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Opened 31 hours ago
Last modified 15 hours ago
#20866 assigned defect
QScore: 'scores' is None
| Reported by: | Owned by: | Tristan Croll | |
|---|---|---|---|
| Priority: | normal | Milestone: | |
| Component: | Third Party | Version: | |
| Keywords: | Cc: | ||
| Blocked By: | Blocking: | ||
| Notify when closed: | Platform: | all | |
| Project: | ChimeraX |
Description
The following bug report has been submitted:
Platform: Linux-6.8.0-136-generic-x86_64-with-glibc2.35
ChimeraX Version: 1.12 (2026-06-12 03:42:34 UTC)
Description
Replace this text with list of actions that caused this problem to occur
Log:
Startup Messages
---
warning | GBM is not supported with the current configuration. Fallback to Vulkan rendering in Chromium.
UCSF ChimeraX version: 1.12 (2026-06-12)
© 2016-2026 Regents of the University of California. All rights reserved.
How to cite UCSF ChimeraX
> open "/mnt/16TB-HDD-3Apr2024/dynein d tail 4sets/CS-dynein-d-
> tail2/J1588/J1588_007_volume_map_sharp.mrc" format mrc
Opened J1588_007_volume_map_sharp.mrc as #1, grid size 260,260,260, pixel
0.873, shown at level 0.122, step 2, values float32
> close #1
> open "/home/em301/Documents/dynein d/dynein-
> d_APO_MD/J1588_007_volume_map_sharp_flip.mrc" format mrc
Opened J1588_007_volume_map_sharp_flip.mrc as #1, grid size 260,260,260, pixel
0.873, shown at level 0.121, step 2, values float32
> open "/home/em301/Documents/dynein d/最終モデル/APO-MD/前嶋さん作成の最終モデル/IDAd-
> APO_Merged_StalkStrut-coot-5.pdb"
Summary of feedback from opening /home/em301/Documents/dynein d/最終モデル/APO-
MD/前嶋さん作成の最終モデル/IDAd-APO_Merged_StalkStrut-coot-5.pdb
---
warning | PDB SEQRES record for chain C is incomplete. Ignoring input sequence records as basis for sequence.
Chain information for IDAd-APO_Merged_StalkStrut-coot-5.pdb #2
---
Chain | Description
C | No description available
> ui tool show "Fit in Map"
> fitmap #2 inMap #1
Fit molecule IDAd-APO_Merged_StalkStrut-coot-5.pdb (#2) to map
J1588_007_volume_map_sharp_flip.mrc (#1) using 25685 atoms
average map value = 0.177, steps = 64
shifted from previous position = 0.317
rotated from previous position = 0.428 degrees
atoms outside contour = 13185, contour level = 0.12127
Position of IDAd-APO_Merged_StalkStrut-coot-5.pdb (#2) relative to
J1588_007_volume_map_sharp_flip.mrc (#1) coordinates:
Matrix rotation and translation
0.99997508 0.00239219 -0.00664276 0.29727852
-0.00237602 0.99999420 0.00244105 -0.20059121
0.00664856 -0.00242520 0.99997496 -0.47097858
Axis -0.32581302 -0.88990210 -0.31924931
Axis point 59.90920236 0.00000000 55.90700962
Rotation angle (degrees) 0.42788056
Shift along axis 0.23200891
> ui tool show "Model-map Q-Score"
> transparency #1 60
> style #2 stick
Changed 25685 atom styles
> color #2 byhetero
> qscore #2 toVolume #1 useGui false pointsPerShell 8 shellRadiusStep 0.100
> maxShellRadius 2.00 referenceGaussianSigma 0.60 logDetails true assignAttr
> false
WARNING: the following residues in #2 have atoms outside the bounds of volume
#1 and will be excluded from the Q-score calculation:
/C:2766-2972
Chain Number Name Qavg Qworst Qbb Qsc
-------------------------------------------------------
C 932 ALA 0.520 -0.105 0.676 -0.105
C 933 SER 0.149 -0.233 0.178 0.092
C 934 ASN 0.188 -0.578 0.137 0.239
C 935 TRP 0.102 -0.688 0.184 0.069
C 936 ARG 0.353 -0.223 0.289 0.389
C 937 SER 0.004 -0.662 -0.122 0.256
C 938 LEU 0.430 -0.081 0.390 0.471
C 939 HIS 0.530 0.150 0.600 0.482
C 940 LYS -0.104 -0.797 -0.341 0.085
C 941 SER -0.255 -0.467 -0.200 -0.364
C 942 TRP 0.448 -0.684 -0.148 0.687
C 943 MET 0.288 -0.233 0.245 0.330
C 944 HIS 0.378 -0.435 0.098 0.565
C 945 ASP -0.304 -0.651 -0.389 -0.219
C 946 SER 0.129 -0.215 0.040 0.306
C 947 TRP 0.241 -0.697 0.433 0.164
C 948 GLU 0.563 0.089 0.541 0.581
C 949 LYS -0.176 -0.591 0.033 -0.344
C 950 LEU 0.435 -0.106 0.492 0.377
C 951 HIS -0.129 -0.636 0.129 -0.302
C 952 GLY -0.088 -0.715 -0.088 N/A
C 953 GLU -0.035 -0.672 -0.074 -0.003
C 954 THR 0.426 -0.192 0.487 0.346
C 955 VAL 0.186 -0.053 0.242 0.111
C 956 GLU 0.320 -0.146 0.321 0.320
