb title:  
Title t= 64600.00000 step= 32300000 [more info...]  
  
Chain information for 64.6.pdb #324  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 64.6.pdb #324  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/64.8.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/64.8.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
64.8.pdb title:  
Title t= 64800.00000 step= 32400000 [more info...]  
  
Chain information for 64.8.pdb #325  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 64.8.pdb #325  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/65.0.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/65.0.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
65.0.pdb title:  
Title t= 65000.00000 step= 32500000 [more info...]  
  
Chain information for 65.0.pdb #326  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 65.0.pdb #326  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/65.2.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/65.2.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
65.2.pdb title:  
Title t= 65200.00000 step= 32600000 [more info...]  
  
Chain information for 65.2.pdb #327  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 65.2.pdb #327  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/65.4.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/65.4.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
65.4.pdb title:  
Title t= 65400.00000 step= 32700000 [more info...]  
  
Chain information for 65.4.pdb #328  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 65.4.pdb #328  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/65.6.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/65.6.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
65.6.pdb title:  
Title t= 65600.00000 step= 32800000 [more info...]  
  
Chain information for 65.6.pdb #329  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 65.6.pdb #329  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/65.8.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/65.8.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
65.8.pdb title:  
Title t= 65800.00000 step= 32900000 [more info...]  
  
Chain information for 65.8.pdb #330  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 65.8.pdb #330  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/66.0.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/66.0.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
66.0.pdb title:  
Title t= 66000.00000 step= 33000000 [more info...]  
  
Chain information for 66.0.pdb #331  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 66.0.pdb #331  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/66.2.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/66.2.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
66.2.pdb title:  
Title t= 66200.00000 step= 33100000 [more info...]  
  
Chain information for 66.2.pdb #332  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 66.2.pdb #332  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/66.4.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/66.4.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
66.4.pdb title:  
Title t= 66400.00000 step= 33200000 [more info...]  
  
Chain information for 66.4.pdb #333  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 66.4.pdb #333  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/66.6.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/66.6.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
66.6.pdb title:  
Title t= 66600.00000 step= 33300000 [more info...]  
  
Chain information for 66.6.pdb #334  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 66.6.pdb #334  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/66.8.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/66.8.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
66.8.pdb title:  
Title t= 66800.00000 step= 33400000 [more info...]  
  
Chain information for 66.8.pdb #335  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 66.8.pdb #335  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/67.0.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/67.0.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
67.0.pdb title:  
Title t= 67000.00000 step= 33500000 [more info...]  
  
Chain information for 67.0.pdb #336  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 67.0.pdb #336  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/67.2.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/67.2.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
67.2.pdb title:  
Title t= 67200.00000 step= 33600000 [more info...]  
  
Chain information for 67.2.pdb #337  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 67.2.pdb #337  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/67.4.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/67.4.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
67.4.pdb title:  
Title t= 67400.00000 step= 33700000 [more info...]  
  
Chain information for 67.4.pdb #338  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 67.4.pdb #338  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/67.6.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/67.6.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
67.6.pdb title:  
Title t= 67600.00000 step= 33800000 [more info...]  
  
Chain information for 67.6.pdb #339  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 67.6.pdb #339  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/67.8.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/67.8.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
67.8.pdb title:  
Title t= 67800.00000 step= 33900000 [more info...]  
  
Chain information for 67.8.pdb #340  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 67.8.pdb #340  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/68.0.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/68.0.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
68.0.pdb title:  
Title t= 68000.00000 step= 34000000 [more info...]  
  
Chain information for 68.0.pdb #341  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 68.0.pdb #341  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/68.2.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/68.2.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
68.2.pdb title:  
Title t= 68200.00000 step= 34100000 [more info...]  
  
Chain information for 68.2.pdb #342  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 68.2.pdb #342  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/68.4.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/68.4.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
68.4.pdb title:  
Title t= 68400.00000 step= 34200000 [more info...]  
  
Chain information for 68.4.pdb #343  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 68.4.pdb #343  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/68.6.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/68.6.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
68.6.pdb title:  
Title t= 68600.00000 step= 34300000 [more info...]  
  
Chain information for 68.6.pdb #344  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 68.6.pdb #344  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/68.8.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/68.8.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
68.8.pdb title:  
Title t= 68800.00000 step= 34400000 [more info...]  
  
Chain information for 68.8.pdb #345  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 68.8.pdb #345  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/69.0.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/69.0.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
69.0.pdb title:  
Title t= 69000.00000 step= 34500000 [more info...]  
  
Chain information for 69.0.pdb #346  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 69.0.pdb #346  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/69.2.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/69.2.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
69.2.pdb title:  
Title t= 69200.00000 step= 34600000 [more info...]  
  
Chain information for 69.2.pdb #347  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 69.2.pdb #347  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/69.4.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/69.4.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
69.4.pdb title:  
Title t= 69400.00000 step= 34700000 [more info...]  
  
Chain information for 69.4.pdb #348  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 69.4.pdb #348  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/69.6.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/69.6.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
69.6.pdb title:  
Title t= 69600.00000 step= 34800000 [more info...]  
  
Chain information for 69.6.pdb #349  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 69.6.pdb #349  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/69.8.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/69.8.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
69.8.pdb title:  
Title t= 69800.00000 step= 34900000 [more info...]  
  
Chain information for 69.8.pdb #350  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 69.8.pdb #350  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/70.0.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/70.0.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
70.0.pdb title:  
Title t= 70000.00000 step= 35000000 [more info...]  
  
Chain information for 70.0.pdb #351  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 70.0.pdb #351  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/70.2.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/70.2.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
70.2.pdb title:  
Title t= 70200.00000 step= 35100000 [more info...]  
  
Chain information for 70.2.pdb #352  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 70.2.pdb #352  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/70.4.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/70.4.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
70.4.pdb title:  
Title t= 70400.00000 step= 35200000 [more info...]  
  
Chain information for 70.4.pdb #353  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 70.4.pdb #353  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/70.6.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/70.6.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
70.6.pdb title:  
Title t= 70600.00000 step= 35300000 [more info...]  
  
Chain information for 70.6.pdb #354  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 70.6.pdb #354  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/70.8.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/70.8.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
70.8.pdb title:  
Title t= 70800.00000 step= 35400000 [more info...]  
  
Chain information for 70.8.pdb #355  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 70.8.pdb #355  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/71.0.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/71.0.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
71.0.pdb title:  
Title t= 71000.00000 step= 35500000 [more info...]  
  
Chain information for 71.0.pdb #356  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 71.0.pdb #356  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/71.2.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/71.2.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
71.2.pdb title:  
Title t= 71200.00000 step= 35600000 [more info...]  
  
Chain information for 71.2.pdb #357  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 71.2.pdb #357  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/71.4.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/71.4.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
71.4.pdb title:  
Title t= 71400.00000 step= 35700000 [more info...]  
  
Chain information for 71.4.pdb #358  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 71.4.pdb #358  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/71.6.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/71.6.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
71.6.pdb title:  
Title t= 71600.00000 step= 35800000 [more info...]  
  
Chain information for 71.6.pdb #359  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 71.6.pdb #359  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/71.8.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/71.8.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
71.8.pdb title:  
Title t= 71800.00000 step= 35900000 [more info...]  
  
Chain information for 71.8.pdb #360  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 71.8.pdb #360  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/72.0.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/72.0.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
72.0.pdb title:  
Title t= 72000.00000 step= 36000000 [more info...]  
  
Chain information for 72.0.pdb #361  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 72.0.pdb #361  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/72.2.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/72.2.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
72.2.pdb title:  
Title t= 72200.00000 step= 36100000 [more info...]  
  
Chain information for 72.2.pdb #362  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 72.2.pdb #362  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/72.4.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/72.4.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
72.4.pdb title:  
Title t= 72400.00000 step= 36200000 [more info...]  
  
Chain information for 72.4.pdb #363  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 72.4.pdb #363  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/72.6.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/72.6.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
72.6.pdb title:  
Title t= 72600.00000 step= 36300000 [more info...]  
  
Chain information for 72.6.pdb #364  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 72.6.pdb #364  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/72.8.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/72.8.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
72.8.pdb title:  
Title t= 72800.00000 step= 36400000 [more info...]  
  
Chain information for 72.8.pdb #365  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 72.8.pdb #365  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/73.0.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/73.0.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
73.0.pdb title:  
Title t= 73000.00000 step= 36500000 [more info...]  
  
Chain information for 73.0.pdb #366  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 73.0.pdb #366  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/73.2.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/73.2.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
73.2.pdb title:  
Title t= 73200.00000 step= 36600000 [more info...]  
  
Chain information for 73.2.pdb #367  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 73.2.pdb #367  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/73.4.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/73.4.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
73.4.pdb title:  
Title t= 73400.00000 step= 36700000 [more info...]  
  
Chain information for 73.4.pdb #368  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 73.4.pdb #368  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/73.6.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/73.6.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
73.6.pdb title:  
Title t= 73600.00000 step= 36800000 [more info...]  
  
Chain information for 73.6.pdb #369  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 73.6.pdb #369  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/73.8.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/73.8.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
73.8.pdb title:  
Title t= 73800.00000 step= 36900000 [more info...]  
  
Chain information for 73.8.pdb #370  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 73.8.pdb #370  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/74.0.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/74.0.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
74.0.pdb title:  
Title t= 74000.00000 step= 37000000 [more info...]  
  
Chain information for 74.0.pdb #371  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 74.0.pdb #371  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/74.2.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/74.2.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
74.2.pdb title:  
Title t= 74200.00000 step= 37100000 [more info...]  
  
Chain information for 74.2.pdb #372  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 74.2.pdb #372  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/74.4.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/74.4.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
74.4.pdb title:  
Title t= 74400.00000 step= 37200000 [more info...]  
  
Chain information for 74.4.pdb #373  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 74.4.pdb #373  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/74.6.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/74.6.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
74.6.pdb title:  
Title t= 74600.00000 step= 37300000 [more info...]  
  
Chain information for 74.6.pdb #374  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 74.6.pdb #374  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/74.8.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/74.8.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
74.8.pdb title:  
Title t= 74800.00000 step= 37400000 [more info...]  
  
Chain information for 74.8.pdb #375  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 74.8.pdb #375  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/75.0.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/75.0.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
75.0.pdb title:  
Title t= 75000.00000 step= 37500000 [more info...]  
  
Chain information for 75.0.pdb #376  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 75.0.pdb #376  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/75.2.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/75.2.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
75.2.pdb title:  
Title t= 75200.00000 step= 37600000 [more info...]  
  
Chain information for 75.2.pdb #377  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 75.2.pdb #377  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/75.4.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/75.4.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
75.4.pdb title:  
Title t= 75400.00000 step= 37700000 [more info...]  
  
Chain information for 75.4.pdb #378  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 75.4.pdb #378  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/75.6.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/75.6.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
75.6.pdb title:  
Title t= 75600.00000 step= 37800000 [more info...]  
  
Chain information for 75.6.pdb #379  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 75.6.pdb #379  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/75.8.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/75.8.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
75.8.pdb title:  
Title t= 75800.00000 step= 37900000 [more info...]  
  
Chain information for 75.8.pdb #380  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 75.8.pdb #380  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/76.0.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/76.0.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
76.0.pdb title:  
Title t= 76000.00000 step= 38000000 [more info...]  
  
Chain information for 76.0.pdb #381  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 76.0.pdb #381  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/76.2.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/76.2.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
76.2.pdb title:  
Title t= 76200.00000 step= 38100000 [more info...]  
  
Chain information for 76.2.pdb #382  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 76.2.pdb #382  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/76.4.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/76.4.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
76.4.pdb title:  
Title t= 76400.00000 step= 38200000 [more info...]  
  
Chain information for 76.4.pdb #383  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 76.4.pdb #383  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/76.6.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/76.6.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
76.6.pdb title:  
Title t= 76600.00000 step= 38300000 [more info...]  
  
Chain information for 76.6.pdb #384  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 76.6.pdb #384  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/76.8.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/76.8.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
76.8.pdb title:  
Title t= 76800.00000 step= 38400000 [more info...]  
  
Chain information for 76.8.pdb #385  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 76.8.pdb #385  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/77.0.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/77.0.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
77.0.pdb title:  
Title t= 77000.00000 step= 38500000 [more info...]  
  
Chain information for 77.0.pdb #386  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 77.0.pdb #386  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/77.2.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/77.2.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
77.2.pdb title:  
Title t= 77200.00000 step= 38600000 [more info...]  
  
Chain information for 77.2.pdb #387  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 77.2.pdb #387  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/77.4.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/77.4.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
77.4.pdb title:  
Title t= 77400.00000 step= 38700000 [more info...]  
  
Chain information for 77.4.pdb #388  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 77.4.pdb #388  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/77.6.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/77.6.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
77.6.pdb title:  
Title t= 77600.00000 step= 38800000 [more info...]  
  
Chain information for 77.6.pdb #389  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 77.6.pdb #389  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/77.8.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/77.8.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
77.8.pdb title:  
Title t= 77800.00000 step= 38900000 [more info...]  
  
Chain information for 77.8.pdb #390  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 77.8.pdb #390  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/78.0.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/78.0.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
78.0.pdb title:  
Title t= 78000.00000 step= 39000000 [more info...]  
  
Chain information for 78.0.pdb #391  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 78.0.pdb #391  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/78.2.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/78.2.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
78.2.pdb title:  
Title t= 78200.00000 step= 39100000 [more info...]  
  
Chain information for 78.2.pdb #392  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 78.2.pdb #392  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/78.4.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/78.4.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
78.4.pdb title:  
Title t= 78400.00000 step= 39200000 [more info...]  
  
Chain information for 78.4.pdb #393  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 78.4.pdb #393  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/78.6.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/78.6.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
78.6.pdb title:  
Title t= 78600.00000 step= 39300000 [more info...]  
  
Chain information for 78.6.pdb #394  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 78.6.pdb #394  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/78.8.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/78.8.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
78.8.pdb title:  
Title t= 78800.00000 step= 39400000 [more info...]  
  
Chain information for 78.8.pdb #395  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 78.8.pdb #395  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/79.0.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/79.0.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
79.0.pdb title:  
Title t= 79000.00000 step= 39500000 [more info...]  
  
Chain information for 79.0.pdb #396  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 79.0.pdb #396  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/79.2.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/79.2.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
79.2.pdb title:  
Title t= 79200.00000 step= 39600000 [more info...]  
  
Chain information for 79.2.pdb #397  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 79.2.pdb #397  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/79.4.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/79.4.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
79.4.pdb title:  
Title t= 79400.00000 step= 39700000 [more info...]  
  
Chain information for 79.4.pdb #398  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 79.4.pdb #398  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/79.6.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/79.6.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
79.6.pdb title:  
Title t= 79600.00000 step= 39800000 [more info...]  
  
Chain information for 79.6.pdb #399  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 79.6.pdb #399  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/79.8.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/79.8.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
79.8.pdb title:  
Title t= 79800.00000 step= 39900000 [more info...]  
  
Chain information for 79.8.pdb #400  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 79.8.pdb #400  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/80.0.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/80.0.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
80.0.pdb title:  
Title t= 80000.00000 step= 40000000 [more info...]  
  
Chain information for 80.0.pdb #401  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 80.0.pdb #401  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/80.2.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/80.2.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
80.2.pdb title:  
Title t= 80200.00000 step= 40100000 [more info...]  
  
Chain information for 80.2.pdb #402  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 80.2.pdb #402  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/80.4.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/80.4.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
80.4.pdb title:  
Title t= 80400.00000 step= 40200000 [more info...]  
  
Chain information for 80.4.pdb #403  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 80.4.pdb #403  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/80.6.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/80.6.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
80.6.pdb title:  
Title t= 80600.00000 step= 40300000 [more info...]  
  
Chain information for 80.6.pdb #404  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 80.6.pdb #404  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/80.8.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/80.8.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
80.8.pdb title:  
Title t= 80800.00000 step= 40400000 [more info...]  
  
Chain information for 80.8.pdb #405  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 80.8.pdb #405  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/81.0.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/81.0.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
81.0.pdb title:  
Title t= 81000.00000 step= 40500000 [more info...]  
  
Chain information for 81.0.pdb #406  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 81.0.pdb #406  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/81.2.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/81.2.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
81.2.pdb title:  
Title t= 81200.00000 step= 40600000 [more info...]  
  
Chain information for 81.2.pdb #407  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 81.2.pdb #407  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/81.4.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/81.4.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
81.4.pdb title:  
Title t= 81400.00000 step= 40700000 [more info...]  
  
Chain information for 81.4.pdb #408  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 81.4.pdb #408  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/81.6.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/81.6.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
81.6.pdb title:  
Title t= 81600.00000 step= 40800000 [more info...]  
  
Chain information for 81.6.pdb #409  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 81.6.pdb #409  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/81.8.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/81.8.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
81.8.pdb title:  
Title t= 81800.00000 step= 40900000 [more info...]  
  
Chain information for 81.8.pdb #410  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 81.8.pdb #410  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/82.0.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/82.0.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
82.0.pdb title:  
Title t= 82000.00000 step= 41000000 [more info...]  
  
Chain information for 82.0.pdb #411  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 82.0.pdb #411  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/82.2.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/82.2.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
82.2.pdb title:  
Title t= 82200.00000 step= 41100000 [more info...]  
  
Chain information for 82.2.pdb #412  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 82.2.pdb #412  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/82.4.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/82.4.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
82.4.pdb title:  
Title t= 82400.00000 step= 41200000 [more info...]  
  
Chain information for 82.4.pdb #413  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 82.4.pdb #413  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/82.6.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/82.6.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
82.6.pdb title:  
Title t= 82600.00000 step= 41300000 [more info...]  
  
Chain information for 82.6.pdb #414  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 82.6.pdb #414  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/82.8.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/82.8.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
82.8.pdb title:  
Title t= 82800.00000 step= 41400000 [more info...]  
  
Chain information for 82.8.pdb #415  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 82.8.pdb #415  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/83.0.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/83.0.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
83.0.pdb title:  
Title t= 83000.00000 step= 41500000 [more info...]  
  
Chain information for 83.0.pdb #416  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 83.0.pdb #416  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/83.2.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/83.2.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
83.2.pdb title:  
Title t= 83200.00000 step= 41600000 [more info...]  
  
Chain information for 83.2.pdb #417  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 83.2.pdb #417  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/83.4.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/83.4.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
83.4.pdb title:  
Title t= 83400.00000 step= 41700000 [more info...]  
  
Chain information for 83.4.pdb #418  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 83.4.pdb #418  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/83.6.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/83.6.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
83.6.pdb title:  
Title t= 83600.00000 step= 41800000 [more info...]  
  
Chain information for 83.6.pdb #419  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 83.6.pdb #419  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/83.8.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/83.8.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
83.8.pdb title:  
Title t= 83800.00000 step= 41900000 [more info...]  
  
Chain information for 83.8.pdb #420  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 83.8.pdb #420  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/84.0.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/84.0.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
84.0.pdb title:  
Title t= 84000.00000 step= 42000000 [more info...]  
  
Chain information for 84.0.pdb #421  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 84.0.pdb #421  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/84.2.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/84.2.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
84.2.pdb title:  
Title t= 84200.00000 step= 42100000 [more info...]  
  
Chain information for 84.2.pdb #422  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 84.2.pdb #422  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/84.4.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/84.4.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
84.4.pdb title:  
Title t= 84400.00000 step= 42200000 [more info...]  
  
Chain information for 84.4.pdb #423  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 84.4.pdb #423  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/84.6.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/84.6.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
84.6.pdb title:  
Title t= 84600.00000 step= 42300000 [more info...]  
  
Chain information for 84.6.pdb #424  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 84.6.pdb #424  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/84.8.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/84.8.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
84.8.pdb title:  
Title t= 84800.00000 step= 42400000 [more info...]  
  
Chain information for 84.8.pdb #425  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 84.8.pdb #425  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/85.0.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/85.0.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
85.0.pdb title:  
Title t= 85000.00000 step= 42500000 [more info...]  
  
Chain information for 85.0.pdb #426  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 85.0.pdb #426  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/85.2.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/85.2.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
85.2.pdb title:  
Title t= 85200.00000 step= 42600000 [more info...]  
  
Chain information for 85.2.pdb #427  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 85.2.pdb #427  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/85.4.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/85.4.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
85.4.pdb title:  
Title t= 85400.00000 step= 42700000 [more info...]  
  
Chain information for 85.4.pdb #428  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 85.4.pdb #428  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/85.6.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/85.6.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
85.6.pdb title:  
Title t= 85600.00000 step= 42800000 [more info...]  
  
Chain information for 85.6.pdb #429  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 85.6.pdb #429  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/85.8.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/85.8.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
85.8.pdb title:  
Title t= 85800.00000 step= 42900000 [more info...]  
  
Chain information for 85.8.pdb #430  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 85.8.pdb #430  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/86.0.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/86.0.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
86.0.pdb title:  
Title t= 86000.00000 step= 43000000 [more info...]  
  
Chain information for 86.0.pdb #431  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 86.0.pdb #431  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/86.2.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/86.2.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
86.2.pdb title:  
Title t= 86200.00000 step= 43100000 [more info...]  
  
Chain information for 86.2.pdb #432  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 86.2.pdb #432  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/86.4.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/86.4.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
86.4.pdb title:  
Title t= 86400.00000 step= 43200000 [more info...]  
  
Chain information for 86.4.pdb #433  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 86.4.pdb #433  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/86.6.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/86.6.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
86.6.pdb title:  
Title t= 86600.00000 step= 43300000 [more info...]  
  