C 957 ARG 0.247 -0.291 0.323 0.203
C 958 GLU 0.135 -0.510 0.027 0.223
C 959 VAL 0.101 -0.766 -0.119 0.393
C 960 THR 0.035 -0.578 0.320 -0.346
C 961 ASN 0.308 -0.137 0.495 0.121
C 962 ALA 0.208 -0.073 0.224 0.146
C 963 TYR 0.472 -0.187 0.571 0.422
C 964 LYS 0.390 -0.236 0.410 0.375
C 965 VAL 0.005 -0.421 -0.134 0.191
C 966 LEU -0.049 -0.718 -0.265 0.166
C 967 PHE 0.398 -0.237 0.209 0.506
C 968 LYS 0.246 -0.826 0.322 0.186
C 969 THR 0.077 -0.524 -0.094 0.304
C 970 ALA 0.067 -0.223 0.030 0.214
C 971 LYS 0.133 -0.460 -0.085 0.308
C 972 VAL 0.225 -0.500 0.027 0.490
C 973 PHE 0.184 -0.554 0.173 0.190
C 974 GLY -0.071 -0.599 -0.071 N/A
C 975 GLN 0.025 -0.728 0.147 -0.072
C 976 ARG -0.027 -0.516 0.000 -0.043
C 977 GLY -0.061 -0.385 -0.061 N/A
C 978 GLY 0.039 -0.293 0.039 N/A
C 979 LEU 0.055 -0.635 0.099 0.010
C 980 ASP 0.118 -0.305 0.239 -0.004
C 981 LYS 0.159 -0.503 0.030 0.263
C 982 CYS 0.299 -0.228 0.060 0.776
C 983 ALA -0.121 -0.336 -0.237 0.341
C 984 GLU 0.061 -0.807 0.235 -0.078
C 985 ASN 0.206 -0.507 -0.132 0.545
C 986 CYS 0.083 -0.788 -0.005 0.259
C 987 GLU 0.029 -0.449 0.016 0.038
C 988 LEU 0.049 -0.737 0.154 -0.056
C 989 ILE -0.143 -0.886 -0.004 -0.282
C 990 ARG 0.151 -0.552 0.167 0.143
C 991 GLU -0.094 -0.625 0.277 -0.391
C 992 GLU 0.218 -0.249 0.267 0.178
C 993 VAL 0.189 -0.471 -0.103 0.577
C 994 GLU 0.235 -0.600 -0.030 0.448
C 995 ALA 0.069 -0.575 -0.023 0.436
C 996 PHE 0.146 -0.926 0.134 0.153
C 997 LYS -0.025 -0.589 -0.238 0.144
C 998 LYS 0.163 -0.525 0.410 -0.036
C 999 PHE 0.006 -0.514 -0.345 0.207
C 1000 VAL -0.118 -0.616 -0.095 -0.149
C 1001 PRO 0.337 -0.253 0.181 0.545
C 1002 LEU 0.148 -0.428 0.265 0.031
C 1003 VAL -0.151 -0.708 -0.283 0.024
C 1004 GLN 0.129 -0.353 0.064 0.182
C 1005 ALA 0.502 0.080 0.460 0.673
C 1006 LEU 0.265 -0.037 0.215 0.315
C 1007 ARG -0.209 -0.706 0.070 -0.369
C 1008 ASN 0.220 -0.474 -0.149 0.588
C 1009 PRO 0.442 0.040 0.388 0.514
C 1010 GLY 0.560 0.388 0.560 N/A
C 1011 MET 0.077 -0.617 -0.103 0.257
C 1012 ARG 0.213 -0.572 0.502 0.048
C 1013 ASP 0.440 0.192 0.439 0.441
C 1014 ARG 0.368 -0.150 0.305 0.404
C 1015 HIS 0.443 -0.118 0.346 0.508
C 1016 TRP 0.458 -0.312 0.156 0.578
C 1017 ASP 0.232 -0.197 0.263 0.200
C 1018 GLN 0.222 -0.582 0.113 0.308
C 1019 LEU 0.090 -0.302 0.070 0.109
C 1020 SER 0.156 -0.198 0.189 0.089
C 1021 ALA 0.414 -0.069 0.434 0.334
C 1022 LEU 0.461 -0.127 0.629 0.293
C 1023 LEU 0.102 -0.589 0.297 -0.093
C 1024 GLY 0.056 -0.552 0.056 N/A
C 1025 PHE 0.132 -0.800 -0.318 0.389
C 1026 LYS 0.534 0.418 0.561 0.512
C 1027 LEU 0.340 -0.039 0.480 0.201
C 1028 HIS -0.019 -0.486 0.125 -0.114
C 1029 PRO 0.426 0.144 0.349 0.528
C 1030 ASP 0.361 0.110 0.362 0.360
C 1031 LYS 0.394 -0.109 0.189 0.558
C 1032 THR 0.181 -0.383 0.153 0.218
C 1033 PHE 0.308 -0.233 0.114 0.419
C 1034 THR 0.272 -0.160 0.429 0.063
C 1035 MET 0.001 -0.646 0.190 -0.188
C 1036 ALA -0.279 -0.847 -0.284 -0.259
C 1037 ALA 0.308 -0.274 0.187 0.795
C 1038 ALA -0.109 -0.483 -0.015 -0.483
C 1039 GLU 0.089 -0.163 0.146 0.044
C 1040 GLN 0.157 -0.607 0.391 -0.030
C 1041 MET 0.293 -0.332 0.701 -0.115
C 1042 GLY 0.287 0.076 0.287 N/A
C 1043 LEU 0.047 -0.638 0.011 0.082
C 1044 LEU 0.066 -0.589 0.335 -0.204
C 1045 GLN 0.215 -0.605 0.120 0.291
C 1046 HIS -0.124 -0.663 -0.262 -0.033
C 1047 LEU 0.088 -0.344 0.234 -0.058
C 1048 GLN -0.024 -0.600 0.005 -0.046
C 1049 ALA 0.077 -0.328 -0.016 0.449
C 1050 ILE 0.106 -0.584 0.082 0.130
C 1051 THR -0.278 -0.546 -0.305 -0.242
C 1052 LYS 0.313 -0.062 0.327 0.301
C 1053 VAL 0.176 -0.429 0.423 -0.152
C 1054 ALA 0.224 -0.208 0.230 0.200
C 1055 ASP 0.378 0.210 0.375 0.381
C 1056 VAL 0.097 -0.293 0.253 -0.111
C 1057 ALA 0.107 -0.356 0.194 -0.239
C 1058 GLY 0.559 0.380 0.559 N/A
C 1059 LYS 0.416 0.007 0.379 0.445
C 1060 GLU 0.306 -0.177 0.475 0.170
C 1061 TYR 0.077 -0.428 0.109 0.062
C 1062 SER 0.555 0.287 0.484 0.698
C 1063 ILE 0.646 0.447 0.591 0.700
C 1064 GLU 0.327 -0.445 0.712 0.020
C 1065 GLN -0.010 -0.510 0.190 -0.170
C 1066 ALA 0.315 -0.656 0.231 0.652
C 1067 LEU 0.493 0.303 0.537 0.449
C 1068 ASP 0.254 -0.307 0.417 0.092
C 1069 LYS 0.571 0.059 0.409 0.701
C 1070 MET 0.522 -0.148 0.378 0.665