Chain information for 86.6.pdb #434  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 86.6.pdb #434  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/86.8.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/86.8.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
86.8.pdb title:  
Title t= 86800.00000 step= 43400000 [more info...]  
  
Chain information for 86.8.pdb #435  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 86.8.pdb #435  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/87.0.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/87.0.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
87.0.pdb title:  
Title t= 87000.00000 step= 43500000 [more info...]  
  
Chain information for 87.0.pdb #436  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 87.0.pdb #436  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/87.2.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/87.2.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
87.2.pdb title:  
Title t= 87200.00000 step= 43600000 [more info...]  
  
Chain information for 87.2.pdb #437  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 87.2.pdb #437  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/87.4.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/87.4.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
87.4.pdb title:  
Title t= 87400.00000 step= 43700000 [more info...]  
  
Chain information for 87.4.pdb #438  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 87.4.pdb #438  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/87.6.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/87.6.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
87.6.pdb title:  
Title t= 87600.00000 step= 43800000 [more info...]  
  
Chain information for 87.6.pdb #439  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 87.6.pdb #439  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/87.8.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/87.8.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
87.8.pdb title:  
Title t= 87800.00000 step= 43900000 [more info...]  
  
Chain information for 87.8.pdb #440  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 87.8.pdb #440  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/88.0.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/88.0.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
88.0.pdb title:  
Title t= 88000.00000 step= 44000000 [more info...]  
  
Chain information for 88.0.pdb #441  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 88.0.pdb #441  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/88.2.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/88.2.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
88.2.pdb title:  
Title t= 88200.00000 step= 44100000 [more info...]  
  
Chain information for 88.2.pdb #442  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 88.2.pdb #442  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/88.4.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/88.4.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
88.4.pdb title:  
Title t= 88400.00000 step= 44200000 [more info...]  
  
Chain information for 88.4.pdb #443  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 88.4.pdb #443  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/88.6.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/88.6.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
88.6.pdb title:  
Title t= 88600.00000 step= 44300000 [more info...]  
  
Chain information for 88.6.pdb #444  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 88.6.pdb #444  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/88.8.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/88.8.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
88.8.pdb title:  
Title t= 88800.00000 step= 44400000 [more info...]  
  
Chain information for 88.8.pdb #445  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 88.8.pdb #445  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/89.0.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/89.0.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
89.0.pdb title:  
Title t= 89000.00000 step= 44500000 [more info...]  
  
Chain information for 89.0.pdb #446  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 89.0.pdb #446  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/89.2.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/89.2.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
89.2.pdb title:  
Title t= 89200.00000 step= 44600000 [more info...]  
  
Chain information for 89.2.pdb #447  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 89.2.pdb #447  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/89.4.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/89.4.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
89.4.pdb title:  
Title t= 89400.00000 step= 44700000 [more info...]  
  
Chain information for 89.4.pdb #448  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 89.4.pdb #448  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/89.6.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/89.6.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
89.6.pdb title:  
Title t= 89600.00000 step= 44800000 [more info...]  
  
Chain information for 89.6.pdb #449  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 89.6.pdb #449  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/89.8.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/89.8.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
89.8.pdb title:  
Title t= 89800.00000 step= 44900000 [more info...]  
  
Chain information for 89.8.pdb #450  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 89.8.pdb #450  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/90.0.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/90.0.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
90.0.pdb title:  
Title t= 90000.00000 step= 45000000 [more info...]  
  
Chain information for 90.0.pdb #451  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 90.0.pdb #451  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/90.2.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/90.2.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
90.2.pdb title:  
Title t= 90200.00000 step= 45100000 [more info...]  
  
Chain information for 90.2.pdb #452  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 90.2.pdb #452  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/90.4.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/90.4.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
90.4.pdb title:  
Title t= 90400.00000 step= 45200000 [more info...]  
  
Chain information for 90.4.pdb #453  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 90.4.pdb #453  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/90.6.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/90.6.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
90.6.pdb title:  
Title t= 90600.00000 step= 45300000 [more info...]  
  
Chain information for 90.6.pdb #454  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 90.6.pdb #454  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/90.8.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/90.8.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
90.8.pdb title:  
Title t= 90800.00000 step= 45400000 [more info...]  
  
Chain information for 90.8.pdb #455  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 90.8.pdb #455  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/91.0.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/91.0.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
91.0.pdb title:  
Title t= 91000.00000 step= 45500000 [more info...]  
  
Chain information for 91.0.pdb #456  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 91.0.pdb #456  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/91.2.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/91.2.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
91.2.pdb title:  
Title t= 91200.00000 step= 45600000 [more info...]  
  
Chain information for 91.2.pdb #457  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 91.2.pdb #457  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/91.4.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/91.4.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
91.4.pdb title:  
Title t= 91400.00000 step= 45700000 [more info...]  
  
Chain information for 91.4.pdb #458  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 91.4.pdb #458  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/91.6.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/91.6.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
91.6.pdb title:  
Title t= 91600.00000 step= 45800000 [more info...]  
  
Chain information for 91.6.pdb #459  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 91.6.pdb #459  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/91.8.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/91.8.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
91.8.pdb title:  
Title t= 91800.00000 step= 45900000 [more info...]  
  
Chain information for 91.8.pdb #460  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 91.8.pdb #460  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/92.0.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/92.0.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
92.0.pdb title:  
Title t= 92000.00000 step= 46000000 [more info...]  
  
Chain information for 92.0.pdb #461  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 92.0.pdb #461  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/92.2.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/92.2.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
92.2.pdb title:  
Title t= 92200.00000 step= 46100000 [more info...]  
  
Chain information for 92.2.pdb #462  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 92.2.pdb #462  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/92.4.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/92.4.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
92.4.pdb title:  
Title t= 92400.00000 step= 46200000 [more info...]  
  
Chain information for 92.4.pdb #463  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 92.4.pdb #463  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/92.6.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/92.6.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
92.6.pdb title:  
Title t= 92600.00000 step= 46300000 [more info...]  
  
Chain information for 92.6.pdb #464  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 92.6.pdb #464  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/92.8.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/92.8.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
92.8.pdb title:  
Title t= 92800.00000 step= 46400000 [more info...]  
  
Chain information for 92.8.pdb #465  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 92.8.pdb #465  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/93.0.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/93.0.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
93.0.pdb title:  
Title t= 93000.00000 step= 46500000 [more info...]  
  
Chain information for 93.0.pdb #466  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 93.0.pdb #466  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/93.2.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/93.2.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
93.2.pdb title:  
Title t= 93200.00000 step= 46600000 [more info...]  
  
Chain information for 93.2.pdb #467  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 93.2.pdb #467  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/93.4.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/93.4.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
93.4.pdb title:  
Title t= 93400.00000 step= 46700000 [more info...]  
  
Chain information for 93.4.pdb #468  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 93.4.pdb #468  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/93.6.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/93.6.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
93.6.pdb title:  
Title t= 93600.00000 step= 46800000 [more info...]  
  
Chain information for 93.6.pdb #469  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 93.6.pdb #469  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/93.8.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/93.8.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
93.8.pdb title:  
Title t= 93800.00000 step= 46900000 [more info...]  
  
Chain information for 93.8.pdb #470  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 93.8.pdb #470  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/94.0.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/94.0.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
94.0.pdb title:  
Title t= 94000.00000 step= 47000000 [more info...]  
  
Chain information for 94.0.pdb #471  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 94.0.pdb #471  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/94.2.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/94.2.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
94.2.pdb title:  
Title t= 94200.00000 step= 47100000 [more info...]  
  
Chain information for 94.2.pdb #472  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 94.2.pdb #472  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/94.4.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/94.4.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
94.4.pdb title:  
Title t= 94400.00000 step= 47200000 [more info...]  
  
Chain information for 94.4.pdb #473  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 94.4.pdb #473  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/94.6.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/94.6.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
94.6.pdb title:  
Title t= 94600.00000 step= 47300000 [more info...]  
  
Chain information for 94.6.pdb #474  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 94.6.pdb #474  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/94.8.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/94.8.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
94.8.pdb title:  
Title t= 94800.00000 step= 47400000 [more info...]  
  
Chain information for 94.8.pdb #475  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 94.8.pdb #475  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/95.0.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/95.0.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
95.0.pdb title:  
Title t= 95000.00000 step= 47500000 [more info...]  
  
Chain information for 95.0.pdb #476  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 95.0.pdb #476  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/95.2.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/95.2.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
95.2.pdb title:  
Title t= 95200.00000 step= 47600000 [more info...]  
  
Chain information for 95.2.pdb #477  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 95.2.pdb #477  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/95.4.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/95.4.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
95.4.pdb title:  
Title t= 95400.00000 step= 47700000 [more info...]  
  
Chain information for 95.4.pdb #478  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 95.4.pdb #478  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/95.6.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/95.6.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
95.6.pdb title:  
Title t= 95600.00000 step= 47800000 [more info...]  
  
Chain information for 95.6.pdb #479  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 95.6.pdb #479  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/95.8.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/95.8.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
95.8.pdb title:  
Title t= 95800.00000 step= 47900000 [more info...]  
  
Chain information for 95.8.pdb #480  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 95.8.pdb #480  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/96.0.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/96.0.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
96.0.pdb title:  
Title t= 96000.00000 step= 48000000 [more info...]  
  
Chain information for 96.0.pdb #481  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 96.0.pdb #481  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/96.2.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/96.2.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
96.2.pdb title:  
Title t= 96200.00000 step= 48100000 [more info...]  
  
Chain information for 96.2.pdb #482  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 96.2.pdb #482  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/96.4.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/96.4.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
96.4.pdb title:  
Title t= 96400.00000 step= 48200000 [more info...]  
  
Chain information for 96.4.pdb #483  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 96.4.pdb #483  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/96.6.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/96.6.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
96.6.pdb title:  
Title t= 96600.00000 step= 48300000 [more info...]  
  
Chain information for 96.6.pdb #484  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 96.6.pdb #484  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/96.8.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/96.8.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
96.8.pdb title:  
Title t= 96800.00000 step= 48400000 [more info...]  
  
Chain information for 96.8.pdb #485  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 96.8.pdb #485  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/97.0.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/97.0.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
97.0.pdb title:  
Title t= 97000.00000 step= 48500000 [more info...]  
  
Chain information for 97.0.pdb #486  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 97.0.pdb #486  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/97.2.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/97.2.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
97.2.pdb title:  
Title t= 97200.00000 step= 48600000 [more info...]  
  
Chain information for 97.2.pdb #487  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 97.2.pdb #487  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/97.4.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/97.4.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
97.4.pdb title:  
Title t= 97400.00000 step= 48700000 [more info...]  
  
Chain information for 97.4.pdb #488  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 97.4.pdb #488  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/97.6.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/97.6.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
97.6.pdb title:  
Title t= 97600.00000 step= 48800000 [more info...]  
  
Chain information for 97.6.pdb #489  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 97.6.pdb #489  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/97.8.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/97.8.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
97.8.pdb title:  
Title t= 97800.00000 step= 48900000 [more info...]  
  
Chain information for 97.8.pdb #490  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 97.8.pdb #490  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/98.0.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/98.0.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
98.0.pdb title:  
Title t= 98000.00000 step= 49000000 [more info...]  
  
Chain information for 98.0.pdb #491  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 98.0.pdb #491  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/98.2.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/98.2.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
98.2.pdb title:  
Title t= 98200.00000 step= 49100000 [more info...]  
  
Chain information for 98.2.pdb #492  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 98.2.pdb #492  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/98.4.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/98.4.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
98.4.pdb title:  
Title t= 98400.00000 step= 49200000 [more info...]  
  
Chain information for 98.4.pdb #493  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 98.4.pdb #493  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/98.6.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/98.6.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
98.6.pdb title:  
Title t= 98600.00000 step= 49300000 [more info...]  
  
Chain information for 98.6.pdb #494  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 98.6.pdb #494  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/98.8.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/98.8.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
98.8.pdb title:  
Title t= 98800.00000 step= 49400000 [more info...]  
  
Chain information for 98.8.pdb #495  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 98.8.pdb #495  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/99.0.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/99.0.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
99.0.pdb title:  
Title t= 99000.00000 step= 49500000 [more info...]  
  
Chain information for 99.0.pdb #496  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 99.0.pdb #496  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/99.2.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/99.2.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
99.2.pdb title:  
Title t= 99200.00000 step= 49600000 [more info...]  
  
Chain information for 99.2.pdb #497  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 99.2.pdb #497  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/99.4.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/99.4.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
99.4.pdb title:  
Title t= 99400.00000 step= 49700000 [more info...]  
  
Chain information for 99.4.pdb #498  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 99.4.pdb #498  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/99.6.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/99.6.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
99.6.pdb title:  
Title t= 99600.00000 step= 49800000 [more info...]  
  
Chain information for 99.6.pdb #499  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 99.6.pdb #499  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/99.8.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/99.8.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
99.8.pdb title:  
Title t= 99800.00000 step= 49900000 [more info...]  
  
Chain information for 99.8.pdb #500  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 99.8.pdb #500  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/100.0.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/100.0.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
100.0.pdb title:  
Title t= 100000.00000 step= 50000000 [more info...]  
  
Chain information for 100.0.pdb #501  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 100.0.pdb #501  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/100.2.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/100.2.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
100.2.pdb title:  
Title t= 100200.00000 step= 50100000 [more info...]  
  
Chain information for 100.2.pdb #502  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 100.2.pdb #502  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/100.4.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/100.4.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
100.4.pdb title:  
Title t= 100400.00000 step= 50200000 [more info...]  
  
Chain information for 100.4.pdb #503  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 100.4.pdb #503  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/100.6.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/100.6.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
100.6.pdb title:  
Title t= 100600.00000 step= 50300000 [more info...]  
  
Chain information for 100.6.pdb #504  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 100.6.pdb #504  
---  
HSD — (HSD)  
POT — (POT)  
  

> open
> /Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/100.8.pdb

Summary of feedback from opening
/Users/zju/Downloads/00_TREK/water_2nm_SOLU_POT/ConK300mM/alone4/0_100ns/100.8.pdb  
---  
warnings | Ignored bad PDB record found on line 1  
REMARK GENERATED BY TRJCONV  
  
Ignored bad PDB record found on line 3  
REMARK THIS IS A SIMULATION BOX  
  
100.8.pdb title:  
Title t= 100800.00000 step= 50400000 [more info...]  
  
Chain information for 100.8.pdb #505  
---  
Chain | Description  
A B | No description available  
  
Non-standard residues in 100.8.pdb #505  
---  
HSD — (HSD)  
POT — (POT)  
  

> open new_setting.cxc

> preset "overall look" "publication 1 (silhouettes)"

Using preset: Overall Look / Publication 1 (Silhouettes)  
Preset expands to these ChimeraX commands:

    
    
    set bg white
    graphics silhouettes t
    lighting depthCue f

  

> lighting soft

> matchmaker #2-505 to #1

Parameters  
---  
Chain pairing | bb  
Alignment algorithm | Needleman-Wunsch  
Similarity matrix | BLOSUM-62  
SS fraction | 0.3  
Gap open (HH/SS/other) | 18/18/6  
Gap extend | 1  
SS matrix |  |  | H | S | O  
---|---|---|---  
H | 6 | -9 | -6  
S |  | 6 | -6  
O |  |  | 4  
Iteration cutoff | 2  
  
Matchmaker 0.pdb, chain B (#1) with 0.2.pdb, chain B (#2), sequence alignment
score = 1696.3  
RMSD between 303 pruned atom pairs is 0.930 angstroms; (across all 330 pairs:
1.212)  
  
Matchmaker 0.pdb, chain B (#1) with 0.4.pdb, chain A (#3), sequence alignment
score = 1699.3  
RMSD between 235 pruned atom pairs is 1.040 angstroms; (across all 330 pairs:
2.353)  
  
Matchmaker 0.pdb, chain B (#1) with 0.6.pdb, chain A (#4), sequence alignment
score = 1689.7  
RMSD between 252 pruned atom pairs is 0.921 angstroms; (across all 330 pairs:
2.743)  
  
Matchmaker 0.pdb, chain B (#1) with 0.8.pdb, chain B (#5), sequence alignment
score = 1689.1  
RMSD between 261 pruned atom pairs is 1.004 angstroms; (across all 330 pairs:
2.388)  
  
Matchmaker 0.pdb, chain B (#1) with 1.0.pdb, chain A (#6), sequence alignment
score = 1689.1  
RMSD between 249 pruned atom pairs is 0.945 angstroms; (across all 330 pairs:
3.801)  
  
Matchmaker 0.pdb, chain B (#1) with 1.2.pdb, chain B (#7), sequence alignment
score = 1692.7  
RMSD between 242 pruned atom pairs is 0.886 angstroms; (across all 330 pairs:
2.246)  
  
Matchmaker 0.pdb, chain B (#1) with 1.4.pdb, chain B (#8), sequence alignment
score = 1696.3  
RMSD between 273 pruned atom pairs is 0.998 angstroms; (across all 330 pairs:
1.983)  
  
Matchmaker 0.pdb, chain B (#1) with 1.6.pdb, chain B (#9), sequence alignment
score = 1683.7  
RMSD between 257 pruned atom pairs is 0.967 angstroms; (across all 330 pairs:
2.018)  
  
Matchmaker 0.pdb, chain A (#1) with 1.8.pdb, chain A (#10), sequence alignment
score = 1681.9  
RMSD between 241 pruned atom pairs is 0.935 angstroms; (across all 330 pairs:
4.984)  
  
Matchmaker 0.pdb, chain B (#1) with 2.0.pdb, chain A (#11), sequence alignment
score = 1678.3  
RMSD between 242 pruned atom pairs is 0.967 angstroms; (across all 330 pairs:
4.385)  
  
Matchmaker 0.pdb, chain B (#1) with 2.2.pdb, chain A (#12), sequence alignment
score = 1678.3  
RMSD between 231 pruned atom pairs is 0.990 angstroms; (across all 330 pairs:
4.915)  
  
Matchmaker 0.pdb, chain A (#1) with 2.4.pdb, chain A (#13), sequence alignment
score = 1684.9  
RMSD between 242 pruned atom pairs is 0.907 angstroms; (across all 330 pairs:
5.581)  
  
Matchmaker 0.pdb, chain A (#1) with 2.6.pdb, chain B (#14), sequence alignment
score = 1692.7  
RMSD between 238 pruned atom pairs is 1.066 angstroms; (across all 330 pairs:
2.092)  
  
Matchmaker 0.pdb, chain B (#1) with 2.8.pdb, chain B (#15), sequence alignment
score = 1690.3  
RMSD between 241 pruned atom pairs is 0.982 angstroms; (across all 330 pairs:
2.179)  
  
Matchmaker 0.pdb, chain B (#1) with 3.0.pdb, chain A (#16), sequence alignment
score = 1688.5  
RMSD between 238 pruned atom pairs is 0.870 angstroms; (across all 330 pairs:
5.454)  
  
Matchmaker 0.pdb, chain B (#1) with 3.2.pdb, chain B (#17), sequence alignment
score = 1683.1  
RMSD between 284 pruned atom pairs is 1.156 angstroms; (across all 330 pairs:
1.618)  
  
Matchmaker 0.pdb, chain B (#1) with 3.4.pdb, chain B (#18), sequence alignment
score = 1683.7  
RMSD between 270 pruned atom pairs is 1.073 angstroms; (across all 330 pairs:
2.131)  
  
Matchmaker 0.pdb, chain B (#1) with 3.6.pdb, chain B (#19), sequence alignment
score = 1683.7  
RMSD between 224 pruned atom pairs is 0.928 angstroms; (across all 330 pairs:
2.944)  
  
Matchmaker 0.pdb, chain B (#1) with 3.8.pdb, chain B (#20), sequence alignment
score = 1692.7  
RMSD between 223 pruned atom pairs is 0.868 angstroms; (across all 330 pairs:
3.574)  
  
Matchmaker 0.pdb, chain B (#1) with 4.0.pdb, chain B (#21), sequence alignment
score = 1692.7  
RMSD between 216 pruned atom pairs is 0.987 angstroms; (across all 330 pairs:
3.346)  
  
Matchmaker 0.pdb, chain B (#1) with 4.2.pdb, chain A (#22), sequence alignment
score = 1689.1  
RMSD between 247 pruned atom pairs is 0.908 angstroms; (across all 330 pairs:
2.844)  
  
Matchmaker 0.pdb, chain A (#1) with 4.4.pdb, chain A (#23), sequence alignment
score = 1688.5  
RMSD between 239 pruned atom pairs is 0.876 angstroms; (across all 330 pairs:
2.450)  
  
Matchmaker 0.pdb, chain B (#1) with 4.6.pdb, chain B (#24), sequence alignment
score = 1688.5  
RMSD between 231 pruned atom pairs is 1.039 angstroms; (across all 330 pairs:
2.100)  
  
Matchmaker 0.pdb, chain B (#1) with 4.8.pdb, chain B (#25), sequence alignment
score = 1692.7  
RMSD between 221 pruned atom pairs is 1.061 angstroms; (across all 330 pairs:
2.374)  
  
Matchmaker 0.pdb, chain A (#1) with 5.0.pdb, chain A (#26), sequence alignment
score = 1681.9  
RMSD between 277 pruned atom pairs is 0.914 angstroms; (across all 330 pairs:
1.761)  
  
Matchmaker 0.pdb, chain B (#1) with 5.2.pdb, chain B (#27), sequence alignment
score = 1682.5  
RMSD between 252 pruned atom pairs is 1.087 angstroms; (across all 330 pairs:
1.724)  
  
Matchmaker 0.pdb, chain B (#1) with 5.4.pdb, chain B (#28), sequence alignment
score = 1675.9  
RMSD between 239 pruned atom pairs is 1.062 angstroms; (across all 330 pairs:
2.011)  
  
Matchmaker 0.pdb, chain B (#1) with 5.6.pdb, chain B (#29), sequence alignment
score = 1692.1  
RMSD between 210 pruned atom pairs is 0.944 angstroms; (across all 330 pairs:
2.938)  
  
Matchmaker 0.pdb, chain B (#1) with 5.8.pdb, chain B (#30), sequence alignment
score = 1677.1  
RMSD between 232 pruned atom pairs is 0.954 angstroms; (across all 330 pairs:
3.146)  
  
Matchmaker 0.pdb, chain B (#1) with 6.0.pdb, chain B (#31), sequence alignment
score = 1682.5  
RMSD between 241 pruned atom pairs is 0.991 angstroms; (across all 330 pairs:
2.782)  
  
Matchmaker 0.pdb, chain B (#1) with 6.2.pdb, chain B (#32), sequence alignment
score = 1672.3  
RMSD between 235 pruned atom pairs is 1.030 angstroms; (across all 330 pairs:
3.447)  
  
Matchmaker 0.pdb, chain B (#1) with 6.4.pdb, chain B (#33), sequence alignment
score = 1692.1  
RMSD between 219 pruned atom pairs is 0.916 angstroms; (across all 330 pairs:
3.846)  
  
Matchmaker 0.pdb, chain B (#1) with 6.6.pdb, chain A (#34), sequence alignment
score = 1689.1  
RMSD between 216 pruned atom pairs is 1.077 angstroms; (across all 330 pairs:
4.776)  
  
Matchmaker 0.pdb, chain B (#1) with 6.8.pdb, chain B (#35), sequence alignment
score = 1686.1  
RMSD between 224 pruned atom pairs is 0.970 angstroms; (across all 330 pairs:
3.297)  
  
Matchmaker 0.pdb, chain B (#1) with 7.0.pdb, chain A (#36), sequence alignment
score = 1675.3  
RMSD between 212 pruned atom pairs is 0.973 angstroms; (across all 330 pairs:
4.261)  
  
Matchmaker 0.pdb, chain B (#1) with 7.2.pdb, chain B (#37), sequence alignment
score = 1689.1  
RMSD between 220 pruned atom pairs is 0.939 angstroms; (across all 330 pairs:
3.298)  
  
Matchmaker 0.pdb, chain B (#1) with 7.4.pdb, chain B (#38), sequence alignment
score = 1683.7  
RMSD between 213 pruned atom pairs is 1.009 angstroms; (across all 330 pairs:
3.727)  
  
Matchmaker 0.pdb, chain B (#1) with 7.6.pdb, chain B (#39), sequence alignment
score = 1673.5  
RMSD between 213 pruned atom pairs is 0.928 angstroms; (across all 330 pairs:
3.421)  
  
Matchmaker 0.pdb, chain B (#1) with 7.8.pdb, chain B (#40), sequence alignment
score = 1676.5  
RMSD between 221 pruned atom pairs is 0.932 angstroms; (across all 330 pairs:
3.391)  
  
Matchmaker 0.pdb, chain B (#1) with 8.0.pdb, chain B (#41), sequence alignment
score = 1685.5  
RMSD between 230 pruned atom pairs is 0.949 angstroms; (across all 330 pairs:
2.692)  
  
Matchmaker 0.pdb, chain A (#1) with 8.2.pdb, chain B (#42), sequence alignment
score = 1685.5  
RMSD between 228 pruned atom pairs is 0.953 angstroms; (across all 330 pairs:
2.213)  
  
Matchmaker 0.pdb, chain B (#1) with 8.4.pdb, chain B (#43), sequence alignment
score = 1674.7  
RMSD between 216 pruned atom pairs is 0.972 angstroms; (across all 330 pairs:
2.040)  
  
Matchmaker 0.pdb, chain A (#1) with 8.6.pdb, chain B (#44), sequence alignment
score = 1675.3  
RMSD between 246 pruned atom pairs is 1.125 angstroms; (across all 330 pairs:
1.897)  
  
Matchmaker 0.pdb, chain B (#1) with 8.8.pdb, chain B (#45), sequence alignment
score = 1686.1  
RMSD between 235 pruned atom pairs is 0.942 angstroms; (across all 330 pairs:
2.376)  
  
Matchmaker 0.pdb, chain A (#1) with 9.0.pdb, chain A (#46), sequence alignment
score = 1678.3  
RMSD between 233 pruned atom pairs is 0.987 angstroms; (across all 330 pairs:
2.555)  
  
Matchmaker 0.pdb, chain B (#1) with 9.2.pdb, chain B (#47), sequence alignment
score = 1668.1  
RMSD between 254 pruned atom pairs is 1.063 angstroms; (across all 330 pairs:
1.656)  
  
Matchmaker 0.pdb, chain B (#1) with 9.4.pdb, chain B (#48), sequence alignment
score = 1678.3  
RMSD between 251 pruned atom pairs is 0.963 angstroms; (across all 330 pairs:
1.968)  
  
Matchmaker 0.pdb, chain A (#1) with 9.6.pdb, chain B (#49), sequence alignment
score = 1688.5  
RMSD between 253 pruned atom pairs is 1.082 angstroms; (across all 330 pairs:
1.816)  
  
Matchmaker 0.pdb, chain B (#1) with 9.8.pdb, chain B (#50), sequence alignment
score = 1685.5  
RMSD between 251 pruned atom pairs is 0.983 angstroms; (across all 330 pairs:
1.958)  
  
Matchmaker 0.pdb, chain B (#1) with 10.0.pdb, chain B (#51), sequence
alignment score = 1685.5  
RMSD between 255 pruned atom pairs is 1.040 angstroms; (across all 330 pairs:
1.876)  
  
Matchmaker 0.pdb, chain B (#1) with 10.2.pdb, chain B (#52), sequence
alignment score = 1689.1  
RMSD between 246 pruned atom pairs is 1.003 angstroms; (across all 330 pairs:
1.853)  
  
Matchmaker 0.pdb, chain B (#1) with 10.4.pdb, chain B (#53), sequence
alignment score = 1692.7  
RMSD between 233 pruned atom pairs is 1.036 angstroms; (across all 330 pairs:
2.935)  
  
Matchmaker 0.pdb, chain B (#1) with 10.6.pdb, chain B (#54), sequence
alignment score = 1688.5  
RMSD between 265 pruned atom pairs is 0.975 angstroms; (across all 330 pairs:
1.715)  
  
Matchmaker 0.pdb, chain B (#1) with 10.8.pdb, chain B (#55), sequence
alignment score = 1692.7  
RMSD between 221 pruned atom pairs is 0.918 angstroms; (across all 330 pairs:
3.125)  
  
Matchmaker 0.pdb, chain B (#1) with 11.0.pdb, chain B (#56), sequence
alignment score = 1696.3  
RMSD between 273 pruned atom pairs is 0.967 angstroms; (across all 330 pairs:
2.476)  
  
Matchmaker 0.pdb, chain B (#1) with 11.2.pdb, chain B (#57), sequence
alignment score = 1693.3  
RMSD between 262 pruned atom pairs is 1.062 angstroms; (across all 330 pairs:
1.825)  
  
Matchmaker 0.pdb, chain B (#1) with 11.4.pdb, chain B (#58), sequence
alignment score = 1695.7  
RMSD between 245 pruned atom pairs is 0.965 angstroms; (across all 330 pairs:
1.945)  
  
Matchmaker 0.pdb, chain B (#1) with 11.6.pdb, chain B (#59), sequence
alignment score = 1681.9  
RMSD between 230 pruned atom pairs is 1.012 angstroms; (across all 330 pairs:
2.238)  
  
Matchmaker 0.pdb, chain B (#1) with 11.8.pdb, chain B (#60), sequence
alignment score = 1678.9  
RMSD between 232 pruned atom pairs is 0.881 angstroms; (across all 330 pairs:
2.696)  
  
Matchmaker 0.pdb, chain B (#1) with 12.0.pdb, chain B (#61), sequence
alignment score = 1692.7  
RMSD between 211 pruned atom pairs is 0.934 angstroms; (across all 330 pairs:
3.410)  
  
Matchmaker 0.pdb, chain B (#1) with 12.2.pdb, chain B (#62), sequence
alignment score = 1692.7  
RMSD between 202 pruned atom pairs is 0.881 angstroms; (across all 330 pairs:
2.372)  
  
Matchmaker 0.pdb, chain B (#1) with 12.4.pdb, chain B (#63), sequence
alignment score = 1686.1  
RMSD between 214 pruned atom pairs is 0.847 angstroms; (across all 330 pairs:
2.459)  
  
Matchmaker 0.pdb, chain B (#1) with 12.6.pdb, chain B (#64), sequence
alignment score = 1696.3  
RMSD between 216 pruned atom pairs is 0.954 angstroms; (across all 330 pairs:
2.545)  
  
Matchmaker 0.pdb, chain B (#1) with 12.8.pdb, chain A (#65), sequence
alignment score = 1681.9  
RMSD between 225 pruned atom pairs is 1.048 angstroms; (across all 330 pairs:
4.772)  
  
Matchmaker 0.pdb, chain B (#1) with 13.0.pdb, chain A (#66), sequence
alignment score = 1678.9  
RMSD between 213 pruned atom pairs is 0.906 angstroms; (across all 330 pairs:
3.858)  
  
Matchmaker 0.pdb, chain B (#1) with 13.2.pdb, chain B (#67), sequence
alignment score = 1696.3  
RMSD between 238 pruned atom pairs is 1.075 angstroms; (across all 330 pairs:
1.904)  
  
Matchmaker 0.pdb, chain B (#1) with 13.4.pdb, chain B (#68), sequence
alignment score = 1681.9  
RMSD between 215 pruned atom pairs is 0.851 angstroms; (across all 330 pairs:
2.358)  
  
Matchmaker 0.pdb, chain A (#1) with 13.6.pdb, chain B (#69), sequence
alignment score = 1689.7  
RMSD between 218 pruned atom pairs is 0.934 angstroms; (across all 330 pairs:
2.386)  
  
Matchmaker 0.pdb, chain B (#1) with 13.8.pdb, chain B (#70), sequence
alignment score = 1688.5  
RMSD between 247 pruned atom pairs is 1.061 angstroms; (across all 330 pairs:
1.918)  
  
Matchmaker 0.pdb, chain A (#1) with 14.0.pdb, chain B (#71), sequence
alignment score = 1689.1  
RMSD between 229 pruned atom pairs is 1.052 angstroms; (across all 330 pairs:
2.289)  
  
Matchmaker 0.pdb, chain A (#1) with 14.2.pdb, chain B (#72), sequence
alignment score = 1692.1  
RMSD between 265 pruned atom pairs is 1.044 angstroms; (across all 330 pairs:
1.972)  
  
Matchmaker 0.pdb, chain B (#1) with 14.4.pdb, chain B (#73), sequence
alignment score = 1683.7  
RMSD between 246 pruned atom pairs is 1.039 angstroms; (across all 330 pairs:
2.304)  
  
Matchmaker 0.pdb, chain B (#1) with 14.6.pdb, chain B (#74), sequence
alignment score = 1693.3  
RMSD between 247 pruned atom pairs is 1.019 angstroms; (across all 330 pairs:
2.996)  
  
Matchmaker 0.pdb, chain B (#1) with 14.8.pdb, chain B (#75), sequence
alignment score = 1699.3  
RMSD between 225 pruned atom pairs is 0.962 angstroms; (across all 330 pairs:
3.195)  
  
Matchmaker 0.pdb, chain A (#1) with 15.0.pdb, chain B (#76), sequence
alignment score = 1692.7  
RMSD between 233 pruned atom pairs is 1.006 angstroms; (across all 330 pairs:
3.873)  
  
Matchmaker 0.pdb, chain B (#1) with 15.2.pdb, chain B (#77), sequence
alignment score = 1684.3  
RMSD between 233 pruned atom pairs is 1.005 angstroms; (across all 330 pairs:
3.815)  
  
Matchmaker 0.pdb, chain B (#1) with 15.4.pdb, chain B (#78), sequence
alignment score = 1685.5  
RMSD between 220 pruned atom pairs is 0.802 angstroms; (across all 330 pairs:
4.548)  
  
Matchmaker 0.pdb, chain B (#1) with 15.6.pdb, chain B (#79), sequence
alignment score = 1696.3  
RMSD between 222 pruned atom pairs is 0.963 angstroms; (across all 330 pairs:
4.125)  
  
Matchmaker 0.pdb, chain B (#1) with 15.8.pdb, chain B (#80), sequence
alignment score = 1682.5  
RMSD between 226 pruned atom pairs is 0.923 angstroms; (across all 330 pairs:
4.548)  
  
Matchmaker 0.pdb, chain B (#1) with 16.0.pdb, chain B (#81), sequence
alignment score = 1678.9  
RMSD between 219 pruned atom pairs is 0.908 angstroms; (across all 330 pairs:
3.857)  
  
Matchmaker 0.pdb, chain B (#1) with 16.2.pdb, chain B (#82), sequence
alignment score = 1692.7  
RMSD between 224 pruned atom pairs is 0.914 angstroms; (across all 330 pairs:
4.820)  
  
Matchmaker 0.pdb, chain B (#1) with 16.4.pdb, chain A (#83), sequence
alignment score = 1671.1  
RMSD between 216 pruned atom pairs is 0.988 angstroms; (across all 330 pairs:
3.341)  
  
Matchmaker 0.pdb, chain B (#1) with 16.6.pdb, chain B (#84), sequence
alignment score = 1682.5  
RMSD between 227 pruned atom pairs is 0.807 angstroms; (across all 330 pairs:
3.657)  
  
Matchmaker 0.pdb, chain B (#1) with 16.8.pdb, chain B (#85), sequence
alignment score = 1682.5  
RMSD between 243 pruned atom pairs is 1.007 angstroms; (across all 330 pairs:
2.793)  
  
Matchmaker 0.pdb, chain B (#1) with 17.0.pdb, chain B (#86), sequence
alignment score = 1678.3  
RMSD between 226 pruned atom pairs is 0.907 angstroms; (across all 330 pairs:
3.657)  
  
Matchmaker 0.pdb, chain B (#1) with 17.2.pdb, chain B (#87), sequence
alignment score = 1689.7  
RMSD between 243 pruned atom pairs is 0.929 angstroms; (across all 330 pairs:
2.102)  
  
Matchmaker 0.pdb, chain B (#1) with 17.4.pdb, chain B (#88), sequence
alignment score = 1681.3  
RMSD between 234 pruned atom pairs is 0.879 angstroms; (across all 330 pairs:
2.120)  
  
Matchmaker 0.pdb, chain B (#1) with 17.6.pdb, chain B (#89), sequence
alignment score = 1686.1  
RMSD between 244 pruned atom pairs is 1.087 angstroms; (across all 330 pairs:
1.886)  
  
Matchmaker 0.pdb, chain B (#1) with 17.8.pdb, chain B (#90), sequence
alignment score = 1682.5  
RMSD between 225 pruned atom pairs is 1.019 angstroms; (across all 330 pairs:
2.011)  
  
Matchmaker 0.pdb, chain B (#1) with 18.0.pdb, chain B (#91), sequence
alignment score = 1678.9  
RMSD between 229 pruned atom pairs is 0.966 angstroms; (across all 330 pairs:
2.689)  
  
Matchmaker 0.pdb, chain B (#1) with 18.2.pdb, chain B (#92), sequence
alignment score = 1682.5  
RMSD between 232 pruned atom pairs is 0.970 angstroms; (across all 330 pairs:
3.655)  
  
Matchmaker 0.pdb, chain B (#1) with 18.4.pdb, chain B (#93), sequence
alignment score = 1675.3  
RMSD between 217 pruned atom pairs is 0.942 angstroms; (across all 330 pairs:
3.603)  
  
Matchmaker 0.pdb, chain B (#1) with 18.6.pdb, chain B (#94), sequence
alignment score = 1681.9  
RMSD between 258 pruned atom pairs is 0.988 angstroms; (across all 330 pairs:
2.929)  
  
Matchmaker 0.pdb, chain B (#1) with 18.8.pdb, chain B (#95), sequence
alignment score = 1683.1  
RMSD between 241 pruned atom pairs is 0.978 angstroms; (across all 330 pairs:
3.659)  
  
Matchmaker 0.pdb, chain B (#1) with 19.0.pdb, chain B (#96), sequence
alignment score = 1678.9  
RMSD between 224 pruned atom pairs is 1.009 angstroms; (across all 330 pairs:
2.838)  
  
Matchmaker 0.pdb, chain B (#1) with 19.2.pdb, chain B (#97), sequence
alignment score = 1688.5  
RMSD between 234 pruned atom pairs is 1.034 angstroms; (across all 330 pairs:
2.853)  
  
Matchmaker 0.pdb, chain A (#1) with 19.4.pdb, chain B (#98), sequence
alignment score = 1692.1  
RMSD between 220 pruned atom pairs is 1.044 angstroms; (across all 330 pairs:
3.404)  
  
Matchmaker 0.pdb, chain A (#1) with 19.6.pdb, chain A (#99), sequence
alignment score = 1671.7  
RMSD between 223 pruned atom pairs is 0.951 angstroms; (across all 330 pairs:
4.275)  
  
Matchmaker 0.pdb, chain B (#1) with 19.8.pdb, chain A (#100), sequence
alignment score = 1678.3  
RMSD between 213 pruned atom pairs is 0.921 angstroms; (across all 330 pairs:
4.110)  
  
Matchmaker 0.pdb, chain B (#1) with 20.0.pdb, chain B (#101), sequence
alignment score = 1695.7  
RMSD between 200 pruned atom pairs is 0.948 angstroms; (across all 330 pairs:
2.855)  
  
Matchmaker 0.pdb, chain B (#1) with 20.2.pdb, chain B (#102), sequence
alignment score = 1678.3  
RMSD between 207 pruned atom pairs is 0.973 angstroms; (across all 330 pairs:
2.533)  
  
Matchmaker 0.pdb, chain B (#1) with 20.4.pdb, chain B (#103), sequence
alignment score = 1692.7  
RMSD between 212 pruned atom pairs is 0.953 angstroms; (across all 330 pairs:
3.644)  
  
Matchmaker 0.pdb, chain B (#1) with 20.6.pdb, chain B (#104), sequence
alignment score = 1685.5  
RMSD between 204 pruned atom pairs is 0.907 angstroms; (across all 330 pairs:
2.796)  
  
Matchmaker 0.pdb, chain B (#1) with 20.8.pdb, chain B (#105), sequence
alignment score = 1684.9  
RMSD between 239 pruned atom pairs is 1.107 angstroms; (across all 330 pairs:
2.232)  
  
Matchmaker 0.pdb, chain B (#1) with 21.0.pdb, chain A (#106), sequence
alignment score = 1681.3  
RMSD between 240 pruned atom pairs is 1.016 angstroms; (across all 330 pairs:
2.753)  
  
Matchmaker 0.pdb, chain B (#1) with 21.2.pdb, chain B (#107), sequence
alignment score = 1692.7  
RMSD between 222 pruned atom pairs is 0.984 angstroms; (across all 330 pairs:
3.784)  
  
Matchmaker 0.pdb, chain A (#1) with 21.4.pdb, chain B (#108), sequence
alignment score = 1688.5  
RMSD between 220 pruned atom pairs is 0.983 angstroms; (across all 330 pairs:
3.809)  
  
Matchmaker 0.pdb, chain B (#1) with 21.6.pdb, chain B (#109), sequence
alignment score = 1695.7  
RMSD between 219 pruned atom pairs is 1.004 angstroms; (across all 330 pairs:
3.219)  
  
Matchmaker 0.pdb, chain B (#1) with 21.8.pdb, chain B (#110), sequence
alignment score = 1679.5  
RMSD between 211 pruned atom pairs is 0.977 angstroms; (across all 330 pairs:
4.044)  
  
Matchmaker 0.pdb, chain B (#1) with 22.0.pdb, chain B (#111), sequence
alignment score = 1678.3  
RMSD between 219 pruned atom pairs is 0.989 angstroms; (across all 330 pairs:
3.022)  
  
Matchmaker 0.pdb, chain B (#1) with 22.2.pdb, chain B (#112), sequence
alignment score = 1675.3  
RMSD between 225 pruned atom pairs is 0.933 angstroms; (across all 330 pairs:
3.284)  
  
Matchmaker 0.pdb, chain B (#1) with 22.4.pdb, chain B (#113), sequence
alignment score = 1689.1  
RMSD between 209 pruned atom pairs is 0.959 angstroms; (across all 330 pairs:
3.661)  
  
Matchmaker 0.pdb, chain B (#1) with 22.6.pdb, chain B (#114), sequence
alignment score = 1686.1  
RMSD between 223 pruned atom pairs is 0.962 angstroms; (across all 330 pairs:
2.911)  
  
Matchmaker 0.pdb, chain B (#1) with 22.8.pdb, chain B (#115), sequence
alignment score = 1689.1  
RMSD between 225 pruned atom pairs is 0.965 angstroms; (across all 330 pairs:
2.796)  
  
Matchmaker 0.pdb, chain B (#1) with 23.0.pdb, chain B (#116), sequence
alignment score = 1684.9  
RMSD between 207 pruned atom pairs is 0.882 angstroms; (across all 330 pairs:
2.870)  
  
Matchmaker 0.pdb, chain B (#1) with 23.2.pdb, chain B (#117), sequence
alignment score = 1682.5  
RMSD between 230 pruned atom pairs is 0.968 angstroms; (across all 330 pairs:
3.077)  
  