C 1071 GLN 0.473 0.228 0.492 0.458
C 1072 ARG 0.080 -0.353 0.135 0.049
C 1073 GLU 0.649 0.408 0.654 0.645
C 1074 TRP 0.424 0.120 0.476 0.402
C 1075 GLU 0.240 -0.078 0.326 0.171
C 1076 SER 0.502 0.345 0.541 0.424
C 1077 ALA 0.422 -0.114 0.373 0.615
C 1078 GLU 0.337 -0.084 0.351 0.326
C 1079 MET 0.495 -0.216 0.326 0.664
C 1080 GLN 0.447 -0.092 0.666 0.272
C 1081 VAL 0.568 0.403 0.641 0.470
C 1082 LEU 0.580 -0.115 0.465 0.695
C 1083 ASP 0.459 0.154 0.493 0.426
C 1084 TYR 0.374 -0.346 0.087 0.518
C 1085 ARG 0.447 0.144 0.403 0.472
C 1086 GLU 0.201 -0.678 0.604 -0.121
C 1087 THR 0.498 -0.213 0.749 0.162
C 1088 LYS 0.377 -0.262 0.675 0.139
C 1089 THR 0.574 0.171 0.656 0.464
C 1090 PHE 0.447 0.159 0.321 0.518
C 1091 VAL 0.370 -0.379 0.246 0.537
C 1092 ILE 0.576 0.297 0.633 0.518
C 1093 LYS 0.481 0.062 0.589 0.395
C 1094 VAL 0.573 0.327 0.663 0.453
C 1095 GLU 0.559 -0.065 0.738 0.416
C 1096 GLU 0.381 -0.312 0.469 0.312
C 1097 GLN 0.379 -0.445 0.656 0.156
C 1098 ILE 0.622 0.172 0.605 0.638
C 1099 SER 0.515 -0.124 0.632 0.280
C 1100 GLN 0.545 0.094 0.557 0.537
C 1101 MET 0.642 0.389 0.688 0.596
C 1102 LEU 0.484 0.172 0.438 0.531
C 1103 ASP 0.515 0.168 0.568 0.461
C 1104 ASP 0.475 -0.049 0.542 0.407
C 1105 HIS 0.718 0.266 0.610 0.791
C 1106 ILE 0.676 0.364 0.742 0.611
C 1107 ALA 0.720 0.407 0.689 0.843
C 1108 MET 0.642 0.351 0.691 0.593
C 1109 THR 0.499 0.146 0.458 0.554
C 1110 GLN 0.583 0.344 0.635 0.541
C 1111 SER 0.604 0.387 0.625 0.562
C 1112 MET 0.637 0.296 0.612 0.661
C 1113 ALA 0.579 0.416 0.577 0.589
C 1114 PHE 0.328 -0.346 0.348 0.316
C 1115 SER 0.250 -0.140 0.155 0.440
C 1116 PRO 0.516 0.433 0.467 0.581
C 1117 TYR 0.650 0.333 0.676 0.638
C 1118 LYS 0.614 0.452 0.622 0.608
C 1119 LYS 0.392 -0.204 0.559 0.259
C 1120 PRO 0.540 0.126 0.470 0.633
C 1121 PHE 0.384 -0.221 0.210 0.483
C 1122 GLU 0.433 -0.464 0.325 0.518
C 1123 GLU 0.362 -0.202 0.589 0.180
C 1124 ARG 0.085 -0.288 -0.009 0.138
C 1125 ILE 0.472 0.067 0.554 0.389
C 1126 ALA 0.404 -0.087 0.439 0.266
C 1127 LYS 0.305 -0.534 0.370 0.253
C 1128 TRP 0.669 0.258 0.507 0.734
C 1129 GLU 0.139 -0.801 0.314 -0.002
C 1130 GLN 0.593 0.211 0.783 0.441
C 1131 GLN 0.485 -0.040 0.691 0.320
C 1132 LEU 0.569 0.386 0.511 0.627
C 1133 SER 0.373 -0.471 0.317 0.484
C 1134 LEU 0.507 -0.036 0.409 0.606
C 1135 VAL 0.512 0.262 0.543 0.470
C 1136 SER 0.703 0.469 0.667 0.773
C 1137 GLU 0.213 -0.596 0.197 0.226
C 1138 ILE 0.521 0.058 0.443 0.599
C 1139 LEU 0.221 -0.402 -0.068 0.510
C 1140 ASP 0.388 0.158 0.494 0.283
C 1141 GLN 0.472 -0.234 0.369 0.554
C 1142 TRP 0.535 0.220 0.568 0.522
C 1143 ILE 0.530 0.254 0.583 0.476
C 1144 GLN 0.550 -0.356 0.337 0.721
C 1145 LEU 0.652 0.245 0.637 0.667
C 1146 GLN 0.464 -0.230 0.520 0.419
C 1147 ARG 0.469 -0.270 0.702 0.336
C 1148 GLN 0.561 -0.345 0.399 0.690
C 1149 TRP 0.691 0.347 0.569 0.739
C 1150 MET 0.462 -0.025 0.421 0.503
C 1151 TYR 0.478 -0.322 0.322 0.555
C 1152 LEU 0.465 -0.093 0.599 0.331
C 1153 GLU 0.489 0.055 0.544 0.446
C 1154 PRO 0.544 0.239 0.561 0.520
C 1155 ILE 0.639 0.431 0.629 0.649
C 1156 PHE 0.714 0.485 0.747 0.696
C 1157 GLY 0.446 -0.060 0.446 N/A
C 1158 SER 0.667 0.506 0.671 0.658
C 1159 GLU 0.295 -0.185 0.339 0.260
C 1160 ASP 0.441 -0.276 0.370 0.512
C 1161 ILE 0.636 0.295 0.710 0.563
C 1162 MET 0.564 0.330 0.606 0.523
C 1163 GLN 0.583 0.397 0.576 0.589
C 1164 GLN 0.620 0.033 0.698 0.558
C 1165 LEU 0.662 0.524 0.652 0.671
C 1166 PRO 0.479 0.132 0.430 0.544
C 1167 LEU 0.436 -0.097 0.471 0.401
C 1168 GLU 0.653 0.278 0.747 0.578
C 1169 GLY 0.602 0.549 0.602 N/A
C 1170 LYS 0.191 -0.230 0.369 0.048
C 1171 ARG 0.310 -0.259 0.378 0.271
C 1172 PHE 0.689 0.427 0.626 0.725
C 1173 ALA 0.261 -0.595 0.184 0.568
C 1174 THR 0.299 -0.228 0.262 0.348
C 1175 VAL 0.538 0.141 0.456 0.648
C 1176 ASP 0.327 0.153 0.281 0.374
C 1177 ARG 0.371 -0.153 0.491 0.302
C 1178 MET 0.504 0.138 0.475 0.533
C 1179 TRP 0.512 -0.358 0.638 0.461
C 1180 ARG 0.193 -0.398 0.511 0.011
C 1181 LYS 0.248 -0.346 0.528 0.023
C 1182 THR 0.603 0.247 0.613 0.590
C 1183 THR 0.604 0.235 0.691 0.489
C 1184 ASP 0.429 -0.383 0.180 0.677
C 1185 ALA 0.402 0.074 0.383 0.478
C 1186 ALA 0.609 0.469 0.643 0.469
C 1187 LYS 0.218 -0.262 -0.055 0.437
C 1188 ARG 0.225 -0.428 0.463 0.089
C 1189 ASN 0.389 -0.348 0.713 0.064
C 1190 PRO 0.518 0.246 0.595 0.416
C 1191 LEU 0.503 0.227 0.532 0.474
C 1192 LEU 0.451 -0.112 0.399 0.503
C 1193 LEU 0.482 0.043 0.645 0.318
C 1194 LYS 0.466 0.029 0.591 0.366
C 1195 VAL 0.371 -0.056 0.414 0.313
C 1196 CYS 0.618 0.475 0.667 0.520
C 1197 SER 0.460 0.030 0.492 0.397
C 1198 SER 0.446 0.154 0.448 0.441
C 1199 GLN 0.328 -0.175 0.250 0.391
C 1200 LYS 0.411 -0.009 0.527 0.318
C 1201 LEU 0.417 0.066 0.524 0.309
C 1202 LEU 0.551 0.174 0.482 0.619
C 1203 ASP 0.046 -0.715 0.260 -0.169
C 1204 SER 0.576 0.395 0.568 0.591
C 1205 PHE 0.546 -0.148 0.287 0.694
C 1206 ILE 0.359 0.155 0.494 0.224
C 1207 GLU 0.372 -0.349 0.407 0.344
C 1208 ALA 0.672 0.435 0.663 0.705
C 1209 ASN 0.582 0.447 0.541 0.624
C 1210 LYS 0.464 0.301 0.445 0.479
C 1211 LEU 0.506 0.147 0.578 0.435
C 1212 LEU 0.486 0.171 0.483 0.489
C 1213 GLU 0.548 0.316 0.663 0.456
C 1214 SER 0.351 -0.156 0.260 0.534
C 1215 VAL 0.548 0.038 0.670 0.385
C 1216 GLN 0.652 0.097 0.547 0.736
C 1217 LYS 0.440 -0.102 0.473 0.414
C 1218 GLY 0.565 0.282 0.565 N/A
C 1219 LEU 0.403 0.051 0.441 0.364
C 1220 ALA 0.415 0.276 0.396 0.493
C 1221 ASP 0.525 0.229 0.471 0.578
C 1222 TYR 0.601 0.093 0.618 0.592
C 1223 LEU 0.475 -0.075 0.394 0.557
C 1224 GLU 0.363 -0.275 0.402 0.332
C 1225 THR 0.588 0.017 0.673 0.474
C 1226 LYS 0.648 0.329 0.624 0.667
C 1227 ARG 0.637 0.292 0.678 0.613
C 1228 LEU 0.633 0.525 0.641 0.624
C 1229 ALA 0.579 0.482 0.603 0.482
C 1230 PHE 0.438 0.112 0.580 0.357
C 1231 ALA 0.543 0.127 0.647 0.127
C 1232 ARG 0.499 0.269 0.377 0.568
C 1233 ALA -0.338 -0.788 -0.306 -0.467
C 1234 PHE 0.514 0.214 0.691 0.413
C 1235 PHE 0.551 0.260 0.618 0.513
C 1236 LEU 0.524 -0.037 0.458 0.591
C 1237 SER 0.579 0.413 0.565 0.605
C 1238 ASN 0.481 -0.055 0.386 0.576
C 1239 ASP 0.326 -0.365 0.660 -0.009
C 1240 GLU 0.508 0.101 0.444 0.560
C 1241 LEU 0.586 0.161 0.679 0.492
C 1242 LEU 0.269 -0.272 0.227 0.310
C 1243 GLN 0.581 0.352 0.452 0.684
C 1244 ILE 0.612 0.123 0.780 0.443
C 1245 LEU 0.606 0.413 0.647 0.565
C 1246 SER 0.557 0.236 0.680 0.311
C 1247 GLN 0.557 -0.151 0.497 0.606
C 1248 THR 0.512 -0.355 0.690 0.273
C 1249 LYS 0.397 -0.508 0.628 0.212
C 1250 ASN 0.594 0.153 0.707 0.480
C 1251 PRO 0.692 0.520 0.676 0.715
C 1252 LEU 0.376 0.115 0.341 0.410
C 1253 ALA 0.642 0.436 0.653 0.599
C 1254 VAL 0.573 0.406 0.505 0.663
C 1255 GLN 0.372 -0.283 0.613 0.179
C 1256 PRO 0.614 0.557 0.632 0.591
C 1257 HIS 0.642 0.148 0.500 0.736
C 1258 LEU 0.541 0.033 0.677 0.405
C 1259 ARG 0.663 0.272 0.717 0.632
C 1260 LYS 0.504 0.051 0.744 0.313
C 1261 CYS 0.572 0.292 0.651 0.414
C 1262 PHE 0.618 0.325 0.629 0.612
C 1263 GLU 0.500 0.222 0.506 0.494
C 1264 ALA 0.537 0.273 0.603 0.273
C 1265 ILE 0.494 -0.007 0.621 0.366
C 1266 GLU 0.606 0.245 0.676 0.550
C 1267 SER 0.607 0.413 0.691 0.439
C 1268 LEU 0.425 -0.109 0.394 0.456
C 1269 ASP 0.622 0.297 0.691 0.554
C 1270 PHE 0.631 0.470 0.578 0.661
C 1271 ALA 0.718 0.616 0.743 0.616
C 1272 PRO 0.411 -0.245 0.582 0.182
C 1273 ASN 0.435 -0.432 0.510 0.360
C 1274 GLY 0.677 0.336 0.677 N/A
C 1275 GLU 0.508 -0.243 0.434 0.567
C 1276 ILE 0.608 0.364 0.595 0.622
C 1277 GLY 0.532 -0.010 0.532 N/A
C 1278 ALA 0.742 0.653 0.764 0.653
C 1279 MET 0.630 0.294 0.718 0.542
C 1280 ASN 0.605 0.041 0.510 0.701
C 1281 SER 0.626 0.330 0.649 0.580
C 1282 ARG 0.323 -0.565 0.517 0.212
C 1283 GLU 0.409 -0.622 0.714 0.165
C 1284 LYS 0.544 0.065 0.611 0.491
C 1285 GLU 0.613 0.174 0.598 0.625
C 1286 LYS 0.608 0.254 0.661 0.565
C 1287 VAL 0.471 0.057 0.486 0.451
C 1288 PRO 0.646 0.001 0.544 0.784
C 1289 PHE 0.640 0.030 0.499 0.721
C 1290 ASP 0.617 0.154 0.490 0.743
C 1291 LYS 0.601 0.198 0.517 0.669
C 1292 PRO 0.554 0.213 0.712 0.343
C 1293 MET 0.569 0.316 0.646 0.491
C 1294 MET 0.574 0.279 0.668 0.481
C 1295 PRO 0.637 0.504 0.700 0.552
C 1296 GLN 0.403 -0.349 0.262 0.516
C 1297 GLY 0.360 -0.105 0.360 N/A
C 1298 ASN 0.192 -0.627 -0.011 0.396
C 1299 VAL 0.147 -0.306 0.409 -0.203
C 1300 GLU -0.141 -0.699 0.270 -0.470
C 1301 ILE 0.396 -0.106 0.143 0.648
C 1302 TRP 0.566 0.113 0.424 0.623