Matchmaker 0.pdb, chain A (#1) with 23.4.pdb, chain B (#118), sequence
alignment score = 1688.5  
RMSD between 215 pruned atom pairs is 0.924 angstroms; (across all 330 pairs:
2.490)  
  
Matchmaker 0.pdb, chain B (#1) with 23.6.pdb, chain A (#119), sequence
alignment score = 1671.7  
RMSD between 223 pruned atom pairs is 0.987 angstroms; (across all 330 pairs:
3.239)  
  
Matchmaker 0.pdb, chain B (#1) with 23.8.pdb, chain B (#120), sequence
alignment score = 1680.1  
RMSD between 228 pruned atom pairs is 0.970 angstroms; (across all 330 pairs:
2.299)  
  
Matchmaker 0.pdb, chain B (#1) with 24.0.pdb, chain A (#121), sequence
alignment score = 1678.3  
RMSD between 208 pruned atom pairs is 0.986 angstroms; (across all 330 pairs:
3.924)  
  
Matchmaker 0.pdb, chain B (#1) with 24.2.pdb, chain B (#122), sequence
alignment score = 1678.9  
RMSD between 220 pruned atom pairs is 0.880 angstroms; (across all 330 pairs:
3.164)  
  
Matchmaker 0.pdb, chain B (#1) with 24.4.pdb, chain B (#123), sequence
alignment score = 1683.7  
RMSD between 231 pruned atom pairs is 1.001 angstroms; (across all 330 pairs:
2.620)  
  
Matchmaker 0.pdb, chain B (#1) with 24.6.pdb, chain B (#124), sequence
alignment score = 1689.7  
RMSD between 190 pruned atom pairs is 0.856 angstroms; (across all 330 pairs:
3.918)  
  
Matchmaker 0.pdb, chain B (#1) with 24.8.pdb, chain A (#125), sequence
alignment score = 1681.9  
RMSD between 203 pruned atom pairs is 0.989 angstroms; (across all 330 pairs:
6.001)  
  
Matchmaker 0.pdb, chain B (#1) with 25.0.pdb, chain B (#126), sequence
alignment score = 1690.3  
RMSD between 239 pruned atom pairs is 0.934 angstroms; (across all 330 pairs:
3.370)  
  
Matchmaker 0.pdb, chain A (#1) with 25.2.pdb, chain B (#127), sequence
alignment score = 1676.5  
RMSD between 234 pruned atom pairs is 0.996 angstroms; (across all 330 pairs:
2.772)  
  
Matchmaker 0.pdb, chain B (#1) with 25.4.pdb, chain B (#128), sequence
alignment score = 1687.3  
RMSD between 243 pruned atom pairs is 0.915 angstroms; (across all 330 pairs:
2.846)  
  
Matchmaker 0.pdb, chain B (#1) with 25.6.pdb, chain B (#129), sequence
alignment score = 1680.1  
RMSD between 235 pruned atom pairs is 0.898 angstroms; (across all 330 pairs:
4.212)  
  
Matchmaker 0.pdb, chain B (#1) with 25.8.pdb, chain B (#130), sequence
alignment score = 1680.7  
RMSD between 226 pruned atom pairs is 0.891 angstroms; (across all 330 pairs:
3.492)  
  
Matchmaker 0.pdb, chain B (#1) with 26.0.pdb, chain B (#131), sequence
alignment score = 1683.7  
RMSD between 227 pruned atom pairs is 0.946 angstroms; (across all 330 pairs:
3.447)  
  
Matchmaker 0.pdb, chain B (#1) with 26.2.pdb, chain B (#132), sequence
alignment score = 1689.7  
RMSD between 228 pruned atom pairs is 0.930 angstroms; (across all 330 pairs:
2.896)  
  
Matchmaker 0.pdb, chain B (#1) with 26.4.pdb, chain B (#133), sequence
alignment score = 1687.3  
RMSD between 229 pruned atom pairs is 0.992 angstroms; (across all 330 pairs:
3.020)  
  
Matchmaker 0.pdb, chain B (#1) with 26.6.pdb, chain B (#134), sequence
alignment score = 1680.7  
RMSD between 195 pruned atom pairs is 0.921 angstroms; (across all 330 pairs:
4.042)  
  
Matchmaker 0.pdb, chain B (#1) with 26.8.pdb, chain B (#135), sequence
alignment score = 1683.7  
RMSD between 199 pruned atom pairs is 0.927 angstroms; (across all 330 pairs:
5.008)  
  
Matchmaker 0.pdb, chain B (#1) with 27.0.pdb, chain B (#136), sequence
alignment score = 1687.3  
RMSD between 212 pruned atom pairs is 0.913 angstroms; (across all 330 pairs:
5.224)  
  
Matchmaker 0.pdb, chain B (#1) with 27.2.pdb, chain B (#137), sequence
alignment score = 1688.5  
RMSD between 208 pruned atom pairs is 0.927 angstroms; (across all 330 pairs:
4.937)  
  
Matchmaker 0.pdb, chain B (#1) with 27.4.pdb, chain B (#138), sequence
alignment score = 1684.3  
RMSD between 216 pruned atom pairs is 0.943 angstroms; (across all 330 pairs:
5.338)  
  
Matchmaker 0.pdb, chain B (#1) with 27.6.pdb, chain B (#139), sequence
alignment score = 1693.3  
RMSD between 209 pruned atom pairs is 0.901 angstroms; (across all 330 pairs:
5.433)  
  
Matchmaker 0.pdb, chain B (#1) with 27.8.pdb, chain B (#140), sequence
alignment score = 1685.5  
RMSD between 210 pruned atom pairs is 0.904 angstroms; (across all 330 pairs:
5.928)  
  
Matchmaker 0.pdb, chain B (#1) with 28.0.pdb, chain A (#141), sequence
alignment score = 1674.7  
RMSD between 208 pruned atom pairs is 1.060 angstroms; (across all 330 pairs:
4.839)  
  
Matchmaker 0.pdb, chain B (#1) with 28.2.pdb, chain B (#142), sequence
alignment score = 1687.3  
RMSD between 208 pruned atom pairs is 0.980 angstroms; (across all 330 pairs:
5.851)  
  
Matchmaker 0.pdb, chain B (#1) with 28.4.pdb, chain B (#143), sequence
alignment score = 1695.7  
RMSD between 199 pruned atom pairs is 0.874 angstroms; (across all 330 pairs:
6.836)  
  
Matchmaker 0.pdb, chain B (#1) with 28.6.pdb, chain B (#144), sequence
alignment score = 1695.7  
RMSD between 197 pruned atom pairs is 0.849 angstroms; (across all 330 pairs:
6.486)  
  
Matchmaker 0.pdb, chain B (#1) with 28.8.pdb, chain B (#145), sequence
alignment score = 1692.1  
RMSD between 195 pruned atom pairs is 0.808 angstroms; (across all 330 pairs:
5.341)  
  
Matchmaker 0.pdb, chain B (#1) with 29.0.pdb, chain B (#146), sequence
alignment score = 1692.1  
RMSD between 194 pruned atom pairs is 0.891 angstroms; (across all 330 pairs:
5.060)  
  
Matchmaker 0.pdb, chain B (#1) with 29.2.pdb, chain B (#147), sequence
alignment score = 1676.5  
RMSD between 203 pruned atom pairs is 0.941 angstroms; (across all 330 pairs:
5.190)  
  
Matchmaker 0.pdb, chain B (#1) with 29.4.pdb, chain B (#148), sequence
alignment score = 1683.7  
RMSD between 199 pruned atom pairs is 0.978 angstroms; (across all 330 pairs:
4.148)  
  
Matchmaker 0.pdb, chain B (#1) with 29.6.pdb, chain B (#149), sequence
alignment score = 1685.5  
RMSD between 192 pruned atom pairs is 0.888 angstroms; (across all 330 pairs:
3.840)  
  
Matchmaker 0.pdb, chain B (#1) with 29.8.pdb, chain B (#150), sequence
alignment score = 1692.7  
RMSD between 182 pruned atom pairs is 0.875 angstroms; (across all 330 pairs:
5.110)  
  
Matchmaker 0.pdb, chain B (#1) with 30.0.pdb, chain B (#151), sequence
alignment score = 1674.7  
RMSD between 178 pruned atom pairs is 0.752 angstroms; (across all 330 pairs:
5.922)  
  
Matchmaker 0.pdb, chain B (#1) with 30.2.pdb, chain B (#152), sequence
alignment score = 1692.1  
RMSD between 182 pruned atom pairs is 0.842 angstroms; (across all 330 pairs:
5.920)  
  
Matchmaker 0.pdb, chain B (#1) with 30.4.pdb, chain B (#153), sequence
alignment score = 1679.5  
RMSD between 208 pruned atom pairs is 0.882 angstroms; (across all 330 pairs:
4.671)  
  
Matchmaker 0.pdb, chain B (#1) with 30.6.pdb, chain B (#154), sequence
alignment score = 1688.5  
RMSD between 206 pruned atom pairs is 0.857 angstroms; (across all 330 pairs:
5.292)  
  
Matchmaker 0.pdb, chain B (#1) with 30.8.pdb, chain B (#155), sequence
alignment score = 1681.9  
RMSD between 195 pruned atom pairs is 0.884 angstroms; (across all 330 pairs:
5.445)  
  
Matchmaker 0.pdb, chain B (#1) with 31.0.pdb, chain B (#156), sequence
alignment score = 1674.7  
RMSD between 198 pruned atom pairs is 0.849 angstroms; (across all 330 pairs:
5.729)  
  
Matchmaker 0.pdb, chain B (#1) with 31.2.pdb, chain B (#157), sequence
alignment score = 1685.5  
RMSD between 192 pruned atom pairs is 0.828 angstroms; (across all 330 pairs:
5.658)  
  
Matchmaker 0.pdb, chain B (#1) with 31.4.pdb, chain B (#158), sequence
alignment score = 1674.7  
RMSD between 198 pruned atom pairs is 0.950 angstroms; (across all 330 pairs:
5.524)  
  
Matchmaker 0.pdb, chain B (#1) with 31.6.pdb, chain B (#159), sequence
alignment score = 1676.5  
RMSD between 208 pruned atom pairs is 0.871 angstroms; (across all 330 pairs:
6.566)  
  
Matchmaker 0.pdb, chain B (#1) with 31.8.pdb, chain B (#160), sequence
alignment score = 1675.3  
RMSD between 209 pruned atom pairs is 0.939 angstroms; (across all 330 pairs:
6.261)  
  
Matchmaker 0.pdb, chain B (#1) with 32.0.pdb, chain A (#161), sequence
alignment score = 1667.5  
RMSD between 217 pruned atom pairs is 1.104 angstroms; (across all 330 pairs:
3.340)  
  
Matchmaker 0.pdb, chain B (#1) with 32.2.pdb, chain B (#162), sequence
alignment score = 1678.9  
RMSD between 196 pruned atom pairs is 0.870 angstroms; (across all 330 pairs:
7.071)  
  
Matchmaker 0.pdb, chain A (#1) with 32.4.pdb, chain B (#163), sequence
alignment score = 1672.3  
RMSD between 197 pruned atom pairs is 1.001 angstroms; (across all 330 pairs:
5.431)  
  
Matchmaker 0.pdb, chain B (#1) with 32.6.pdb, chain B (#164), sequence
alignment score = 1675.9  
RMSD between 194 pruned atom pairs is 0.882 angstroms; (across all 330 pairs:
6.194)  
  
Matchmaker 0.pdb, chain B (#1) with 32.8.pdb, chain B (#165), sequence
alignment score = 1686.1  
RMSD between 206 pruned atom pairs is 0.891 angstroms; (across all 330 pairs:
5.928)  
  
Matchmaker 0.pdb, chain B (#1) with 33.0.pdb, chain B (#166), sequence
alignment score = 1690.3  
RMSD between 210 pruned atom pairs is 0.940 angstroms; (across all 330 pairs:
5.641)  
  
Matchmaker 0.pdb, chain B (#1) with 33.2.pdb, chain B (#167), sequence
alignment score = 1696.3  
RMSD between 200 pruned atom pairs is 0.830 angstroms; (across all 330 pairs:
5.268)  
  
Matchmaker 0.pdb, chain B (#1) with 33.4.pdb, chain B (#168), sequence
alignment score = 1685.5  
RMSD between 176 pruned atom pairs is 0.841 angstroms; (across all 330 pairs:
5.333)  
  
Matchmaker 0.pdb, chain B (#1) with 33.6.pdb, chain B (#169), sequence
alignment score = 1685.5  
RMSD between 207 pruned atom pairs is 0.890 angstroms; (across all 330 pairs:
3.585)  
  
Matchmaker 0.pdb, chain B (#1) with 33.8.pdb, chain B (#170), sequence
alignment score = 1677.1  
RMSD between 209 pruned atom pairs is 0.954 angstroms; (across all 330 pairs:
3.845)  
  
Matchmaker 0.pdb, chain B (#1) with 34.0.pdb, chain B (#171), sequence
alignment score = 1692.1  
RMSD between 232 pruned atom pairs is 0.987 angstroms; (across all 330 pairs:
3.700)  
  
Matchmaker 0.pdb, chain B (#1) with 34.2.pdb, chain B (#172), sequence
alignment score = 1680.7  
RMSD between 219 pruned atom pairs is 1.072 angstroms; (across all 330 pairs:
2.757)  
  
Matchmaker 0.pdb, chain B (#1) with 34.4.pdb, chain B (#173), sequence
alignment score = 1692.7  
RMSD between 204 pruned atom pairs is 1.013 angstroms; (across all 330 pairs:
2.943)  
  
Matchmaker 0.pdb, chain B (#1) with 34.6.pdb, chain B (#174), sequence
alignment score = 1677.1  
RMSD between 230 pruned atom pairs is 1.072 angstroms; (across all 330 pairs:
2.452)  
  
Matchmaker 0.pdb, chain B (#1) with 34.8.pdb, chain B (#175), sequence
alignment score = 1684.3  
RMSD between 225 pruned atom pairs is 1.025 angstroms; (across all 330 pairs:
2.301)  
  
Matchmaker 0.pdb, chain B (#1) with 35.0.pdb, chain B (#176), sequence
alignment score = 1689.1  
RMSD between 208 pruned atom pairs is 0.971 angstroms; (across all 330 pairs:
3.052)  
  
Matchmaker 0.pdb, chain B (#1) with 35.2.pdb, chain B (#177), sequence
alignment score = 1681.3  
RMSD between 217 pruned atom pairs is 0.994 angstroms; (across all 330 pairs:
2.722)  
  
Matchmaker 0.pdb, chain B (#1) with 35.4.pdb, chain B (#178), sequence
alignment score = 1686.1  
RMSD between 211 pruned atom pairs is 1.033 angstroms; (across all 330 pairs:
2.560)  
  
Matchmaker 0.pdb, chain A (#1) with 35.6.pdb, chain B (#179), sequence
alignment score = 1681.3  
RMSD between 251 pruned atom pairs is 1.167 angstroms; (across all 330 pairs:
2.476)  
  
Matchmaker 0.pdb, chain B (#1) with 35.8.pdb, chain B (#180), sequence
alignment score = 1689.1  
RMSD between 233 pruned atom pairs is 1.088 angstroms; (across all 330 pairs:
3.225)  
  
Matchmaker 0.pdb, chain B (#1) with 36.0.pdb, chain B (#181), sequence
alignment score = 1686.1  
RMSD between 207 pruned atom pairs is 1.024 angstroms; (across all 330 pairs:
2.918)  
  
Matchmaker 0.pdb, chain B (#1) with 36.2.pdb, chain B (#182), sequence
alignment score = 1687.3  
RMSD between 222 pruned atom pairs is 1.034 angstroms; (across all 330 pairs:
3.096)  
  
Matchmaker 0.pdb, chain B (#1) with 36.4.pdb, chain B (#183), sequence
alignment score = 1683.1  
RMSD between 228 pruned atom pairs is 1.106 angstroms; (across all 330 pairs:
1.967)  
  
Matchmaker 0.pdb, chain B (#1) with 36.6.pdb, chain B (#184), sequence
alignment score = 1684.9  
RMSD between 238 pruned atom pairs is 0.927 angstroms; (across all 330 pairs:
2.779)  
  
Matchmaker 0.pdb, chain A (#1) with 36.8.pdb, chain B (#185), sequence
alignment score = 1665.1  
RMSD between 249 pruned atom pairs is 1.015 angstroms; (across all 330 pairs:
1.899)  
  
Matchmaker 0.pdb, chain B (#1) with 37.0.pdb, chain B (#186), sequence
alignment score = 1677.7  
RMSD between 220 pruned atom pairs is 1.105 angstroms; (across all 330 pairs:
2.557)  
  
Matchmaker 0.pdb, chain B (#1) with 37.2.pdb, chain B (#187), sequence
alignment score = 1669.9  
RMSD between 236 pruned atom pairs is 1.062 angstroms; (across all 330 pairs:
2.318)  
  
Matchmaker 0.pdb, chain B (#1) with 37.4.pdb, chain B (#188), sequence
alignment score = 1681.9  
RMSD between 209 pruned atom pairs is 1.144 angstroms; (across all 330 pairs:
2.431)  
  
Matchmaker 0.pdb, chain B (#1) with 37.6.pdb, chain B (#189), sequence
alignment score = 1674.7  
RMSD between 200 pruned atom pairs is 0.881 angstroms; (across all 330 pairs:
4.033)  
  
Matchmaker 0.pdb, chain B (#1) with 37.8.pdb, chain B (#190), sequence
alignment score = 1669.3  
RMSD between 206 pruned atom pairs is 0.968 angstroms; (across all 330 pairs:
3.961)  
  
Matchmaker 0.pdb, chain B (#1) with 38.0.pdb, chain B (#191), sequence
alignment score = 1672.3  
RMSD between 185 pruned atom pairs is 0.792 angstroms; (across all 330 pairs:
3.396)  
  
Matchmaker 0.pdb, chain B (#1) with 38.2.pdb, chain B (#192), sequence
alignment score = 1682.5  
RMSD between 190 pruned atom pairs is 0.855 angstroms; (across all 330 pairs:
3.445)  
  
Matchmaker 0.pdb, chain B (#1) with 38.4.pdb, chain B (#193), sequence
alignment score = 1676.5  
RMSD between 232 pruned atom pairs is 1.041 angstroms; (across all 330 pairs:
2.433)  
  
Matchmaker 0.pdb, chain B (#1) with 38.6.pdb, chain B (#194), sequence
alignment score = 1682.5  
RMSD between 200 pruned atom pairs is 1.016 angstroms; (across all 330 pairs:
3.043)  
  
Matchmaker 0.pdb, chain A (#1) with 38.8.pdb, chain B (#195), sequence
alignment score = 1679.5  
RMSD between 186 pruned atom pairs is 0.900 angstroms; (across all 330 pairs:
4.064)  
  
Matchmaker 0.pdb, chain B (#1) with 39.0.pdb, chain A (#196), sequence
alignment score = 1663.9  
RMSD between 216 pruned atom pairs is 0.963 angstroms; (across all 330 pairs:
5.257)  
  
Matchmaker 0.pdb, chain B (#1) with 39.2.pdb, chain A (#197), sequence
alignment score = 1674.1  
RMSD between 213 pruned atom pairs is 0.976 angstroms; (across all 330 pairs:
6.183)  
  
Matchmaker 0.pdb, chain B (#1) with 39.4.pdb, chain B (#198), sequence
alignment score = 1679.5  
RMSD between 226 pruned atom pairs is 0.888 angstroms; (across all 330 pairs:
3.586)  
  
Matchmaker 0.pdb, chain B (#1) with 39.6.pdb, chain B (#199), sequence
alignment score = 1677.1  
RMSD between 230 pruned atom pairs is 1.100 angstroms; (across all 330 pairs:
3.192)  
  
Matchmaker 0.pdb, chain B (#1) with 39.8.pdb, chain B (#200), sequence
alignment score = 1679.5  
RMSD between 188 pruned atom pairs is 0.887 angstroms; (across all 330 pairs:
4.801)  
  
Matchmaker 0.pdb, chain B (#1) with 40.0.pdb, chain B (#201), sequence
alignment score = 1675.9  
RMSD between 204 pruned atom pairs is 1.017 angstroms; (across all 330 pairs:
3.932)  
  
Matchmaker 0.pdb, chain B (#1) with 40.2.pdb, chain B (#202), sequence
alignment score = 1683.7  
RMSD between 191 pruned atom pairs is 0.896 angstroms; (across all 330 pairs:
5.170)  
  
Matchmaker 0.pdb, chain B (#1) with 40.4.pdb, chain B (#203), sequence
alignment score = 1689.1  
RMSD between 177 pruned atom pairs is 0.985 angstroms; (across all 330 pairs:
5.515)  
  
Matchmaker 0.pdb, chain B (#1) with 40.6.pdb, chain B (#204), sequence
alignment score = 1672.9  
RMSD between 178 pruned atom pairs is 0.883 angstroms; (across all 330 pairs:
5.646)  
  
Matchmaker 0.pdb, chain B (#1) with 40.8.pdb, chain B (#205), sequence
alignment score = 1679.5  
RMSD between 196 pruned atom pairs is 0.975 angstroms; (across all 330 pairs:
5.001)  
  
Matchmaker 0.pdb, chain B (#1) with 41.0.pdb, chain A (#206), sequence
alignment score = 1678.9  
RMSD between 211 pruned atom pairs is 1.091 angstroms; (across all 330 pairs:
3.593)  
  
Matchmaker 0.pdb, chain B (#1) with 41.2.pdb, chain B (#207), sequence
alignment score = 1681.9  
RMSD between 193 pruned atom pairs is 0.943 angstroms; (across all 330 pairs:
4.514)  
  