C 1303 LEU 0.534 0.296 0.619 0.448
C 1304 GLY 0.587 0.386 0.587 N/A
C 1305 GLU 0.586 0.386 0.521 0.638
C 1306 VAL 0.554 0.240 0.604 0.488
C 1307 GLU 0.422 -0.063 0.677 0.219
C 1308 ARG 0.325 -0.284 0.477 0.238
C 1309 ARG 0.666 0.400 0.726 0.632
C 1310 MET 0.451 -0.540 0.637 0.265
C 1311 ARG 0.486 -0.252 0.570 0.438
C 1312 PHE 0.418 -0.003 0.567 0.333
C 1313 SER 0.287 -0.081 0.110 0.640
C 1314 VAL 0.266 0.041 0.245 0.293
C 1315 ARG 0.312 -0.220 0.584 0.157
C 1316 HIS 0.599 0.177 0.617 0.587
C 1317 GLN 0.180 -0.514 0.174 0.186
C 1318 VAL 0.370 -0.345 0.618 0.041
C 1319 VAL 0.364 -0.512 0.375 0.350
C 1320 LEU 0.590 0.085 0.647 0.532
C 1321 ALA 0.545 0.208 0.526 0.622
C 1322 VAL 0.493 0.140 0.473 0.519
C 1323 ALA 0.203 -0.638 0.147 0.427
C 1324 ALA 0.530 0.225 0.503 0.638
C 1325 TYR 0.511 -0.323 0.248 0.643
C 1326 ALA 0.495 -0.047 0.476 0.571
C 1327 THR 0.561 0.438 0.574 0.544
C 1328 THR 0.382 0.039 0.383 0.380
C 1329 PRO 0.687 0.571 0.687 0.687
C 1330 ARG 0.026 -0.805 0.465 -0.225
C 1331 LYS 0.622 0.299 0.634 0.613
C 1332 GLN 0.661 0.460 0.692 0.635
C 1333 TRP 0.576 -0.036 0.386 0.652
C 1334 VAL 0.611 0.364 0.689 0.507
C 1335 ARG 0.690 0.574 0.694 0.688
C 1336 ASP 0.554 0.080 0.743 0.365
C 1337 TRP 0.725 0.437 0.728 0.723
C 1338 PRO 0.725 0.459 0.684 0.779
C 1339 ALA 0.606 0.331 0.591 0.666
C 1340 MET 0.585 0.228 0.533 0.637
C 1341 VAL 0.675 0.459 0.676 0.673
C 1342 VAL 0.617 0.167 0.536 0.725
C 1343 LEU 0.608 0.400 0.538 0.678
C 1344 ALA 0.644 0.231 0.602 0.816
C 1345 VAL 0.639 0.364 0.627 0.655
C 1346 SER 0.721 0.458 0.783 0.598
C 1347 ALA 0.687 0.356 0.770 0.356
C 1348 ILE 0.494 0.109 0.506 0.482
C 1349 TYR 0.565 0.200 0.724 0.486
C 1350 TRP 0.656 0.052 0.489 0.723
C 1351 SER 0.505 0.305 0.508 0.499
C 1352 ARG 0.573 -0.224 0.445 0.646
C 1353 GLU 0.101 -0.637 0.454 -0.182
C 1354 VAL 0.297 -0.181 0.455 0.085
C 1355 GLU 0.509 0.006 0.342 0.642
C 1356 GLU 0.124 -0.756 0.373 -0.075
C 1357 ALA 0.609 0.313 0.683 0.313
C 1358 ILE 0.601 0.258 0.694 0.508
C 1359 SER 0.590 0.496 0.599 0.573
C 1360 GLU 0.529 -0.163 0.691 0.400
C 1361 GLY 0.555 0.501 0.555 N/A
C 1362 SER 0.461 -0.223 0.285 0.812
C 1363 VAL 0.406 -0.174 0.380 0.442
C 1364 PRO 0.686 0.526 0.662 0.719
C 1365 ALA 0.651 0.572 0.670 0.572
C 1366 TYR 0.500 -0.107 0.201 0.650
C 1367 LEU 0.572 0.109 0.471 0.674
C 1368 ASP 0.698 0.618 0.668 0.728
C 1369 LYS 0.501 0.113 0.611 0.413
C 1370 CYS 0.518 0.170 0.448 0.659
C 1371 SER 0.592 0.187 0.547 0.681
C 1372 ALA 0.733 0.613 0.716 0.797
C 1373 ASP 0.577 0.218 0.753 0.400
C 1374 LEU 0.580 0.425 0.557 0.603
C 1375 LEU 0.658 0.218 0.727 0.589
C 1376 ASP 0.531 0.332 0.597 0.465
C 1377 LEU 0.556 0.086 0.472 0.640
C 1378 THR 0.575 0.257 0.555 0.602
C 1379 ASP 0.489 0.020 0.709 0.269
C 1380 LEU 0.683 0.533 0.687 0.678
C 1381 VAL 0.610 0.499 0.618 0.599
C 1382 ARG 0.665 0.403 0.594 0.706
C 1383 GLY 0.759 0.679 0.759 N/A
C 1384 ARG 0.398 -0.848 0.678 0.238
C 1385 LEU 0.635 0.391 0.693 0.576
C 1386 SER 0.727 0.528 0.754 0.672
C 1387 GLY 0.520 0.054 0.520 N/A
C 1388 GLN 0.349 -0.549 0.541 0.196
C 1389 GLU 0.705 0.436 0.682 0.724
C 1390 ARG 0.474 -0.405 0.456 0.484
C 1391 LEU 0.588 0.192 0.504 0.672
C 1392 THR 0.685 0.422 0.677 0.695
C 1393 LEU 0.632 0.360 0.725 0.539
C 1394 GLY 0.438 0.350 0.438 N/A
C 1395 ALA 0.563 -0.081 0.502 0.808
C 1396 LEU 0.645 0.313 0.660 0.630
C 1397 ILE 0.647 0.333 0.753 0.542
C 1398 THR 0.660 0.524 0.669 0.647
C 1399 ILE 0.613 0.279 0.544 0.683
C 1400 ASP 0.502 0.156 0.642 0.363
C 1401 VAL 0.461 -0.193 0.522 0.380
C 1402 HIS 0.648 0.278 0.555 0.710
C 1403 ALA 0.649 0.353 0.647 0.656
C 1404 ARG 0.505 -0.370 0.694 0.397
C 1405 ASP 0.522 0.128 0.557 0.487
C 1406 VAL 0.549 -0.194 0.412 0.733
C 1407 VAL 0.545 0.161 0.547 0.543
C 1408 ALA 0.672 0.407 0.738 0.407
C 1409 GLU 0.450 0.056 0.671 0.273
C 1410 LEU 0.439 -0.338 0.395 0.483
C 1411 ALA 0.632 0.403 0.655 0.540
C 1412 GLU 0.660 0.421 0.641 0.674
C 1413 ALA 0.415 0.022 0.513 0.022
C 1414 LYS 0.681 0.603 0.698 0.667
C 1415 ILE 0.530 -0.049 0.590 0.470
C 1416 LYS 0.468 -0.187 0.536 0.414
C 1417 ASN 0.532 0.163 0.709 0.355
C 1418 PRO 0.650 0.523 0.638 0.667
C 1419 THR 0.461 -0.134 0.420 0.515
C 1420 ASP 0.645 0.412 0.700 0.590
C 1421 PHE 0.377 0.101 0.449 0.335
C 1422 GLU 0.582 0.329 0.523 0.629
C 1423 TRP 0.615 -0.079 0.367 0.714
C 1424 VAL 0.549 0.307 0.608 0.471
C 1425 SER 0.515 0.128 0.429 0.688
C 1426 ARG 0.628 0.038 0.545 0.675
C 1427 LEU 0.562 0.029 0.618 0.505
C 1428 ARG 0.690 0.408 0.711 0.679
C 1429 TYR 0.678 0.324 0.687 0.673
C 1430 TYR 0.729 0.498 0.718 0.735
C 1431 TRP 0.755 0.653 0.712 0.772
C 1432 ARG 0.705 0.522 0.651 0.736
C 1433 ASN 0.633 0.448 0.675 0.590
C 1434 ASP 0.580 -0.060 0.534 0.625
C 1435 ASP 0.640 0.454 0.676 0.604
C 1436 VAL 0.572 0.325 0.626 0.500
C 1437 CYS 0.673 0.347 0.731 0.556
C 1438 VAL 0.662 0.418 0.690 0.623
C 1439 ASP 0.439 0.038 0.632 0.247
C 1440 MET 0.488 0.023 0.437 0.539
C 1441 VAL 0.186 -0.451 0.129 0.263
C 1442 GLN 0.173 -0.652 0.481 -0.074
C 1443 ALA 0.475 -0.306 0.670 -0.306
C 1444 SER 0.609 -0.257 0.768 0.290
C 1445 ILE 0.431 -0.126 0.513 0.350
C 1446 ALA 0.547 0.222 0.555 0.518
C 1447 TYR 0.719 0.504 0.666 0.745
C 1448 GLY 0.558 0.183 0.558 N/A
C 1449 TYR 0.642 0.044 0.524 0.701
C 1450 GLU 0.457 0.228 0.451 0.461
C 1451 TYR 0.442 -0.113 0.629 0.348
C 1452 LEU 0.656 0.417 0.682 0.629
C 1453 GLY 0.775 0.681 0.775 N/A
C 1454 ASN 0.647 0.374 0.597 0.696
C 1455 THR 0.505 -0.309 0.731 0.203
C 1456 PRO 0.617 0.204 0.544 0.714
C 1457 ARG 0.654 0.237 0.640 0.662
C 1458 LEU 0.668 0.489 0.664 0.672
C 1459 VAL 0.581 0.209 0.574 0.589
C 1460 ILE 0.679 0.533 0.708 0.650
C 1461 THR 0.503 0.209 0.561 0.427
C 1462 PRO 0.635 0.289 0.732 0.505
C 1463 LEU 0.686 0.297 0.742 0.629
C 1464 THR 0.730 0.619 0.747 0.709
C 1465 ASP 0.513 -0.006 0.422 0.603
C 1466 ARG 0.716 0.395 0.649 0.755
C 1467 CYS 0.576 -0.002 0.495 0.738
C 1468 TYR 0.594 -0.036 0.712 0.535
C 1469 MET 0.642 0.278 0.669 0.615
C 1470 THR 0.622 0.198 0.565 0.699
C 1471 LEU 0.634 0.384 0.669 0.600
C 1472 MET 0.521 -0.193 0.393 0.650
C 1473 SER 0.553 -0.030 0.693 0.274
C 1474 ALA 0.665 0.213 0.646 0.739
C 1475 MET 0.651 0.415 0.759 0.542
C 1476 HIS 0.724 0.557 0.760 0.699
C 1477 MET 0.608 0.517 0.625 0.591
C 1478 ASN 0.618 0.434 0.702 0.533
C 1479 LEU 0.569 0.305 0.574 0.565
C 1480 GLY 0.614 0.453 0.614 N/A
C 1481 GLY 0.763 0.635 0.763 N/A
C 1482 ALA 0.719 0.470 0.781 0.470
C 1483 PRO 0.737 0.332 0.685 0.807
C 1484 ALA 0.471 0.022 0.584 0.022
C 1485 GLY 0.711 0.598 0.711 N/A
C 1486 PRO 0.708 0.236 0.675 0.752
C 1487 ALA 0.652 0.519 0.685 0.521
C 1488 GLY 0.631 0.468 0.631 N/A
C 1489 THR 0.681 0.467 0.642 0.733
C 1490 GLY 0.630 0.349 0.630 N/A
C 1491 LYS 0.619 0.338 0.621 0.617
C 1492 THR 0.687 0.559 0.727 0.634
C 1493 GLU 0.483 -0.198 0.564 0.418
C 1494 THR 0.717 0.389 0.674 0.773
C 1495 THR 0.540 0.029 0.595 0.467
C 1496 LYS 0.560 0.102 0.555 0.565
C 1497 ASP 0.674 0.212 0.770 0.579
C 1498 LEU 0.388 -0.001 0.368 0.408
C 1499 ALA 0.636 0.351 0.629 0.668
C 1500 LYS 0.540 0.074 0.378 0.669
C 1501 ALA 0.691 0.618 0.684 0.721
C 1502 LEU 0.644 0.321 0.659 0.629
C 1503 ALA 0.664 0.367 0.650 0.723
C 1504 LYS 0.574 -0.017 0.669 0.498
C 1505 GLN 0.689 0.226 0.625 0.741
C 1506 CYS 0.702 0.527 0.674 0.757
C 1507 VAL 0.668 0.521 0.648 0.696
C 1508 VAL 0.642 0.214 0.697 0.568
C 1509 PHE 0.523 0.032 0.495 0.539
C 1510 ASN 0.281 -0.680 0.319 0.242
C 1511 CYS 0.463 -0.139 0.422 0.544
C 1512 SER 0.342 -0.049 0.252 0.523
C 1513 ASP 0.535 0.028 0.447 0.623
C 1514 GLY 0.494 0.103 0.494 N/A
C 1515 LEU 0.313 -0.616 0.133 0.493
C 1516 ASP 0.210 -0.375 0.142 0.277
C 1517 TYR 0.238 -0.194 0.354 0.180
C 1518 GLN 0.316 -0.138 0.288 0.339
C 1519 ALA 0.322 0.008 0.400 0.008
C 1520 MET 0.575 0.219 0.680 0.470
C 1521 ALA 0.541 0.322 0.586 0.359
C 1522 LYS 0.617 -0.007 0.718 0.536
C 1523 PHE 0.331 -0.165 0.405 0.288
C 1524 PHE 0.650 0.248 0.571 0.695
C 1525 LYS 0.609 0.381 0.633 0.590
C 1526 GLY 0.304 -0.288 0.304 N/A
C 1527 LEU 0.487 0.071 0.431 0.543
C 1528 ALA 0.633 0.533 0.658 0.533
C 1529 SER 0.756 0.582 0.788 0.691
C 1530 SER 0.675 0.453 0.700 0.624
C 1531 GLY 0.576 0.483 0.576 N/A
C 1532 ALA 0.709 0.531 0.720 0.667
C 1533 TRP 0.715 0.475 0.729 0.709
C 1534 ALA 0.635 0.482 0.660 0.533
C 1535 CYS 0.627 0.254 0.628 0.624
C 1536 PHE 0.730 0.482 0.639 0.782