Matchmaker 0.pdb, chain B (#1) with 41.4.pdb, chain B (#208), sequence
alignment score = 1672.9  
RMSD between 205 pruned atom pairs is 1.041 angstroms; (across all 330 pairs:
4.643)  
  
Matchmaker 0.pdb, chain B (#1) with 41.6.pdb, chain B (#209), sequence
alignment score = 1677.1  
RMSD between 190 pruned atom pairs is 0.930 angstroms; (across all 330 pairs:
4.576)  
  
Matchmaker 0.pdb, chain B (#1) with 41.8.pdb, chain A (#210), sequence
alignment score = 1678.3  
RMSD between 205 pruned atom pairs is 1.053 angstroms; (across all 330 pairs:
5.146)  
  
Matchmaker 0.pdb, chain B (#1) with 42.0.pdb, chain B (#211), sequence
alignment score = 1680.1  
RMSD between 195 pruned atom pairs is 0.983 angstroms; (across all 330 pairs:
5.322)  
  
Matchmaker 0.pdb, chain B (#1) with 42.2.pdb, chain A (#212), sequence
alignment score = 1678.9  
RMSD between 210 pruned atom pairs is 0.961 angstroms; (across all 330 pairs:
4.573)  
  
Matchmaker 0.pdb, chain B (#1) with 42.4.pdb, chain A (#213), sequence
alignment score = 1681.3  
RMSD between 203 pruned atom pairs is 1.046 angstroms; (across all 330 pairs:
4.634)  
  
Matchmaker 0.pdb, chain B (#1) with 42.6.pdb, chain A (#214), sequence
alignment score = 1681.3  
RMSD between 197 pruned atom pairs is 0.943 angstroms; (across all 330 pairs:
3.113)  
  
Matchmaker 0.pdb, chain B (#1) with 42.8.pdb, chain A (#215), sequence
alignment score = 1671.7  
RMSD between 209 pruned atom pairs is 1.057 angstroms; (across all 330 pairs:
3.743)  
  
Matchmaker 0.pdb, chain A (#1) with 43.0.pdb, chain A (#216), sequence
alignment score = 1673.5  
RMSD between 198 pruned atom pairs is 1.028 angstroms; (across all 330 pairs:
4.065)  
  
Matchmaker 0.pdb, chain B (#1) with 43.2.pdb, chain A (#217), sequence
alignment score = 1667.5  
RMSD between 193 pruned atom pairs is 0.999 angstroms; (across all 330 pairs:
4.014)  
  
Matchmaker 0.pdb, chain B (#1) with 43.4.pdb, chain A (#218), sequence
alignment score = 1678.3  
RMSD between 193 pruned atom pairs is 0.972 angstroms; (across all 330 pairs:
3.929)  
  
Matchmaker 0.pdb, chain B (#1) with 43.6.pdb, chain B (#219), sequence
alignment score = 1681.3  
RMSD between 180 pruned atom pairs is 0.975 angstroms; (across all 330 pairs:
5.596)  
  
Matchmaker 0.pdb, chain B (#1) with 43.8.pdb, chain A (#220), sequence
alignment score = 1678.3  
RMSD between 217 pruned atom pairs is 1.068 angstroms; (across all 330 pairs:
4.025)  
  
Matchmaker 0.pdb, chain B (#1) with 44.0.pdb, chain B (#221), sequence
alignment score = 1681.9  
RMSD between 182 pruned atom pairs is 0.888 angstroms; (across all 330 pairs:
5.145)  
  
Matchmaker 0.pdb, chain B (#1) with 44.2.pdb, chain B (#222), sequence
alignment score = 1682.5  
RMSD between 195 pruned atom pairs is 0.915 angstroms; (across all 330 pairs:
4.847)  
  
Matchmaker 0.pdb, chain B (#1) with 44.4.pdb, chain A (#223), sequence
alignment score = 1674.7  
RMSD between 211 pruned atom pairs is 1.021 angstroms; (across all 330 pairs:
3.657)  
  
Matchmaker 0.pdb, chain B (#1) with 44.6.pdb, chain B (#224), sequence
alignment score = 1672.3  
RMSD between 217 pruned atom pairs is 0.980 angstroms; (across all 330 pairs:
4.458)  
  
Matchmaker 0.pdb, chain B (#1) with 44.8.pdb, chain B (#225), sequence
alignment score = 1678.3  
RMSD between 192 pruned atom pairs is 0.882 angstroms; (across all 330 pairs:
4.501)  
  
Matchmaker 0.pdb, chain B (#1) with 45.0.pdb, chain A (#226), sequence
alignment score = 1677.7  
RMSD between 199 pruned atom pairs is 1.098 angstroms; (across all 330 pairs:
3.680)  
  
Matchmaker 0.pdb, chain B (#1) with 45.2.pdb, chain A (#227), sequence
alignment score = 1677.7  
RMSD between 212 pruned atom pairs is 1.074 angstroms; (across all 330 pairs:
3.978)  
  
Matchmaker 0.pdb, chain B (#1) with 45.4.pdb, chain A (#228), sequence
alignment score = 1667.5  
RMSD between 205 pruned atom pairs is 0.932 angstroms; (across all 330 pairs:
3.995)  
  
Matchmaker 0.pdb, chain A (#1) with 45.6.pdb, chain A (#229), sequence
alignment score = 1674.7  
RMSD between 215 pruned atom pairs is 1.024 angstroms; (across all 330 pairs:
3.860)  
  
Matchmaker 0.pdb, chain B (#1) with 45.8.pdb, chain B (#230), sequence
alignment score = 1681.9  
RMSD between 207 pruned atom pairs is 0.957 angstroms; (across all 330 pairs:
4.538)  
  
Matchmaker 0.pdb, chain B (#1) with 46.0.pdb, chain A (#231), sequence
alignment score = 1672.3  
RMSD between 225 pruned atom pairs is 0.958 angstroms; (across all 330 pairs:
4.528)  
  
Matchmaker 0.pdb, chain B (#1) with 46.2.pdb, chain A (#232), sequence
alignment score = 1674.7  
RMSD between 220 pruned atom pairs is 0.981 angstroms; (across all 330 pairs:
5.090)  
  
Matchmaker 0.pdb, chain B (#1) with 46.4.pdb, chain A (#233), sequence
alignment score = 1668.7  
RMSD between 231 pruned atom pairs is 0.982 angstroms; (across all 330 pairs:
3.669)  
  
Matchmaker 0.pdb, chain B (#1) with 46.6.pdb, chain A (#234), sequence
alignment score = 1678.3  
RMSD between 226 pruned atom pairs is 0.900 angstroms; (across all 330 pairs:
4.478)  
  
Matchmaker 0.pdb, chain B (#1) with 46.8.pdb, chain B (#235), sequence
alignment score = 1666.9  
RMSD between 185 pruned atom pairs is 0.964 angstroms; (across all 330 pairs:
4.207)  
  
Matchmaker 0.pdb, chain B (#1) with 47.0.pdb, chain A (#236), sequence
alignment score = 1674.7  
RMSD between 221 pruned atom pairs is 0.954 angstroms; (across all 330 pairs:
5.771)  
  
Matchmaker 0.pdb, chain B (#1) with 47.2.pdb, chain A (#237), sequence
alignment score = 1681.9  
RMSD between 213 pruned atom pairs is 1.037 angstroms; (across all 330 pairs:
6.609)  
  
Matchmaker 0.pdb, chain B (#1) with 47.4.pdb, chain A (#238), sequence
alignment score = 1681.9  
RMSD between 209 pruned atom pairs is 0.969 angstroms; (across all 330 pairs:
6.379)  
  
Matchmaker 0.pdb, chain A (#1) with 47.6.pdb, chain A (#239), sequence
alignment score = 1678.3  
RMSD between 216 pruned atom pairs is 0.931 angstroms; (across all 330 pairs:
5.722)  
  
Matchmaker 0.pdb, chain B (#1) with 47.8.pdb, chain B (#240), sequence
alignment score = 1681.9  
RMSD between 212 pruned atom pairs is 0.946 angstroms; (across all 330 pairs:
3.318)  
  
Matchmaker 0.pdb, chain B (#1) with 48.0.pdb, chain A (#241), sequence
alignment score = 1668.7  
RMSD between 200 pruned atom pairs is 0.935 angstroms; (across all 330 pairs:
6.116)  
  
Matchmaker 0.pdb, chain A (#1) with 48.2.pdb, chain A (#242), sequence
alignment score = 1672.3  
RMSD between 223 pruned atom pairs is 0.894 angstroms; (across all 330 pairs:
4.917)  
  
Matchmaker 0.pdb, chain B (#1) with 48.4.pdb, chain A (#243), sequence
alignment score = 1664.5  
RMSD between 213 pruned atom pairs is 0.902 angstroms; (across all 330 pairs:
4.829)  
  
Matchmaker 0.pdb, chain B (#1) with 48.6.pdb, chain A (#244), sequence
alignment score = 1678.9  
RMSD between 227 pruned atom pairs is 0.936 angstroms; (across all 330 pairs:
5.652)  
  
Matchmaker 0.pdb, chain B (#1) with 48.8.pdb, chain A (#245), sequence
alignment score = 1678.9  
RMSD between 214 pruned atom pairs is 0.943 angstroms; (across all 330 pairs:
5.760)  
  
Matchmaker 0.pdb, chain B (#1) with 49.0.pdb, chain A (#246), sequence
alignment score = 1671.7  
RMSD between 225 pruned atom pairs is 0.985 angstroms; (across all 330 pairs:
5.517)  
  
Matchmaker 0.pdb, chain B (#1) with 49.2.pdb, chain A (#247), sequence
alignment score = 1671.7  
RMSD between 219 pruned atom pairs is 0.902 angstroms; (across all 330 pairs:
5.283)  
  
Matchmaker 0.pdb, chain B (#1) with 49.4.pdb, chain A (#248), sequence
alignment score = 1681.3  
RMSD between 229 pruned atom pairs is 0.986 angstroms; (across all 330 pairs:
5.292)  
  
Matchmaker 0.pdb, chain B (#1) with 49.6.pdb, chain B (#249), sequence
alignment score = 1669.9  
RMSD between 197 pruned atom pairs is 0.938 angstroms; (across all 330 pairs:
2.804)  
  
Matchmaker 0.pdb, chain B (#1) with 49.8.pdb, chain A (#250), sequence
alignment score = 1678.3  
RMSD between 225 pruned atom pairs is 1.011 angstroms; (across all 330 pairs:
4.316)  
  
Matchmaker 0.pdb, chain A (#1) with 50.0.pdb, chain A (#251), sequence
alignment score = 1674.7  
RMSD between 213 pruned atom pairs is 1.033 angstroms; (across all 330 pairs:
4.759)  
  
Matchmaker 0.pdb, chain B (#1) with 50.2.pdb, chain A (#252), sequence
alignment score = 1674.7  
RMSD between 212 pruned atom pairs is 0.885 angstroms; (across all 330 pairs:
3.549)  
  
Matchmaker 0.pdb, chain B (#1) with 50.4.pdb, chain A (#253), sequence
alignment score = 1674.7  
RMSD between 221 pruned atom pairs is 0.982 angstroms; (across all 330 pairs:
3.735)  
  
Matchmaker 0.pdb, chain B (#1) with 50.6.pdb, chain A (#254), sequence
alignment score = 1681.3  
RMSD between 214 pruned atom pairs is 0.987 angstroms; (across all 330 pairs:
3.683)  
  
Matchmaker 0.pdb, chain B (#1) with 50.8.pdb, chain B (#255), sequence
alignment score = 1674.7  
RMSD between 200 pruned atom pairs is 0.940 angstroms; (across all 330 pairs:
2.571)  
  
Matchmaker 0.pdb, chain B (#1) with 51.0.pdb, chain A (#256), sequence
alignment score = 1681.9  
RMSD between 217 pruned atom pairs is 0.932 angstroms; (across all 330 pairs:
4.768)  
  
Matchmaker 0.pdb, chain B (#1) with 51.2.pdb, chain B (#257), sequence
alignment score = 1672.3  
RMSD between 221 pruned atom pairs is 0.980 angstroms; (across all 330 pairs:
2.773)  
  
Matchmaker 0.pdb, chain B (#1) with 51.4.pdb, chain A (#258), sequence
alignment score = 1674.7  
RMSD between 212 pruned atom pairs is 1.024 angstroms; (across all 330 pairs:
6.453)  
  
Matchmaker 0.pdb, chain B (#1) with 51.6.pdb, chain B (#259), sequence
alignment score = 1678.3  
RMSD between 238 pruned atom pairs is 1.088 angstroms; (across all 330 pairs:
2.665)  
  
Matchmaker 0.pdb, chain B (#1) with 51.8.pdb, chain B (#260), sequence
alignment score = 1671.1  
RMSD between 212 pruned atom pairs is 0.964 angstroms; (across all 330 pairs:
3.615)  
  
Matchmaker 0.pdb, chain B (#1) with 52.0.pdb, chain A (#261), sequence
alignment score = 1668.1  
RMSD between 206 pruned atom pairs is 0.931 angstroms; (across all 330 pairs:
6.204)  
  
Matchmaker 0.pdb, chain B (#1) with 52.2.pdb, chain A (#262), sequence
alignment score = 1681.9  
RMSD between 217 pruned atom pairs is 0.988 angstroms; (across all 330 pairs:
5.713)  
  
Matchmaker 0.pdb, chain B (#1) with 52.4.pdb, chain A (#263), sequence
alignment score = 1681.9  
RMSD between 215 pruned atom pairs is 0.983 angstroms; (across all 330 pairs:
5.303)  
  
Matchmaker 0.pdb, chain B (#1) with 52.6.pdb, chain A (#264), sequence
alignment score = 1681.9  
RMSD between 214 pruned atom pairs is 1.007 angstroms; (across all 330 pairs:
5.115)  
  
Matchmaker 0.pdb, chain B (#1) with 52.8.pdb, chain A (#265), sequence
alignment score = 1675.9  
RMSD between 207 pruned atom pairs is 0.922 angstroms; (across all 330 pairs:
5.408)  
  
Matchmaker 0.pdb, chain B (#1) with 53.0.pdb, chain B (#266), sequence
alignment score = 1671.7  
RMSD between 224 pruned atom pairs is 0.985 angstroms; (across all 330 pairs:
3.440)  
  
Matchmaker 0.pdb, chain B (#1) with 53.2.pdb, chain A (#267), sequence
alignment score = 1675.3  
RMSD between 210 pruned atom pairs is 0.932 angstroms; (across all 330 pairs:
5.277)  
  
Matchmaker 0.pdb, chain B (#1) with 53.4.pdb, chain B (#268), sequence
alignment score = 1671.7  
RMSD between 200 pruned atom pairs is 0.969 angstroms; (across all 330 pairs:
3.828)  
  
Matchmaker 0.pdb, chain B (#1) with 53.6.pdb, chain B (#269), sequence
alignment score = 1674.7  
RMSD between 218 pruned atom pairs is 1.010 angstroms; (across all 330 pairs:
3.615)  
  
Matchmaker 0.pdb, chain B (#1) with 53.8.pdb, chain B (#270), sequence
alignment score = 1675.9  
RMSD between 224 pruned atom pairs is 0.969 angstroms; (across all 330 pairs:
3.458)  
  
Matchmaker 0.pdb, chain B (#1) with 54.0.pdb, chain B (#271), sequence
alignment score = 1671.7  
RMSD between 250 pruned atom pairs is 1.004 angstroms; (across all 330 pairs:
2.374)  
  
Matchmaker 0.pdb, chain B (#1) with 54.2.pdb, chain A (#272), sequence
alignment score = 1675.3  
RMSD between 194 pruned atom pairs is 0.966 angstroms; (across all 330 pairs:
5.044)  
  
Matchmaker 0.pdb, chain B (#1) with 54.4.pdb, chain A (#273), sequence
alignment score = 1684.9  
RMSD between 188 pruned atom pairs is 0.895 angstroms; (across all 330 pairs:
5.220)  
  
Matchmaker 0.pdb, chain A (#1) with 54.6.pdb, chain A (#274), sequence
alignment score = 1671.1  
RMSD between 221 pruned atom pairs is 0.938 angstroms; (across all 330 pairs:
5.558)  
  
Matchmaker 0.pdb, chain B (#1) with 54.8.pdb, chain B (#275), sequence
alignment score = 1662.7  
RMSD between 219 pruned atom pairs is 0.960 angstroms; (across all 330 pairs:
4.991)  
  
Matchmaker 0.pdb, chain B (#1) with 55.0.pdb, chain A (#276), sequence
alignment score = 1664.5  
RMSD between 201 pruned atom pairs is 0.896 angstroms; (across all 330 pairs:
5.199)  
  
Matchmaker 0.pdb, chain B (#1) with 55.2.pdb, chain A (#277), sequence
alignment score = 1663.9  
RMSD between 209 pruned atom pairs is 0.901 angstroms; (across all 330 pairs:
5.156)  
  
Matchmaker 0.pdb, chain B (#1) with 55.4.pdb, chain B (#278), sequence
alignment score = 1669.3  
RMSD between 215 pruned atom pairs is 0.934 angstroms; (across all 330 pairs:
6.435)  
  
Matchmaker 0.pdb, chain B (#1) with 55.6.pdb, chain A (#279), sequence
alignment score = 1656.7  
RMSD between 205 pruned atom pairs is 0.964 angstroms; (across all 330 pairs:
5.403)  
  
Matchmaker 0.pdb, chain B (#1) with 55.8.pdb, chain B (#280), sequence
alignment score = 1662.7  
RMSD between 241 pruned atom pairs is 1.051 angstroms; (across all 330 pairs:
4.890)  
  
Matchmaker 0.pdb, chain B (#1) with 56.0.pdb, chain A (#281), sequence
alignment score = 1666.9  
RMSD between 197 pruned atom pairs is 0.916 angstroms; (across all 330 pairs:
7.094)  
  
Matchmaker 0.pdb, chain B (#1) with 56.2.pdb, chain B (#282), sequence
alignment score = 1674.1  
RMSD between 236 pruned atom pairs is 0.926 angstroms; (across all 330 pairs:
3.895)  
  
Matchmaker 0.pdb, chain B (#1) with 56.4.pdb, chain A (#283), sequence
alignment score = 1667.5  
RMSD between 208 pruned atom pairs is 0.947 angstroms; (across all 330 pairs:
6.071)  
  
Matchmaker 0.pdb, chain B (#1) with 56.6.pdb, chain A (#284), sequence
alignment score = 1671.1  
RMSD between 201 pruned atom pairs is 0.968 angstroms; (across all 330 pairs:
5.787)  
  
Matchmaker 0.pdb, chain B (#1) with 56.8.pdb, chain B (#285), sequence
alignment score = 1659.1  
RMSD between 229 pruned atom pairs is 0.941 angstroms; (across all 330 pairs:
4.036)  
  
Matchmaker 0.pdb, chain B (#1) with 57.0.pdb, chain B (#286), sequence
alignment score = 1662.7  
RMSD between 218 pruned atom pairs is 0.897 angstroms; (across all 330 pairs:
4.147)  
  
Matchmaker 0.pdb, chain B (#1) with 57.2.pdb, chain B (#287), sequence
alignment score = 1669.3  
RMSD between 212 pruned atom pairs is 0.944 angstroms; (across all 330 pairs:
4.074)  
  
Matchmaker 0.pdb, chain B (#1) with 57.4.pdb, chain A (#288), sequence
alignment score = 1671.1  
RMSD between 196 pruned atom pairs is 0.961 angstroms; (across all 330 pairs:
4.847)  
  
Matchmaker 0.pdb, chain B (#1) with 57.6.pdb, chain B (#289), sequence
alignment score = 1664.5  
RMSD between 209 pruned atom pairs is 0.908 angstroms; (across all 330 pairs:
3.879)  
  
Matchmaker 0.pdb, chain B (#1) with 57.8.pdb, chain B (#290), sequence
alignment score = 1669.3  
RMSD between 211 pruned atom pairs is 0.903 angstroms; (across all 330 pairs:
3.943)  
  
Matchmaker 0.pdb, chain B (#1) with 58.0.pdb, chain B (#291), sequence
alignment score = 1668.7  
RMSD between 223 pruned atom pairs is 0.939 angstroms; (across all 330 pairs:
4.999)  
  
Matchmaker 0.pdb, chain B (#1) with 58.2.pdb, chain A (#292), sequence
alignment score = 1671.1  
RMSD between 191 pruned atom pairs is 0.889 angstroms; (across all 330 pairs:
5.602)  
  
Matchmaker 0.pdb, chain A (#1) with 58.4.pdb, chain A (#293), sequence
alignment score = 1669.9  
RMSD between 192 pruned atom pairs is 0.954 angstroms; (across all 330 pairs:
4.312)  
  
Matchmaker 0.pdb, chain B (#1) with 58.6.pdb, chain B (#294), sequence
alignment score = 1671.7  
RMSD between 218 pruned atom pairs is 0.953 angstroms; (across all 330 pairs:
4.698)  
  
Matchmaker 0.pdb, chain B (#1) with 58.8.pdb, chain B (#295), sequence
alignment score = 1668.7  
RMSD between 200 pruned atom pairs is 0.801 angstroms; (across all 330 pairs:
4.438)  
  
Matchmaker 0.pdb, chain B (#1) with 59.0.pdb, chain B (#296), sequence
alignment score = 1659.1  
RMSD between 219 pruned atom pairs is 0.955 angstroms; (across all 330 pairs:
5.545)  
  