C 1537 ASP 0.477 0.222 0.646 0.309
C 1538 GLU 0.391 -0.004 0.461 0.334
C 1539 PHE 0.658 0.276 0.605 0.687
C 1540 ASN 0.458 -0.058 0.415 0.500
C 1541 ARG 0.607 -0.262 0.717 0.544
C 1542 ILE 0.524 0.103 0.500 0.549
C 1543 ASP 0.341 -0.247 0.614 0.069
C 1544 LEU 0.723 0.498 0.682 0.763
C 1545 GLU 0.491 0.216 0.587 0.414
C 1546 VAL 0.559 0.324 0.530 0.599
C 1547 LEU 0.477 0.290 0.474 0.481
C 1548 SER 0.491 0.139 0.611 0.253
C 1549 VAL 0.285 -0.238 0.436 0.083
C 1550 VAL 0.658 0.437 0.627 0.700
C 1551 ALA 0.660 0.336 0.667 0.635
C 1552 GLN 0.516 0.021 0.491 0.537
C 1553 GLN 0.604 0.071 0.443 0.733
C 1554 ILE 0.623 0.511 0.574 0.673
C 1555 LEU 0.524 0.326 0.594 0.454
C 1556 THR 0.673 0.490 0.662 0.688
C 1557 ILE 0.511 0.024 0.441 0.581
C 1558 GLN 0.686 0.433 0.641 0.722
C 1559 LEU 0.644 0.408 0.770 0.518
C 1560 ALA 0.624 0.167 0.634 0.584
C 1561 ILE 0.679 0.482 0.722 0.636
C 1562 GLN 0.740 0.625 0.709 0.764
C 1563 ALA 0.579 0.228 0.667 0.228
C 1564 LYS 0.566 0.043 0.503 0.616
C 1565 VAL 0.595 0.318 0.680 0.481
C 1566 LYS 0.496 -0.095 0.662 0.362
C 1567 ARG 0.517 -0.492 0.653 0.439
C 1568 PHE 0.585 0.296 0.602 0.575
C 1569 ILE 0.503 -0.082 0.679 0.326
C 1570 PHE 0.710 0.570 0.709 0.710
C 1571 GLU 0.604 -0.026 0.672 0.549
C 1572 ASP 0.464 -0.422 0.603 0.325
C 1573 THR 0.559 0.239 0.633 0.461
C 1574 GLU 0.535 0.084 0.624 0.464
C 1575 ILE 0.487 -0.071 0.426 0.549
C 1576 ASP 0.627 0.362 0.765 0.489
C 1577 LEU 0.462 -0.107 0.421 0.503
C 1578 ASN 0.713 0.469 0.760 0.666
C 1579 PRO 0.518 0.210 0.668 0.318
C 1580 ALA 0.551 0.198 0.639 0.198
C 1581 CYS 0.587 0.298 0.630 0.501
C 1582 SER 0.641 0.353 0.641 0.639
C 1583 VAL 0.612 0.408 0.568 0.671
C 1584 TYR 0.549 -0.415 0.722 0.463
C 1585 ILE 0.596 0.320 0.668 0.523
C 1586 THR 0.640 0.353 0.708 0.549
C 1587 MET 0.646 0.200 0.754 0.538
C 1588 ASN 0.463 -0.498 0.311 0.616
C 1589 PRO 0.577 0.270 0.726 0.378
C 1590 GLY 0.561 0.334 0.561 N/A
C 1591 TYR 0.392 -0.054 0.228 0.474
C 1592 ALA 0.311 0.143 0.352 0.143
C 1593 GLY 0.539 0.439 0.539 N/A
C 1594 ARG 0.532 0.063 0.440 0.585
C 1595 SER 0.516 0.303 0.619 0.310
C 1596 GLU 0.318 -0.322 0.640 0.060
C 1597 LEU 0.478 -0.004 0.442 0.513
C 1598 PRO 0.407 -0.146 0.194 0.691
C 1599 ASP 0.625 0.297 0.647 0.603
C 1600 ASN 0.670 0.409 0.702 0.637
C 1601 LEU 0.601 0.050 0.627 0.575
C 1602 LYS 0.609 0.053 0.618 0.601
C 1603 ALA 0.467 0.046 0.573 0.046
C 1604 LEU 0.631 0.426 0.593 0.669
C 1605 PHE 0.644 0.411 0.660 0.635
C 1606 ARG 0.619 0.300 0.703 0.571
C 1607 PRO 0.557 -0.255 0.421 0.738
C 1608 CYS 0.588 0.275 0.545 0.673
C 1609 ALA 0.556 0.341 0.601 0.377
C 1610 MET 0.666 0.324 0.731 0.600
C 1611 MET 0.535 0.239 0.613 0.457
C 1612 VAL 0.421 -0.004 0.523 0.285
C 1613 PRO 0.765 0.610 0.751 0.784
C 1614 ASP 0.591 -0.121 0.571 0.610
C 1615 TYR 0.475 -0.069 0.596 0.414
C 1616 ALA 0.542 -0.117 0.496 0.729
C 1617 LEU 0.556 0.211 0.625 0.487
C 1618 ILE 0.673 0.481 0.652 0.694
C 1619 ALA 0.701 0.623 0.721 0.623
C 1620 GLU 0.401 -0.087 0.555 0.278
C 1621 ILE 0.569 0.069 0.520 0.618
C 1622 CYS 0.593 0.358 0.541 0.697
C 1623 LEU 0.710 0.520 0.751 0.669
C 1624 TYR 0.707 0.443 0.624 0.749
C 1625 SER 0.696 0.345 0.688 0.714
C 1626 TYR 0.666 0.326 0.623 0.688
C 1627 GLY 0.692 0.529 0.692 N/A
C 1628 TYR 0.691 0.266 0.765 0.654
C 1629 LYS 0.605 0.055 0.644 0.574
C 1630 ASN 0.508 0.193 0.661 0.355
C 1631 GLY 0.620 0.411 0.620 N/A
C 1632 LYS 0.645 0.400 0.740 0.570
C 1633 ASP 0.577 0.319 0.542 0.611
C 1634 LEU 0.677 0.422 0.622 0.732
C 1635 ALA 0.678 0.529 0.714 0.531
C 1636 ARG 0.530 -0.034 0.702 0.431
C 1637 LYS 0.662 0.342 0.590 0.720
C 1638 MET 0.650 0.228 0.640 0.660
C 1639 VAL 0.677 0.346 0.727 0.610
C 1640 ALA 0.659 0.535 0.686 0.554
C 1641 THR 0.576 0.205 0.507 0.669
C 1642 PHE 0.530 0.112 0.577 0.503
C 1643 LYS 0.548 0.025 0.593 0.512
C 1644 LEU 0.674 0.337 0.655 0.692
C 1645 CYS 0.590 0.125 0.513 0.743
C 1646 SER 0.670 0.316 0.751 0.508
C 1647 GLU 0.721 0.527 0.811 0.649
C 1648 GLN 0.715 0.486 0.706 0.722
C 1649 LEU 0.681 0.479 0.657 0.704
C 1650 SER 0.504 -0.161 0.720 0.073
C 1651 SER 0.692 0.455 0.740 0.594
C 1652 GLN 0.641 0.342 0.702 0.592
C 1653 ASP 0.600 0.224 0.723 0.478