Matchmaker 0.pdb, chain B (#1) with 59.2.pdb, chain B (#297), sequence
alignment score = 1672.3  
RMSD between 218 pruned atom pairs is 0.950 angstroms; (across all 330 pairs:
4.643)  
  
Matchmaker 0.pdb, chain B (#1) with 59.4.pdb, chain A (#298), sequence
alignment score = 1671.7  
RMSD between 199 pruned atom pairs is 0.984 angstroms; (across all 330 pairs:
4.488)  
  
Matchmaker 0.pdb, chain B (#1) with 59.6.pdb, chain B (#299), sequence
alignment score = 1652.5  
RMSD between 205 pruned atom pairs is 0.947 angstroms; (across all 330 pairs:
4.728)  
  
Matchmaker 0.pdb, chain B (#1) with 59.8.pdb, chain B (#300), sequence
alignment score = 1666.3  
RMSD between 221 pruned atom pairs is 0.950 angstroms; (across all 330 pairs:
4.820)  
  
Matchmaker 0.pdb, chain B (#1) with 60.0.pdb, chain B (#301), sequence
alignment score = 1674.7  
RMSD between 215 pruned atom pairs is 0.966 angstroms; (across all 330 pairs:
4.515)  
  
Matchmaker 0.pdb, chain B (#1) with 60.2.pdb, chain A (#302), sequence
alignment score = 1667.5  
RMSD between 194 pruned atom pairs is 0.983 angstroms; (across all 330 pairs:
5.103)  
  
Matchmaker 0.pdb, chain B (#1) with 60.4.pdb, chain B (#303), sequence
alignment score = 1675.9  
RMSD between 187 pruned atom pairs is 0.879 angstroms; (across all 330 pairs:
5.889)  
  
Matchmaker 0.pdb, chain B (#1) with 60.6.pdb, chain B (#304), sequence
alignment score = 1672.3  
RMSD between 206 pruned atom pairs is 0.892 angstroms; (across all 330 pairs:
4.141)  
  
Matchmaker 0.pdb, chain B (#1) with 60.8.pdb, chain B (#305), sequence
alignment score = 1672.3  
RMSD between 207 pruned atom pairs is 0.948 angstroms; (across all 330 pairs:
3.502)  
  
Matchmaker 0.pdb, chain B (#1) with 61.0.pdb, chain A (#306), sequence
alignment score = 1656.7  
RMSD between 197 pruned atom pairs is 0.977 angstroms; (across all 330 pairs:
4.738)  
  
Matchmaker 0.pdb, chain B (#1) with 61.2.pdb, chain B (#307), sequence
alignment score = 1678.3  
RMSD between 200 pruned atom pairs is 0.902 angstroms; (across all 330 pairs:
4.075)  
  
Matchmaker 0.pdb, chain B (#1) with 61.4.pdb, chain A (#308), sequence
alignment score = 1671.1  
RMSD between 197 pruned atom pairs is 0.872 angstroms; (across all 330 pairs:
3.434)  
  
Matchmaker 0.pdb, chain B (#1) with 61.6.pdb, chain B (#309), sequence
alignment score = 1668.1  
RMSD between 217 pruned atom pairs is 0.944 angstroms; (across all 330 pairs:
4.153)  
  
Matchmaker 0.pdb, chain B (#1) with 61.8.pdb, chain A (#310), sequence
alignment score = 1663.9  
RMSD between 206 pruned atom pairs is 0.948 angstroms; (across all 330 pairs:
5.163)  
  
Matchmaker 0.pdb, chain B (#1) with 62.0.pdb, chain B (#311), sequence
alignment score = 1665.7  
RMSD between 195 pruned atom pairs is 0.847 angstroms; (across all 330 pairs:
4.741)  
  
Matchmaker 0.pdb, chain B (#1) with 62.2.pdb, chain A (#312), sequence
alignment score = 1663.9  
RMSD between 195 pruned atom pairs is 0.929 angstroms; (across all 330 pairs:
3.945)  
  
Matchmaker 0.pdb, chain B (#1) with 62.4.pdb, chain B (#313), sequence
alignment score = 1675.3  
RMSD between 220 pruned atom pairs is 0.851 angstroms; (across all 330 pairs:
4.336)  
  
Matchmaker 0.pdb, chain B (#1) with 62.6.pdb, chain B (#314), sequence
alignment score = 1674.7  
RMSD between 207 pruned atom pairs is 0.797 angstroms; (across all 330 pairs:
4.325)  
  
Matchmaker 0.pdb, chain A (#1) with 62.8.pdb, chain A (#315), sequence
alignment score = 1663.9  
RMSD between 204 pruned atom pairs is 0.836 angstroms; (across all 330 pairs:
4.108)  
  
Matchmaker 0.pdb, chain B (#1) with 63.0.pdb, chain B (#316), sequence
alignment score = 1678.9  
RMSD between 224 pruned atom pairs is 0.960 angstroms; (across all 330 pairs:
3.537)  
  
Matchmaker 0.pdb, chain B (#1) with 63.2.pdb, chain B (#317), sequence
alignment score = 1665.7  
RMSD between 233 pruned atom pairs is 0.973 angstroms; (across all 330 pairs:
3.420)  
  
Matchmaker 0.pdb, chain B (#1) with 63.4.pdb, chain B (#318), sequence
alignment score = 1668.1  
RMSD between 247 pruned atom pairs is 1.018 angstroms; (across all 330 pairs:
2.820)  
  
Matchmaker 0.pdb, chain B (#1) with 63.6.pdb, chain A (#319), sequence
alignment score = 1663.9  
RMSD between 216 pruned atom pairs is 0.934 angstroms; (across all 330 pairs:
4.177)  
  
Matchmaker 0.pdb, chain B (#1) with 63.8.pdb, chain A (#320), sequence
alignment score = 1671.1  
RMSD between 199 pruned atom pairs is 0.957 angstroms; (across all 330 pairs:
3.485)  
  
Matchmaker 0.pdb, chain B (#1) with 64.0.pdb, chain B (#321), sequence
alignment score = 1669.3  
RMSD between 226 pruned atom pairs is 0.903 angstroms; (across all 330 pairs:
3.686)  
  
Matchmaker 0.pdb, chain B (#1) with 64.2.pdb, chain A (#322), sequence
alignment score = 1674.7  
RMSD between 203 pruned atom pairs is 0.974 angstroms; (across all 330 pairs:
2.685)  
  
Matchmaker 0.pdb, chain B (#1) with 64.4.pdb, chain A (#323), sequence
alignment score = 1670.5  
RMSD between 224 pruned atom pairs is 0.979 angstroms; (across all 330 pairs:
2.669)  
  
Matchmaker 0.pdb, chain B (#1) with 64.6.pdb, chain A (#324), sequence
alignment score = 1663.3  
RMSD between 217 pruned atom pairs is 1.044 angstroms; (across all 330 pairs:
2.681)  
  
Matchmaker 0.pdb, chain B (#1) with 64.8.pdb, chain B (#325), sequence
alignment score = 1674.1  
RMSD between 264 pruned atom pairs is 1.016 angstroms; (across all 330 pairs:
2.258)  
  
Matchmaker 0.pdb, chain B (#1) with 65.0.pdb, chain A (#326), sequence
alignment score = 1664.5  
RMSD between 208 pruned atom pairs is 0.942 angstroms; (across all 330 pairs:
3.731)  
  
Matchmaker 0.pdb, chain B (#1) with 65.2.pdb, chain A (#327), sequence
alignment score = 1671.1  
RMSD between 185 pruned atom pairs is 0.829 angstroms; (across all 330 pairs:
3.479)  
  
Matchmaker 0.pdb, chain B (#1) with 65.4.pdb, chain A (#328), sequence
alignment score = 1667.5  
RMSD between 208 pruned atom pairs is 0.961 angstroms; (across all 330 pairs:
4.088)  
  
Matchmaker 0.pdb, chain B (#1) with 65.6.pdb, chain A (#329), sequence
alignment score = 1663.9  
RMSD between 211 pruned atom pairs is 0.936 angstroms; (across all 330 pairs:
3.768)  
  
Matchmaker 0.pdb, chain B (#1) with 65.8.pdb, chain A (#330), sequence
alignment score = 1670.5  
RMSD between 195 pruned atom pairs is 0.971 angstroms; (across all 330 pairs:
5.435)  
  
Matchmaker 0.pdb, chain B (#1) with 66.0.pdb, chain A (#331), sequence
alignment score = 1668.1  
RMSD between 208 pruned atom pairs is 0.972 angstroms; (across all 330 pairs:
4.401)  
  
Matchmaker 0.pdb, chain B (#1) with 66.2.pdb, chain B (#332), sequence
alignment score = 1668.1  
RMSD between 206 pruned atom pairs is 0.988 angstroms; (across all 330 pairs:
5.635)  
  
Matchmaker 0.pdb, chain B (#1) with 66.4.pdb, chain A (#333), sequence
alignment score = 1663.3  
RMSD between 233 pruned atom pairs is 1.069 angstroms; (across all 330 pairs:
3.994)  
  
Matchmaker 0.pdb, chain A (#1) with 66.6.pdb, chain B (#334), sequence
alignment score = 1668.7  
RMSD between 229 pruned atom pairs is 0.905 angstroms; (across all 330 pairs:
5.348)  
  
Matchmaker 0.pdb, chain B (#1) with 66.8.pdb, chain B (#335), sequence
alignment score = 1666.9  
RMSD between 242 pruned atom pairs is 0.945 angstroms; (across all 330 pairs:
4.935)  
  
Matchmaker 0.pdb, chain B (#1) with 67.0.pdb, chain B (#336), sequence
alignment score = 1662.7  
RMSD between 235 pruned atom pairs is 0.936 angstroms; (across all 330 pairs:
4.406)  
  
Matchmaker 0.pdb, chain B (#1) with 67.2.pdb, chain A (#337), sequence
alignment score = 1671.1  
RMSD between 198 pruned atom pairs is 1.049 angstroms; (across all 330 pairs:
3.000)  
  
Matchmaker 0.pdb, chain B (#1) with 67.4.pdb, chain B (#338), sequence
alignment score = 1672.3  
RMSD between 215 pruned atom pairs is 0.889 angstroms; (across all 330 pairs:
5.976)  
  
Matchmaker 0.pdb, chain B (#1) with 67.6.pdb, chain A (#339), sequence
alignment score = 1667.5  
RMSD between 192 pruned atom pairs is 0.869 angstroms; (across all 330 pairs:
2.962)  
  
Matchmaker 0.pdb, chain B (#1) with 67.8.pdb, chain A (#340), sequence
alignment score = 1671.1  
RMSD between 216 pruned atom pairs is 0.961 angstroms; (across all 330 pairs:
2.852)  
  
Matchmaker 0.pdb, chain B (#1) with 68.0.pdb, chain B (#341), sequence
alignment score = 1668.7  
RMSD between 216 pruned atom pairs is 0.813 angstroms; (across all 330 pairs:
5.823)  
  
Matchmaker 0.pdb, chain B (#1) with 68.2.pdb, chain B (#342), sequence
alignment score = 1670.5  
RMSD between 219 pruned atom pairs is 0.876 angstroms; (across all 330 pairs:
5.383)  
  
Matchmaker 0.pdb, chain B (#1) with 68.4.pdb, chain A (#343), sequence
alignment score = 1659.7  
RMSD between 196 pruned atom pairs is 0.858 angstroms; (across all 330 pairs:
2.843)  
  
Matchmaker 0.pdb, chain B (#1) with 68.6.pdb, chain A (#344), sequence
alignment score = 1674.7  
RMSD between 203 pruned atom pairs is 1.034 angstroms; (across all 330 pairs:
3.160)  
  
Matchmaker 0.pdb, chain B (#1) with 68.8.pdb, chain A (#345), sequence
alignment score = 1671.1  
RMSD between 213 pruned atom pairs is 1.054 angstroms; (across all 330 pairs:
3.582)  
  
Matchmaker 0.pdb, chain B (#1) with 69.0.pdb, chain B (#346), sequence
alignment score = 1671.1  
RMSD between 228 pruned atom pairs is 0.956 angstroms; (across all 330 pairs:
4.720)  
  
Matchmaker 0.pdb, chain B (#1) with 69.2.pdb, chain B (#347), sequence
alignment score = 1660.9  
RMSD between 230 pruned atom pairs is 1.024 angstroms; (across all 330 pairs:
4.644)  
  
Matchmaker 0.pdb, chain A (#1) with 69.4.pdb, chain B (#348), sequence
alignment score = 1668.1  
RMSD between 217 pruned atom pairs is 0.998 angstroms; (across all 330 pairs:
3.983)  
  
Matchmaker 0.pdb, chain B (#1) with 69.6.pdb, chain B (#349), sequence
alignment score = 1672.3  
RMSD between 235 pruned atom pairs is 0.949 angstroms; (across all 330 pairs:
3.695)  
  
Matchmaker 0.pdb, chain B (#1) with 69.8.pdb, chain A (#350), sequence
alignment score = 1670.5  
RMSD between 203 pruned atom pairs is 1.065 angstroms; (across all 330 pairs:
3.634)  
  
Matchmaker 0.pdb, chain B (#1) with 70.0.pdb, chain B (#351), sequence
alignment score = 1677.7  
RMSD between 216 pruned atom pairs is 0.886 angstroms; (across all 330 pairs:
5.052)  
  
Matchmaker 0.pdb, chain B (#1) with 70.2.pdb, chain A (#352), sequence
alignment score = 1674.7  
RMSD between 227 pruned atom pairs is 1.129 angstroms; (across all 330 pairs:
3.349)  
  
Matchmaker 0.pdb, chain B (#1) with 70.4.pdb, chain B (#353), sequence
alignment score = 1681.3  
RMSD between 212 pruned atom pairs is 1.007 angstroms; (across all 330 pairs:
4.733)  
  
Matchmaker 0.pdb, chain B (#1) with 70.6.pdb, chain B (#354), sequence
alignment score = 1672.3  
RMSD between 231 pruned atom pairs is 1.031 angstroms; (across all 330 pairs:
3.702)  
  
Matchmaker 0.pdb, chain B (#1) with 70.8.pdb, chain A (#355), sequence
alignment score = 1671.1  
RMSD between 208 pruned atom pairs is 0.972 angstroms; (across all 330 pairs:
3.378)  
  
Matchmaker 0.pdb, chain B (#1) with 71.0.pdb, chain A (#356), sequence
alignment score = 1671.1  
RMSD between 204 pruned atom pairs is 1.042 angstroms; (across all 330 pairs:
5.002)  
  
Matchmaker 0.pdb, chain B (#1) with 71.2.pdb, chain B (#357), sequence
alignment score = 1677.7  
RMSD between 229 pruned atom pairs is 0.924 angstroms; (across all 330 pairs:
4.263)  
  
Matchmaker 0.pdb, chain B (#1) with 71.4.pdb, chain A (#358), sequence
alignment score = 1671.1  
RMSD between 195 pruned atom pairs is 0.886 angstroms; (across all 330 pairs:
4.327)  
  
Matchmaker 0.pdb, chain B (#1) with 71.6.pdb, chain A (#359), sequence
alignment score = 1671.1  
RMSD between 232 pruned atom pairs is 1.080 angstroms; (across all 330 pairs:
3.222)  
  
Matchmaker 0.pdb, chain B (#1) with 71.8.pdb, chain B (#360), sequence
alignment score = 1671.7  
RMSD between 208 pruned atom pairs is 0.935 angstroms; (across all 330 pairs:
3.499)  
  
Matchmaker 0.pdb, chain B (#1) with 72.0.pdb, chain B (#361), sequence
alignment score = 1671.7  
RMSD between 211 pruned atom pairs is 0.917 angstroms; (across all 330 pairs:
4.146)  
  
Matchmaker 0.pdb, chain B (#1) with 72.2.pdb, chain B (#362), sequence
alignment score = 1677.7  
RMSD between 224 pruned atom pairs is 0.983 angstroms; (across all 330 pairs:
3.600)  
  
Matchmaker 0.pdb, chain B (#1) with 72.4.pdb, chain B (#363), sequence
alignment score = 1671.1  
RMSD between 217 pruned atom pairs is 0.920 angstroms; (across all 330 pairs:
3.403)  
  
Matchmaker 0.pdb, chain B (#1) with 72.6.pdb, chain B (#364), sequence
alignment score = 1681.9  
RMSD between 219 pruned atom pairs is 0.920 angstroms; (across all 330 pairs:
2.550)  
  
Matchmaker 0.pdb, chain B (#1) with 72.8.pdb, chain B (#365), sequence
alignment score = 1678.3  
RMSD between 229 pruned atom pairs is 0.926 angstroms; (across all 330 pairs:
2.858)  
  
Matchmaker 0.pdb, chain B (#1) with 73.0.pdb, chain B (#366), sequence
alignment score = 1674.7  
RMSD between 265 pruned atom pairs is 1.132 angstroms; (across all 330 pairs:
2.300)  
  
Matchmaker 0.pdb, chain B (#1) with 73.2.pdb, chain B (#367), sequence
alignment score = 1666.9  
RMSD between 233 pruned atom pairs is 0.928 angstroms; (across all 330 pairs:
3.879)  
  
Matchmaker 0.pdb, chain B (#1) with 73.4.pdb, chain A (#368), sequence
alignment score = 1674.7  
RMSD between 204 pruned atom pairs is 0.930 angstroms; (across all 330 pairs:
2.823)  
  
Matchmaker 0.pdb, chain B (#1) with 73.6.pdb, chain B (#369), sequence
alignment score = 1671.7  
RMSD between 239 pruned atom pairs is 1.103 angstroms; (across all 330 pairs:
2.731)  
  
Matchmaker 0.pdb, chain A (#1) with 73.8.pdb, chain A (#370), sequence
alignment score = 1671.1  
RMSD between 191 pruned atom pairs is 0.911 angstroms; (across all 330 pairs:
3.012)  
  
Matchmaker 0.pdb, chain B (#1) with 74.0.pdb, chain A (#371), sequence
alignment score = 1671.1  
RMSD between 228 pruned atom pairs is 1.067 angstroms; (across all 330 pairs:
2.353)  
  
Matchmaker 0.pdb, chain B (#1) with 74.2.pdb, chain B (#372), sequence
alignment score = 1671.1  
RMSD between 250 pruned atom pairs is 1.012 angstroms; (across all 330 pairs:
2.672)  
  
Matchmaker 0.pdb, chain B (#1) with 74.4.pdb, chain A (#373), sequence
alignment score = 1668.7  
RMSD between 210 pruned atom pairs is 0.960 angstroms; (across all 330 pairs:
2.839)  
  
Matchmaker 0.pdb, chain B (#1) with 74.6.pdb, chain A (#374), sequence
alignment score = 1675.3  
RMSD between 213 pruned atom pairs is 1.028 angstroms; (across all 330 pairs:
3.078)  
  
Matchmaker 0.pdb, chain A (#1) with 74.8.pdb, chain A (#375), sequence
alignment score = 1674.1  
RMSD between 215 pruned atom pairs is 1.100 angstroms; (across all 330 pairs:
2.495)  
  
Matchmaker 0.pdb, chain B (#1) with 75.0.pdb, chain A (#376), sequence
alignment score = 1678.3  
RMSD between 226 pruned atom pairs is 0.981 angstroms; (across all 330 pairs:
3.016)  
  
Matchmaker 0.pdb, chain B (#1) with 75.2.pdb, chain A (#377), sequence
alignment score = 1665.1  
RMSD between 205 pruned atom pairs is 0.936 angstroms; (across all 330 pairs:
3.323)  
  
Matchmaker 0.pdb, chain A (#1) with 75.4.pdb, chain A (#378), sequence
alignment score = 1677.7  
RMSD between 210 pruned atom pairs is 1.042 angstroms; (across all 330 pairs:
3.084)  
  
Matchmaker 0.pdb, chain B (#1) with 75.6.pdb, chain A (#379), sequence
alignment score = 1668.7  
RMSD between 191 pruned atom pairs is 0.926 angstroms; (across all 330 pairs:
3.489)  
  
Matchmaker 0.pdb, chain B (#1) with 75.8.pdb, chain A (#380), sequence
alignment score = 1671.1  
RMSD between 186 pruned atom pairs is 0.928 angstroms; (across all 330 pairs:
3.224)  
  
Matchmaker 0.pdb, chain B (#1) with 76.0.pdb, chain A (#381), sequence
alignment score = 1674.7  
RMSD between 210 pruned atom pairs is 0.998 angstroms; (across all 330 pairs:
3.226)  
  
Matchmaker 0.pdb, chain A (#1) with 76.2.pdb, chain A (#382), sequence
alignment score = 1674.7  
RMSD between 215 pruned atom pairs is 0.964 angstroms; (across all 330 pairs:
3.489)  
  
Matchmaker 0.pdb, chain B (#1) with 76.4.pdb, chain A (#383), sequence
alignment score = 1672.3  
RMSD between 218 pruned atom pairs is 1.039 angstroms; (across all 330 pairs:
3.771)  
  
Matchmaker 0.pdb, chain B (#1) with 76.6.pdb, chain A (#384), sequence
alignment score = 1675.3  
RMSD between 212 pruned atom pairs is 1.032 angstroms; (across all 330 pairs:
4.281)  
  
Matchmaker 0.pdb, chain B (#1) with 76.8.pdb, chain A (#385), sequence
alignment score = 1675.3  
RMSD between 217 pruned atom pairs is 1.062 angstroms; (across all 330 pairs:
4.667)  
  
Matchmaker 0.pdb, chain B (#1) with 77.0.pdb, chain B (#386), sequence
alignment score = 1675.9  
RMSD between 233 pruned atom pairs is 0.862 angstroms; (across all 330 pairs:
2.494)  
  
Matchmaker 0.pdb, chain B (#1) with 77.2.pdb, chain A (#387), sequence
alignment score = 1675.3  
RMSD between 217 pruned atom pairs is 0.980 angstroms; (across all 330 pairs:
3.743)  
  
Matchmaker 0.pdb, chain B (#1) with 77.4.pdb, chain B (#388), sequence
alignment score = 1671.1  
RMSD between 226 pruned atom pairs is 0.883 angstroms; (across all 330 pairs:
3.332)  
  
Matchmaker 0.pdb, chain B (#1) with 77.6.pdb, chain A (#389), sequence
alignment score = 1671.7  
RMSD between 225 pruned atom pairs is 1.076 angstroms; (across all 330 pairs:
3.370)  
  
Matchmaker 0.pdb, chain B (#1) with 77.8.pdb, chain B (#390), sequence
alignment score = 1668.7  
RMSD between 223 pruned atom pairs is 0.900 angstroms; (across all 330 pairs:
3.226)  
  
Matchmaker 0.pdb, chain B (#1) with 78.0.pdb, chain A (#391), sequence
alignment score = 1677.7  
RMSD between 223 pruned atom pairs is 1.071 angstroms; (across all 330 pairs:
2.751)  
  
Matchmaker 0.pdb, chain B (#1) with 78.2.pdb, chain B (#392), sequence
alignment score = 1675.3  
RMSD between 224 pruned atom pairs is 0.864 angstroms; (across all 330 pairs:
3.647)  
  
Matchmaker 0.pdb, chain B (#1) with 78.4.pdb, chain A (#393), sequence
alignment score = 1675.3  
RMSD between 221 pruned atom pairs is 1.088 angstroms; (across all 330 pairs:
2.758)  
  
Matchmaker 0.pdb, chain A (#1) with 78.6.pdb, chain A (#394), sequence
alignment score = 1674.7  
RMSD between 214 pruned atom pairs is 1.081 angstroms; (across all 330 pairs:
2.704)  
  
Matchmaker 0.pdb, chain B (#1) with 78.8.pdb, chain A (#395), sequence
alignment score = 1671.1  
RMSD between 218 pruned atom pairs is 1.037 angstroms; (across all 330 pairs:
3.026)  
  
Matchmaker 0.pdb, chain B (#1) with 79.0.pdb, chain B (#396), sequence
alignment score = 1672.9  
RMSD between 215 pruned atom pairs is 0.886 angstroms; (across all 330 pairs:
3.154)  
  
Matchmaker 0.pdb, chain B (#1) with 79.2.pdb, chain A (#397), sequence
alignment score = 1671.1  
RMSD between 199 pruned atom pairs is 0.960 angstroms; (across all 330 pairs:
3.335)  
  
Matchmaker 0.pdb, chain B (#1) with 79.4.pdb, chain B (#398), sequence
alignment score = 1674.7  
RMSD between 214 pruned atom pairs is 0.917 angstroms; (across all 330 pairs:
2.848)  
  
Matchmaker 0.pdb, chain B (#1) with 79.6.pdb, chain A (#399), sequence
alignment score = 1678.3  
RMSD between 217 pruned atom pairs is 1.024 angstroms; (across all 330 pairs:
3.665)  
  
Matchmaker 0.pdb, chain B (#1) with 79.8.pdb, chain B (#400), sequence
alignment score = 1684.9  
RMSD between 222 pruned atom pairs is 0.859 angstroms; (across all 330 pairs:
3.094)  
  
Matchmaker 0.pdb, chain B (#1) with 80.0.pdb, chain A (#401), sequence
alignment score = 1674.1  
RMSD between 194 pruned atom pairs is 0.962 angstroms; (across all 330 pairs:
3.757)  
  
Matchmaker 0.pdb, chain B (#1) with 80.2.pdb, chain A (#402), sequence
alignment score = 1668.1  
RMSD between 212 pruned atom pairs is 0.971 angstroms; (across all 330 pairs:
3.701)  
  
Matchmaker 0.pdb, chain B (#1) with 80.4.pdb, chain A (#403), sequence
alignment score = 1674.1  
RMSD between 197 pruned atom pairs is 0.948 angstroms; (across all 330 pairs:
4.163)  
  
Matchmaker 0.pdb, chain B (#1) with 80.6.pdb, chain A (#404), sequence
alignment score = 1662.1  
RMSD between 210 pruned atom pairs is 0.979 angstroms; (across all 330 pairs:
4.167)  
  
Matchmaker 0.pdb, chain A (#1) with 80.8.pdb, chain B (#405), sequence
alignment score = 1668.1  
RMSD between 205 pruned atom pairs is 1.023 angstroms; (across all 330 pairs:
2.981)  
  
Matchmaker 0.pdb, chain B (#1) with 81.0.pdb, chain B (#406), sequence
alignment score = 1671.1  
RMSD between 229 pruned atom pairs is 0.975 angstroms; (across all 330 pairs:
2.812)  
  
Matchmaker 0.pdb, chain B (#1) with 81.2.pdb, chain A (#407), sequence
alignment score = 1671.1  
RMSD between 209 pruned atom pairs is 0.946 angstroms; (across all 330 pairs:
3.070)  
  
Matchmaker 0.pdb, chain B (#1) with 81.4.pdb, chain A (#408), sequence
alignment score = 1674.7  
RMSD between 208 pruned atom pairs is 0.961 angstroms; (across all 330 pairs:
3.262)  
  
Matchmaker 0.pdb, chain A (#1) with 81.6.pdb, chain A (#409), sequence
alignment score = 1671.1  
RMSD between 196 pruned atom pairs is 0.973 angstroms; (across all 330 pairs:
4.021)  
  
Matchmaker 0.pdb, chain B (#1) with 81.8.pdb, chain A (#410), sequence
alignment score = 1668.7  
RMSD between 201 pruned atom pairs is 0.968 angstroms; (across all 330 pairs:
3.628)  
  
Matchmaker 0.pdb, chain B (#1) with 82.0.pdb, chain A (#411), sequence
alignment score = 1672.3  
RMSD between 205 pruned atom pairs is 1.070 angstroms; (across all 330 pairs:
3.489)  
  
Matchmaker 0.pdb, chain B (#1) with 82.2.pdb, chain A (#412), sequence
alignment score = 1674.1  
RMSD between 204 pruned atom pairs is 1.034 angstroms; (across all 330 pairs:
2.999)  
  
Matchmaker 0.pdb, chain B (#1) with 82.4.pdb, chain A (#413), sequence
alignment score = 1668.1  
RMSD between 203 pruned atom pairs is 1.006 angstroms; (across all 330 pairs:
3.901)  
  
Matchmaker 0.pdb, chain B (#1) with 82.6.pdb, chain A (#414), sequence
alignment score = 1674.7  
RMSD between 208 pruned atom pairs is 0.959 angstroms; (across all 330 pairs:
4.596)  
  
Matchmaker 0.pdb, chain B (#1) with 82.8.pdb, chain A (#415), sequence
alignment score = 1674.7  
RMSD between 209 pruned atom pairs is 0.990 angstroms; (across all 330 pairs:
4.355)  
  
Matchmaker 0.pdb, chain B (#1) with 83.0.pdb, chain B (#416), sequence
alignment score = 1670.5  
RMSD between 229 pruned atom pairs is 0.985 angstroms; (across all 330 pairs:
3.104)  
  
Matchmaker 0.pdb, chain B (#1) with 83.2.pdb, chain A (#417), sequence
alignment score = 1677.7  
RMSD between 207 pruned atom pairs is 0.988 angstroms; (across all 330 pairs:
3.828)  
  
Matchmaker 0.pdb, chain B (#1) with 83.4.pdb, chain A (#418), sequence
alignment score = 1668.1  
RMSD between 199 pruned atom pairs is 1.093 angstroms; (across all 330 pairs:
4.027)  
  
Matchmaker 0.pdb, chain B (#1) with 83.6.pdb, chain A (#419), sequence
alignment score = 1678.3  
RMSD between 225 pruned atom pairs is 1.130 angstroms; (across all 330 pairs:
2.945)  
  
Matchmaker 0.pdb, chain B (#1) with 83.8.pdb, chain A (#420), sequence
alignment score = 1674.7  
RMSD between 259 pruned atom pairs is 1.083 angstroms; (across all 330 pairs:
2.109)  
  
Matchmaker 0.pdb, chain B (#1) with 84.0.pdb, chain B (#421), sequence
alignment score = 1675.3  
RMSD between 237 pruned atom pairs is 0.954 angstroms; (across all 330 pairs:
3.192)  
  
Matchmaker 0.pdb, chain B (#1) with 84.2.pdb, chain A (#422), sequence
alignment score = 1675.3  
RMSD between 226 pruned atom pairs is 0.984 angstroms; (across all 330 pairs:
3.010)  
  
Matchmaker 0.pdb, chain A (#1) with 84.4.pdb, chain A (#423), sequence
alignment score = 1671.1  
RMSD between 244 pruned atom pairs is 0.975 angstroms; (across all 330 pairs:
3.284)  
  
Matchmaker 0.pdb, chain B (#1) with 84.6.pdb, chain B (#424), sequence
alignment score = 1675.3  
RMSD between 252 pruned atom pairs is 1.025 angstroms; (across all 330 pairs:
2.357)  
  
Matchmaker 0.pdb, chain B (#1) with 84.8.pdb, chain A (#425), sequence
alignment score = 1660.9  
RMSD between 226 pruned atom pairs is 0.950 angstroms; (across all 330 pairs:
3.405)  
  
Matchmaker 0.pdb, chain B (#1) with 85.0.pdb, chain B (#426), sequence
alignment score = 1665.7  
RMSD between 243 pruned atom pairs is 0.900 angstroms; (across all 330 pairs:
2.818)  
  
Matchmaker 0.pdb, chain B (#1) with 85.2.pdb, chain A (#427), sequence
alignment score = 1671.1  
RMSD between 244 pruned atom pairs is 1.036 angstroms; (across all 330 pairs:
2.282)  
  
Matchmaker 0.pdb, chain B (#1) with 85.4.pdb, chain A (#428), sequence
alignment score = 1667.5  
RMSD between 234 pruned atom pairs is 0.989 angstroms; (across all 330 pairs:
2.853)  
  
Matchmaker 0.pdb, chain B (#1) with 85.6.pdb, chain B (#429), sequence
alignment score = 1675.3  
RMSD between 252 pruned atom pairs is 0.894 angstroms; (across all 330 pairs:
2.683)  
  
Matchmaker 0.pdb, chain B (#1) with 85.8.pdb, chain B (#430), sequence
alignment score = 1671.7  
RMSD between 230 pruned atom pairs is 0.994 angstroms; (across all 330 pairs:
3.101)  
  
Matchmaker 0.pdb, chain B (#1) with 86.0.pdb, chain B (#431), sequence
alignment score = 1681.3  
RMSD between 219 pruned atom pairs is 0.958 angstroms; (across all 330 pairs:
3.599)  
  
Matchmaker 0.pdb, chain B (#1) with 86.2.pdb, chain B (#432), sequence
alignment score = 1672.3  
RMSD between 228 pruned atom pairs is 0.954 angstroms; (across all 330 pairs:
4.432)  
  
Matchmaker 0.pdb, chain B (#1) with 86.4.pdb, chain B (#433), sequence
alignment score = 1678.9  
RMSD between 220 pruned atom pairs is 0.999 angstroms; (across all 330 pairs:
4.311)  
  
Matchmaker 0.pdb, chain B (#1) with 86.6.pdb, chain B (#434), sequence
alignment score = 1668.7  
RMSD between 223 pruned atom pairs is 0.992 angstroms; (across all 330 pairs:
4.246)  
  
Matchmaker 0.pdb, chain B (#1) with 86.8.pdb, chain B (#435), sequence
alignment score = 1681.9  
RMSD between 216 pruned atom pairs is 0.948 angstroms; (across all 330 pairs:
4.027)  
  
Matchmaker 0.pdb, chain B (#1) with 87.0.pdb, chain B (#436), sequence
alignment score = 1671.7  
RMSD between 218 pruned atom pairs is 0.897 angstroms; (across all 330 pairs:
3.847)  
  
Matchmaker 0.pdb, chain B (#1) with 87.2.pdb, chain B (#437), sequence
alignment score = 1675.3  
RMSD between 232 pruned atom pairs is 0.966 angstroms; (across all 330 pairs:
4.165)  
  
Matchmaker 0.pdb, chain B (#1) with 87.4.pdb, chain A (#438), sequence
alignment score = 1678.3  
RMSD between 225 pruned atom pairs is 0.982 angstroms; (across all 330 pairs:
2.660)  
  
Matchmaker 0.pdb, chain B (#1) with 87.6.pdb, chain B (#439), sequence
alignment score = 1674.7  
RMSD between 230 pruned atom pairs is 0.952 angstroms; (across all 330 pairs:
4.323)  
  
Matchmaker 0.pdb, chain B (#1) with 87.8.pdb, chain B (#440), sequence
alignment score = 1674.7  
RMSD between 233 pruned atom pairs is 0.957 angstroms; (across all 330 pairs:
3.729)  
  
Matchmaker 0.pdb, chain B (#1) with 88.0.pdb, chain A (#441), sequence
alignment score = 1671.1  
RMSD between 239 pruned atom pairs is 0.991 angstroms; (across all 330 pairs:
2.507)  
  
Matchmaker 0.pdb, chain B (#1) with 88.2.pdb, chain B (#442), sequence
alignment score = 1671.7  
RMSD between 224 pruned atom pairs is 0.905 angstroms; (across all 330 pairs:
6.143)  
  
Matchmaker 0.pdb, chain B (#1) with 88.4.pdb, chain B (#443), sequence
alignment score = 1671.1  
RMSD between 216 pruned atom pairs is 0.929 angstroms; (across all 330 pairs:
4.736)  
  
Matchmaker 0.pdb, chain B (#1) with 88.6.pdb, chain A (#444), sequence
alignment score = 1672.3  
RMSD between 225 pruned atom pairs is 0.997 angstroms; (across all 330 pairs:
3.842)  
  
Matchmaker 0.pdb, chain B (#1) with 88.8.pdb, chain A (#445), sequence
alignment score = 1664.5  
RMSD between 219 pruned atom pairs is 1.035 angstroms; (across all 330 pairs:
3.404)  
  
Matchmaker 0.pdb, chain B (#1) with 89.0.pdb, chain A (#446), sequence
alignment score = 1668.1  
RMSD between 209 pruned atom pairs is 0.978 angstroms; (across all 330 pairs:
3.510)  
  
Matchmaker 0.pdb, chain B (#1) with 89.2.pdb, chain B (#447), sequence
alignment score = 1671.1  
RMSD between 213 pruned atom pairs is 0.939 angstroms; (across all 330 pairs:
5.563)  
  
Matchmaker 0.pdb, chain B (#1) with 89.4.pdb, chain A (#448), sequence
alignment score = 1674.1  
RMSD between 224 pruned atom pairs is 1.048 angstroms; (across all 330 pairs:
3.370)  
  
Matchmaker 0.pdb, chain A (#1) with 89.6.pdb, chain B (#449), sequence
alignment score = 1674.7  
RMSD between 210 pruned atom pairs is 0.961 angstroms; (across all 330 pairs:
6.496)  
  
Matchmaker 0.pdb, chain A (#1) with 89.8.pdb, chain A (#450), sequence
alignment score = 1671.1  
RMSD between 214 pruned atom pairs is 1.016 angstroms; (across all 330 pairs:
3.088)  
  
Matchmaker 0.pdb, chain B (#1) with 90.0.pdb, chain A (#451), sequence
alignment score = 1677.7  
RMSD between 233 pruned atom pairs is 1.030 angstroms; (across all 330 pairs:
2.669)  
  
Matchmaker 0.pdb, chain A (#1) with 90.2.pdb, chain A (#452), sequence
alignment score = 1677.1  
RMSD between 239 pruned atom pairs is 0.996 angstroms; (across all 330 pairs:
2.574)  
  
Matchmaker 0.pdb, chain B (#1) with 90.4.pdb, chain B (#453), sequence
alignment score = 1665.7  
RMSD between 225 pruned atom pairs is 1.004 angstroms; (across all 330 pairs:
5.015)  
  
Matchmaker 0.pdb, chain B (#1) with 90.6.pdb, chain A (#454), sequence
alignment score = 1671.1  
RMSD between 233 pruned atom pairs is 0.965 angstroms; (across all 330 pairs:
3.305)  
  
Matchmaker 0.pdb, chain B (#1) with 90.8.pdb, chain B (#455), sequence
alignment score = 1669.3  
RMSD between 220 pruned atom pairs is 0.968 angstroms; (across all 330 pairs:
5.233)  
  
Matchmaker 0.pdb, chain B (#1) with 91.0.pdb, chain B (#456), sequence
alignment score = 1668.1  
RMSD between 205 pruned atom pairs is 0.964 angstroms; (across all 330 pairs:
6.244)  
  
Matchmaker 0.pdb, chain B (#1) with 91.2.pdb, chain A (#457), sequence
alignment score = 1675.3  
RMSD between 225 pruned atom pairs is 0.941 angstroms; (across all 330 pairs:
2.924)  
  
Matchmaker 0.pdb, chain B (#1) with 91.4.pdb, chain A (#458), sequence
alignment score = 1667.5  
RMSD between 241 pruned atom pairs is 1.047 angstroms; (across all 330 pairs:
2.666)  
  
Matchmaker 0.pdb, chain B (#1) with 91.6.pdb, chain A (#459), sequence
alignment score = 1671.1  
RMSD between 223 pruned atom pairs is 0.975 angstroms; (across all 330 pairs:
3.275)  
  
Matchmaker 0.pdb, chain B (#1) with 91.8.pdb, chain B (#460), sequence
alignment score = 1671.7  
RMSD between 208 pruned atom pairs is 0.880 angstroms; (across all 330 pairs:
3.505)  
  
Matchmaker 0.pdb, chain B (#1) with 92.0.pdb, chain A (#461), sequence
alignment score = 1667.5  
RMSD between 218 pruned atom pairs is 0.945 angstroms; (across all 330 pairs:
3.643)  
  
Matchmaker 0.pdb, chain B (#1) with 92.2.pdb, chain A (#462), sequence
alignment score = 1674.7  
RMSD between 242 pruned atom pairs is 1.003 angstroms; (across all 330 pairs:
2.506)  
  
Matchmaker 0.pdb, chain B (#1) with 92.4.pdb, chain B (#463), sequence
alignment score = 1675.3  
RMSD between 228 pruned atom pairs is 1.035 angstroms; (across all 330 pairs:
3.393)  
  
Matchmaker 0.pdb, chain B (#1) with 92.6.pdb, chain B (#464), sequence
alignment score = 1675.3  
RMSD between 220 pruned atom pairs is 1.008 angstroms; (across all 330 pairs:
4.376)  
  
Matchmaker 0.pdb, chain A (#1) with 92.8.pdb, chain A (#465), sequence
alignment score = 1668.1  
RMSD between 235 pruned atom pairs is 1.011 angstroms; (across all 330 pairs:
3.340)  
  
Matchmaker 0.pdb, chain B (#1) with 93.0.pdb, chain B (#466), sequence
alignment score = 1668.1  
RMSD between 205 pruned atom pairs is 0.943 angstroms; (across all 330 pairs:
4.922)  
  
Matchmaker 0.pdb, chain B (#1) with 93.2.pdb, chain A (#467), sequence
alignment score = 1668.7  
RMSD between 226 pruned atom pairs is 0.939 angstroms; (across all 330 pairs:
3.614)  
  
Matchmaker 0.pdb, chain B (#1) with 93.4.pdb, chain B (#468), sequence
alignment score = 1672.3  
RMSD between 216 pruned atom pairs is 1.018 angstroms; (across all 330 pairs:
4.713)  
  
Matchmaker 0.pdb, chain B (#1) with 93.6.pdb, chain A (#469), sequence
alignment score = 1668.1  
RMSD between 231 pruned atom pairs is 1.051 angstroms; (across all 330 pairs:
3.489)  
  
Matchmaker 0.pdb, chain B (#1) with 93.8.pdb, chain B (#470), sequence
alignment score = 1671.7  
RMSD between 226 pruned atom pairs is 1.047 angstroms; (across all 330 pairs:
4.307)  
  
Matchmaker 0.pdb, chain B (#1) with 94.0.pdb, chain B (#471), sequence
alignment score = 1671.7  
RMSD between 241 pruned atom pairs is 1.022 angstroms; (across all 330 pairs:
4.119)  
  
Matchmaker 0.pdb, chain B (#1) with 94.2.pdb, chain A (#472), sequence
alignment score = 1667.5  
RMSD between 234 pruned atom pairs is 1.000 angstroms; (across all 330 pairs:
3.166)  
  
Matchmaker 0.pdb, chain A (#1) with 94.4.pdb, chain A (#473), sequence
alignment score = 1671.1  
RMSD between 242 pruned atom pairs is 0.958 angstroms; (across all 330 pairs:
3.324)  
  
Matchmaker 0.pdb, chain B (#1) with 94.6.pdb, chain B (#474), sequence
alignment score = 1669.3  
RMSD between 222 pruned atom pairs is 0.961 angstroms; (across all 330 pairs:
5.151)  
  
Matchmaker 0.pdb, chain B (#1) with 94.8.pdb, chain A (#475), sequence
alignment score = 1667.5  
RMSD between 229 pruned atom pairs is 1.123 angstroms; (across all 330 pairs:
3.008)  
  
Matchmaker 0.pdb, chain B (#1) with 95.0.pdb, chain B (#476), sequence
alignment score = 1661.5  
RMSD between 235 pruned atom pairs is 1.033 angstroms; (across all 330 pairs:
3.915)  
  
Matchmaker 0.pdb, chain B (#1) with 95.2.pdb, chain B (#477), sequence
alignment score = 1669.3  
RMSD between 224 pruned atom pairs is 1.057 angstroms; (across all 330 pairs:
4.164)  
  
Matchmaker 0.pdb, chain B (#1) with 95.4.pdb, chain A (#478), sequence
alignment score = 1671.7  
RMSD between 230 pruned atom pairs is 0.966 angstroms; (across all 330 pairs:
2.750)  
  
Matchmaker 0.pdb, chain B (#1) with 95.6.pdb, chain B (#479), sequence
alignment score = 1672.3  
RMSD between 233 pruned atom pairs is 1.044 angstroms; (across all 330 pairs:
3.767)  
  
Matchmaker 0.pdb, chain B (#1) with 95.8.pdb, chain A (#480), sequence
alignment score = 1675.3  
RMSD between 238 pruned atom pairs is 1.038 angstroms; (across all 330 pairs:
2.962)  
  
Matchmaker 0.pdb, chain B (#1) with 96.0.pdb, chain A (#481), sequence
alignment score = 1666.9  
RMSD between 225 pruned atom pairs is 0.959 angstroms; (across all 330 pairs:
2.880)  
  
Matchmaker 0.pdb, chain B (#1) with 96.2.pdb, chain A (#482), sequence
alignment score = 1671.7  
RMSD between 239 pruned atom pairs is 0.992 angstroms; (across all 330 pairs:
2.794)  
  
Matchmaker 0.pdb, chain B (#1) with 96.4.pdb, chain B (#483), sequence
alignment score = 1669.3  
RMSD between 247 pruned atom pairs is 1.102 angstroms; (across all 330 pairs:
4.728)  
  
Matchmaker 0.pdb, chain B (#1) with 96.6.pdb, chain A (#484), sequence
alignment score = 1671.1  
RMSD between 234 pruned atom pairs is 0.954 angstroms; (across all 330 pairs:
2.722)  
  
Matchmaker 0.pdb, chain B (#1) with 96.8.pdb, chain A (#485), sequence
alignment score = 1657.9  
RMSD between 227 pruned atom pairs is 1.060 angstroms; (across all 330 pairs:
2.597)  
  
Matchmaker 0.pdb, chain B (#1) with 97.0.pdb, chain B (#486), sequence
alignment score = 1671.7  
RMSD between 220 pruned atom pairs is 1.029 angstroms; (across all 330 pairs:
5.616)  
  
Matchmaker 0.pdb, chain B (#1) with 97.2.pdb, chain A (#487), sequence
alignment score = 1675.3  
RMSD between 219 pruned atom pairs is 0.998 angstroms; (across all 330 pairs:
2.699)  
  
Matchmaker 0.pdb, chain B (#1) with 97.4.pdb, chain B (#488), sequence
alignment score = 1674.7  
RMSD between 209 pruned atom pairs is 1.083 angstroms; (across all 330 pairs:
7.129)  
  
Matchmaker 0.pdb, chain B (#1) with 97.6.pdb, chain B (#489), sequence
alignment score = 1669.3  
RMSD between 226 pruned atom pairs is 1.042 angstroms; (across all 330 pairs:
6.547)  
  
Matchmaker 0.pdb, chain B (#1) with 97.8.pdb, chain A (#490), sequence
alignment score = 1672.3  
RMSD between 224 pruned atom pairs is 1.081 angstroms; (across all 330 pairs:
2.779)  
  
Matchmaker 0.pdb, chain B (#1) with 98.0.pdb, chain B (#491), sequence
alignment score = 1672.3  
RMSD between 214 pruned atom pairs is 1.043 angstroms; (across all 330 pairs:
5.949)  
  
Matchmaker 0.pdb, chain B (#1) with 98.2.pdb, chain B (#492), sequence
alignment score = 1672.9  
RMSD between 202 pruned atom pairs is 1.040 angstroms; (across all 330 pairs:
6.306)  
  
Matchmaker 0.pdb, chain B (#1) with 98.4.pdb, chain B (#493), sequence
alignment score = 1665.1  
RMSD between 215 pruned atom pairs is 0.959 angstroms; (across all 330 pairs:
6.080)  
  
Matchmaker 0.pdb, chain B (#1) with 98.6.pdb, chain B (#494), sequence
alignment score = 1662.7  
RMSD between 216 pruned atom pairs is 0.974 angstroms; (across all 330 pairs:
6.215)  
  
Matchmaker 0.pdb, chain A (#1) with 98.8.pdb, chain A (#495), sequence
alignment score = 1674.1  
RMSD between 237 pruned atom pairs is 1.023 angstroms; (across all 330 pairs:
2.907)  
  
Matchmaker 0.pdb, chain B (#1) with 99.0.pdb, chain A (#496), sequence
alignment score = 1668.1  
RMSD between 229 pruned atom pairs is 0.987 angstroms; (across all 330 pairs:
3.138)  
  
Matchmaker 0.pdb, chain B (#1) with 99.2.pdb, chain A (#497), sequence
alignment score = 1678.3  
RMSD between 214 pruned atom pairs is 0.978 angstroms; (across all 330 pairs:
4.116)  
  
Matchmaker 0.pdb, chain B (#1) with 99.4.pdb, chain B (#498), sequence
alignment score = 1671.7  
RMSD between 215 pruned atom pairs is 0.919 angstroms; (across all 330 pairs:
5.701)  
  
Matchmaker 0.pdb, chain B (#1) with 99.6.pdb, chain A (#499), sequence
alignment score = 1681.3  
RMSD between 220 pruned atom pairs is 0.933 angstroms; (across all 330 pairs:
4.143)  
  
Matchmaker 0.pdb, chain B (#1) with 99.8.pdb, chain B (#500), sequence
alignment score = 1671.1  
RMSD between 215 pruned atom pairs is 0.957 angstroms; (across all 330 pairs:
5.949)  
  
Matchmaker 0.pdb, chain B (#1) with 100.0.pdb, chain A (#501), sequence
alignment score = 1675.3  
RMSD between 196 pruned atom pairs is 0.876 angstroms; (across all 330 pairs:
3.534)  
  
Matchmaker 0.pdb, chain B (#1) with 100.2.pdb, chain A (#502), sequence
alignment score = 1671.7  
RMSD between 219 pruned atom pairs is 0.931 angstroms; (across all 330 pairs:
3.836)  
  
Matchmaker 0.pdb, chain B (#1) with 100.4.pdb, chain B (#503), sequence
alignment score = 1662.1  
RMSD between 208 pruned atom pairs is 0.933 angstroms; (across all 330 pairs:
7.571)  
  
Matchmaker 0.pdb, chain B (#1) with 100.6.pdb, chain B (#504), sequence
alignment score = 1674.1  
RMSD between 215 pruned atom pairs is 0.952 angstroms; (across all 330 pairs:
6.961)  
  
Matchmaker 0.pdb, chain B (#1) with 100.8.pdb, chain B (#505), sequence
alignment score = 1665.7  
RMSD between 221 pruned atom pairs is 0.924 angstroms; (across all 330 pairs:
5.929)  
  

> color protein gray

> show :TIP3 atoms

> transparency protein 95 cartoons

> transparency :TIP3 50 atoms

> select :POT

208565 atoms, 3 pseudobonds, 208565 residues, 508 models selected  

> color sel medium purple

> transparency :POT 50 atoms

> select :157-160,266-269

121320 atoms, 121280 bonds, 8120 residues, 505 models selected  

> show sel atoms

> color sel byelement

> hide sel cartoons

> select intersect sideonly

70700 atoms, 66660 bonds, 6060 residues, 505 models selected  

> hide sel atoms

> view orient

> turn y 90

> turn z 90

> turn y 11

> label :TIP3 attribute number offset -0.6,-0.3,0 height 0.3 font Arial

> label :POT attribute number offset -0.6,-0.3,0

> hide target m

> zoom 8.0

> move x -2

> move y -10

executed new_setting.cxc  

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> movie encode 0.2-100.8ns.mp4

Movie saved to 0.2-100.8ns.mp4  
  

> save 0.2-100.8ns.cxs

executed chimera_movie.py  




OpenGL version: 4.1 Metal - 71.7.1
OpenGL renderer: Apple M1
OpenGL vendor: Apple

Python: 3.9.11
Locale: UTF-8
Qt version: PyQt6 6.4.2, Qt 6.4.2
Qt runtime version: 6.4.3
Qt platform: cocoa
Hardware:

    Hardware Overview:

      Model Name: iMac
      Model Identifier: iMac21,1
      Chip: Apple M1
      Total Number of Cores: 8 (4 performance and 4 efficiency)
      Memory: 16 GB
      System Firmware Version: 6723.140.2
      OS Loader Version: 6723.140.2

Software:

    System Software Overview:

      System Version: macOS 11.6 (20G165)
      Kernel Version: Darwin 20.6.0
      Time since boot: 16 days 17:22

Graphics/Displays:

    Apple M1:

      Chipset Model: Apple M1
      Type: GPU
      Bus: Built-In
      Total Number of Cores: 8
      Vendor: Apple (0x106b)
      Metal Family: Supported, Metal GPUFamily Apple 7
      Displays:
        iMac:
          Display Type: Built-In Retina LCD
          Resolution: Retina 4.5K (4480 x 2520)
          Main Display: Yes
          Mirror: Off
          Online: Yes
          Automatically Adjust Brightness: No
          Connection Type: Internal


Installed Packages:
    alabaster: 0.7.13
    appdirs: 1.4.4
    appnope: 0.1.3
    asttokens: 2.2.1
    Babel: 2.12.1
    backcall: 0.2.0
    beautifulsoup4: 4.11.2
    blockdiag: 3.0.0
    build: 0.10.0
    certifi: 2021.10.8
    cftime: 1.6.2
    charset-normalizer: 3.1.0
    ChimeraX-AddCharge: 1.5.9.1
    ChimeraX-AddH: 2.2.5
    ChimeraX-AlignmentAlgorithms: 2.0.1
    ChimeraX-AlignmentHdrs: 3.3.1
    ChimeraX-AlignmentMatrices: 2.1
    ChimeraX-Alignments: 2.9.3
    ChimeraX-AlphaFold: 1.0
    ChimeraX-AltlocExplorer: 1.0.3
    ChimeraX-AmberInfo: 1.0
    ChimeraX-Arrays: 1.1
    ChimeraX-Atomic: 1.43.10
    ChimeraX-AtomicLibrary: 10.0.6
    ChimeraX-AtomSearch: 2.0.1
    ChimeraX-AxesPlanes: 2.3.2
    ChimeraX-BasicActions: 1.1.2
    ChimeraX-BILD: 1.0
    ChimeraX-BlastProtein: 2.1.2
    ChimeraX-BondRot: 2.0.1
    ChimeraX-BugReporter: 1.0.1
    ChimeraX-BuildStructure: 2.8
    ChimeraX-Bumps: 1.0
    ChimeraX-BundleBuilder: 1.2.2
    ChimeraX-ButtonPanel: 1.0.1
    ChimeraX-CageBuilder: 1.0.1
    ChimeraX-CellPack: 1.0
    ChimeraX-Centroids: 1.3.2
    ChimeraX-ChangeChains: 1.0.2
    ChimeraX-CheckWaters: 1.3.1
    ChimeraX-ChemGroup: 2.0.1
    ChimeraX-Clashes: 2.2.4
    ChimeraX-ColorActions: 1.0.3
    ChimeraX-ColorGlobe: 1.0
    ChimeraX-ColorKey: 1.5.3
    ChimeraX-CommandLine: 1.2.5
    ChimeraX-ConnectStructure: 2.0.1
    ChimeraX-Contacts: 1.0.1
    ChimeraX-Core: 1.6.1
    ChimeraX-CoreFormats: 1.1
    ChimeraX-coulombic: 1.4.2
    ChimeraX-Crosslinks: 1.0
    ChimeraX-Crystal: 1.0
    ChimeraX-CrystalContacts: 1.0.1
    ChimeraX-DataFormats: 1.2.3
    ChimeraX-Dicom: 1.2
    ChimeraX-DistMonitor: 1.4
    ChimeraX-DockPrep: 1.1.1
    ChimeraX-Dssp: 2.0
    ChimeraX-EMDB-SFF: 1.0
    ChimeraX-ESMFold: 1.0
    ChimeraX-FileHistory: 1.0.1
    ChimeraX-FunctionKey: 1.0.1
    ChimeraX-Geometry: 1.3
    ChimeraX-gltf: 1.0
    ChimeraX-Graphics: 1.1.1
    ChimeraX-Hbonds: 2.4
    ChimeraX-Help: 1.2.1
    ChimeraX-HKCage: 1.3
    ChimeraX-IHM: 1.1
    ChimeraX-ImageFormats: 1.2
    ChimeraX-IMOD: 1.0
    ChimeraX-IO: 1.0.1
    ChimeraX-ItemsInspection: 1.0.1
    ChimeraX-Label: 1.1.7
    ChimeraX-ListInfo: 1.1.1
    ChimeraX-Log: 1.1.5
    ChimeraX-LookingGlass: 1.1
    ChimeraX-Maestro: 1.8.2
    ChimeraX-Map: 1.1.4
    ChimeraX-MapData: 2.0
    ChimeraX-MapEraser: 1.0.1
    ChimeraX-MapFilter: 2.0.1
    ChimeraX-MapFit: 2.0
    ChimeraX-MapSeries: 2.1.1
    ChimeraX-Markers: 1.0.1
    ChimeraX-Mask: 1.0.2
    ChimeraX-MatchMaker: 2.0.12
    ChimeraX-MDcrds: 2.6
    ChimeraX-MedicalToolbar: 1.0.2
    ChimeraX-Meeting: 1.0.1
    ChimeraX-MLP: 1.1.1
    ChimeraX-mmCIF: 2.12
    ChimeraX-MMTF: 2.2
    ChimeraX-Modeller: 1.5.9
    ChimeraX-ModelPanel: 1.3.7
    ChimeraX-ModelSeries: 1.0.1
    ChimeraX-Mol2: 2.0
    ChimeraX-Mole: 1.0
    ChimeraX-Morph: 1.0.2
    ChimeraX-MouseModes: 1.2
    ChimeraX-Movie: 1.0
    ChimeraX-Neuron: 1.0
    ChimeraX-Nifti: 1.0
    ChimeraX-NRRD: 1.0
    ChimeraX-Nucleotides: 2.0.3
    ChimeraX-OpenCommand: 1.10.1
    ChimeraX-PDB: 2.7.2
    ChimeraX-PDBBio: 1.0
    ChimeraX-PDBLibrary: 1.0.2
    ChimeraX-PDBMatrices: 1.0
    ChimeraX-PickBlobs: 1.0.1
    ChimeraX-Positions: 1.0
    ChimeraX-PresetMgr: 1.1
    ChimeraX-PubChem: 2.1
    ChimeraX-ReadPbonds: 1.0.1
    ChimeraX-Registration: 1.1.1
    ChimeraX-RemoteControl: 1.0
    ChimeraX-RenderByAttr: 1.1
    ChimeraX-RenumberResidues: 1.1
    ChimeraX-ResidueFit: 1.0.1
    ChimeraX-RestServer: 1.1
    ChimeraX-RNALayout: 1.0
    ChimeraX-RotamerLibMgr: 3.0
    ChimeraX-RotamerLibsDunbrack: 2.0
    ChimeraX-RotamerLibsDynameomics: 2.0
    ChimeraX-RotamerLibsRichardson: 2.0
    ChimeraX-SaveCommand: 1.5.1
    ChimeraX-SchemeMgr: 1.0
    ChimeraX-SDF: 2.0.1
    ChimeraX-Segger: 1.0
    ChimeraX-Segment: 1.0.1
    ChimeraX-SelInspector: 1.0
    ChimeraX-SeqView: 2.8.3
    ChimeraX-Shape: 1.0.1
    ChimeraX-Shell: 1.0.1
    ChimeraX-Shortcuts: 1.1.1
    ChimeraX-ShowSequences: 1.0.1
    ChimeraX-SideView: 1.0.1
    ChimeraX-Smiles: 2.1
    ChimeraX-SmoothLines: 1.0
    ChimeraX-SpaceNavigator: 1.0
    ChimeraX-StdCommands: 1.10.3
    ChimeraX-STL: 1.0.1
    ChimeraX-Storm: 1.0
    ChimeraX-StructMeasure: 1.1.2
    ChimeraX-Struts: 1.0.1
    ChimeraX-Surface: 1.0.1
    ChimeraX-SwapAA: 2.0.1
    ChimeraX-SwapRes: 2.2.1
    ChimeraX-TapeMeasure: 1.0
    ChimeraX-Test: 1.0
    ChimeraX-Toolbar: 1.1.2
    ChimeraX-ToolshedUtils: 1.2.1
    ChimeraX-Topography: 1.0
    ChimeraX-Tug: 1.0.1
    ChimeraX-UI: 1.28.4
    ChimeraX-uniprot: 2.2.2
    ChimeraX-UnitCell: 1.0.1
    ChimeraX-ViewDockX: 1.2
    ChimeraX-VIPERdb: 1.0
    ChimeraX-Vive: 1.1
    ChimeraX-VolumeMenu: 1.0.1
    ChimeraX-VTK: 1.0
    ChimeraX-WavefrontOBJ: 1.0
    ChimeraX-WebCam: 1.0.2
    ChimeraX-WebServices: 1.1.1
    ChimeraX-Zone: 1.0.1
    colorama: 0.4.6
    comm: 0.1.3
    contourpy: 1.0.7
    cxservices: 1.2.2
    cycler: 0.11.0
    Cython: 0.29.33
    debugpy: 1.6.7
    decorator: 5.1.1
    docutils: 0.19
    executing: 1.2.0
    filelock: 3.9.0
    fonttools: 4.39.3
    funcparserlib: 1.0.1
    grako: 3.16.5
    h5py: 3.8.0
    html2text: 2020.1.16
    idna: 3.4
    ihm: 0.35
    imagecodecs: 2022.2.22
    imagesize: 1.4.1
    importlib-metadata: 6.6.0
    ipykernel: 6.21.1
    ipython: 8.10.0
    ipython-genutils: 0.2.0
    ipywidgets: 8.0.6
    jedi: 0.18.2
    Jinja2: 3.1.2
    jupyter-client: 8.0.2
    jupyter-core: 5.3.0
    jupyterlab-widgets: 3.0.7
    kiwisolver: 1.4.4
    line-profiler: 4.0.2
    lxml: 4.9.2
    lz4: 4.3.2
    MarkupSafe: 2.1.2
    matplotlib: 3.6.3
    matplotlib-inline: 0.1.6
    msgpack: 1.0.4
    nest-asyncio: 1.5.6
    netCDF4: 1.6.2
    networkx: 2.8.8
    nibabel: 5.0.1
    nptyping: 2.5.0
    numexpr: 2.8.4
    numpy: 1.23.5
    openvr: 1.23.701
    packaging: 21.3
    ParmEd: 3.4.3
    parso: 0.8.3
    pep517: 0.13.0
    pexpect: 4.8.0
    pickleshare: 0.7.5
    Pillow: 9.3.0
    pip: 23.0
    pkginfo: 1.9.6
    platformdirs: 3.5.0
    prompt-toolkit: 3.0.38
    psutil: 5.9.4
    ptyprocess: 0.7.0
    pure-eval: 0.2.2
    pycollada: 0.7.2
    pydicom: 2.3.0
    Pygments: 2.14.0
    pynrrd: 1.0.0
    PyOpenGL: 3.1.5
    PyOpenGL-accelerate: 3.1.5
    pyparsing: 3.0.9
    pyproject-hooks: 1.0.0
    PyQt6-commercial: 6.4.2
    PyQt6-Qt6: 6.4.3
    PyQt6-sip: 13.4.1
    PyQt6-WebEngine-commercial: 6.4.0
    PyQt6-WebEngine-Qt6: 6.4.3
    python-dateutil: 2.8.2
    pytz: 2023.3
    pyzmq: 25.0.2
    qtconsole: 5.4.0
    QtPy: 2.3.1
    RandomWords: 0.4.0
    requests: 2.28.2
    scipy: 1.9.3
    setuptools: 67.4.0
    setuptools-scm: 7.0.5
    sfftk-rw: 0.7.3
    six: 1.16.0
    snowballstemmer: 2.2.0
    sortedcontainers: 2.4.0
    soupsieve: 2.4.1
    sphinx: 6.1.3
    sphinx-autodoc-typehints: 1.22
    sphinxcontrib-applehelp: 1.0.4
    sphinxcontrib-blockdiag: 3.0.0
    sphinxcontrib-devhelp: 1.0.2
    sphinxcontrib-htmlhelp: 2.0.1
    sphinxcontrib-jsmath: 1.0.1
    sphinxcontrib-qthelp: 1.0.3
    sphinxcontrib-serializinghtml: 1.1.5
    stack-data: 0.6.2
    tables: 3.7.0
    tcia-utils: 1.2.0
    tifffile: 2022.10.10
    tinyarray: 1.2.4
    tomli: 2.0.1
    tornado: 6.3.1
    traitlets: 5.9.0
    typing-extensions: 4.5.0
    tzdata: 2023.3
    urllib3: 1.26.15
    wcwidth: 0.2.6
    webcolors: 1.12
    wheel: 0.38.4
    wheel-filename: 1.4.1
    widgetsnbextension: 4.0.7
    zipp: 3.15.0

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