C 1654 HIS 0.760 0.500 0.683 0.812
C 1655 TYR 0.664 -0.135 0.451 0.771
C 1656 ASP 0.623 0.243 0.674 0.572
C 1657 TYR 0.604 0.209 0.712 0.550
C 1658 GLY 0.635 0.281 0.635 N/A
C 1659 MET 0.640 0.368 0.667 0.613
C 1660 ARG 0.378 -0.255 0.569 0.269
C 1661 ALA 0.556 0.320 0.561 0.536
C 1662 VAL 0.595 -0.113 0.772 0.359
C 1663 LYS 0.591 0.243 0.778 0.441
C 1664 SER 0.629 0.321 0.584 0.719
C 1665 VAL 0.657 0.357 0.654 0.660
C 1666 ILE 0.668 0.469 0.655 0.681
C 1667 THR 0.312 -0.548 0.673 -0.168
C 1668 ALA 0.705 0.599 0.731 0.599
C 1669 ALA 0.509 -0.251 0.699 -0.251
C 1670 GLY 0.612 0.361 0.612 N/A
C 1671 ASN 0.605 0.401 0.671 0.539
C 1672 LEU 0.497 0.357 0.464 0.531
C 1673 LYS 0.563 0.331 0.518 0.599
C 1674 ARG 0.578 0.211 0.544 0.597
C 1675 GLU 0.528 0.018 0.639 0.440
C 1676 PHE 0.447 0.200 0.559 0.383
C 1677 PRO 0.670 0.512 0.757 0.554
C 1678 ASP 0.521 0.130 0.685 0.356
C 1679 ASP 0.504 0.196 0.734 0.273
C 1680 ASP 0.634 0.393 0.649 0.618
C 1681 GLU 0.515 0.253 0.574 0.468
C 1682 GLU 0.555 0.240 0.627 0.498
C 1683 VAL 0.607 0.232 0.533 0.704
C 1684 LEU 0.654 0.290 0.699 0.608
C 1685 LEU 0.511 -0.155 0.333 0.688
C 1686 LEU 0.570 0.346 0.474 0.667
C 1687 ARG 0.575 0.400 0.616 0.552
C 1688 ALA 0.625 0.421 0.676 0.421
C 1689 LEU 0.699 0.514 0.716 0.682
C 1690 ARG 0.740 0.347 0.755 0.732
C 1691 ASP 0.506 0.028 0.498 0.513
C 1692 VAL 0.641 0.401 0.648 0.631
C 1693 ASN 0.655 0.351 0.671 0.640
C 1694 VAL 0.682 0.404 0.672 0.694
C 1695 PRO 0.600 0.058 0.529 0.694
C 1696 LYS 0.645 0.433 0.750 0.562
C 1697 PHE 0.640 0.386 0.737 0.585
C 1698 LEU 0.710 0.550 0.711 0.709
C 1699 SER 0.524 0.070 0.692 0.188
C 1700 HIS 0.639 0.338 0.622 0.650
C 1701 ASP 0.598 0.293 0.534 0.662
C 1702 LEU 0.662 0.373 0.651 0.673
C 1703 PRO 0.690 0.471 0.633 0.766
C 1704 LEU 0.630 0.142 0.533 0.728
C 1705 PHE 0.663 0.131 0.572 0.716
C 1706 ASP 0.720 0.585 0.705 0.734
C 1707 GLY 0.473 0.151 0.473 N/A
C 1708 ILE 0.699 0.426 0.740 0.657
C 1709 ILE 0.657 0.418 0.619 0.695
C 1710 THR 0.637 0.405 0.643 0.628
C 1711 ASP 0.752 0.582 0.713 0.792
C 1712 LEU 0.632 0.327 0.584 0.680
C 1713 PHE 0.707 0.415 0.615 0.759
C 1714 PRO 0.633 0.499 0.643 0.619
C 1715 GLY 0.568 0.462 0.568 N/A
C 1716 VAL 0.628 0.296 0.647 0.603
C 1717 LYS 0.425 -0.153 0.734 0.177
C 1718 MET 0.755 0.687 0.766 0.744
C 1719 PRO 0.570 0.189 0.503 0.658
C 1720 GLU 0.569 0.091 0.555 0.580
C 1721 VAL 0.633 0.414 0.683 0.566
C 1722 ASP 0.361 -0.040 0.464 0.258
C 1723 TYR 0.535 0.196 0.585 0.509
C 1724 ASN 0.602 0.447 0.680 0.524
C 1725 SER 0.607 0.317 0.530 0.762
C 1726 LEU 0.688 0.456 0.605 0.772
C 1727 LEU 0.421 -0.037 0.488 0.355
C 1728 LYS 0.602 0.344 0.757 0.478
C 1729 ALA 0.508 -0.087 0.491 0.574
C 1730 LEU 0.455 0.072 0.428 0.483
C 1731 ASP 0.605 0.061 0.721 0.488
C 1732 GLU 0.652 0.427 0.698 0.615
C 1733 SER 0.607 0.262 0.603 0.614
C 1734 CYS 0.592 0.171 0.613 0.550
C 1735 GLY 0.704 0.657 0.704 N/A
C 1736 GLU 0.619 0.163 0.558 0.667
C 1737 LEU 0.643 0.428 0.653 0.633
C 1738 GLY 0.786 0.755 0.786 N/A
C 1739 ILE 0.657 0.432 0.658 0.655
C 1740 GLN 0.591 0.311 0.539 0.632
C 1741 PRO 0.659 0.339 0.648 0.674
C 1742 VAL 0.556 0.194 0.670 0.404
C 1743 GLU 0.577 -0.133 0.712 0.469
C 1744 SER 0.673 0.527 0.699 0.620
C 1745 PHE 0.725 0.332 0.665 0.760
C 1746 VAL 0.524 -0.034 0.432 0.647
C 1747 GLY 0.792 0.754 0.792 N/A
C 1748 LYS 0.688 0.425 0.756 0.634
C 1749 VAL 0.645 0.411 0.648 0.641
C 1750 ILE 0.667 0.489 0.675 0.660
C 1751 GLN 0.738 0.580 0.747 0.731
C 1752 LEU 0.694 0.431 0.656 0.732
C 1753 TYR 0.622 0.264 0.433 0.717
C 1754 GLU 0.673 0.452 0.723 0.632
C 1755 THR 0.692 0.442 0.672 0.719
C 1756 THR 0.449 0.203 0.521 0.353
C 1757 ILE 0.537 0.352 0.537 0.536
C 1758 VAL 0.508 0.180 0.604 0.381
C 1759 ARG 0.678 0.342 0.653 0.692
C 1760 HIS 0.698 0.486 0.775 0.647
C 1761 GLY 0.615 0.134 0.615 N/A
C 1762 LEU 0.618 0.315 0.720 0.516
C 1763 MET 0.707 0.551 0.730 0.684
C 1764 LEU 0.658 0.498 0.695 0.622
C 1765 VAL 0.703 0.466 0.801 0.573
C 1766 GLY 0.748 0.583 0.748 N/A
C 1767 PRO 0.707 0.452 0.685 0.735
C 1768 THR 0.660 0.344 0.658 0.664
C 1769 MET 0.511 0.257 0.648 0.375
C 1770 GLY 0.612 0.362 0.612 N/A
C 1771 GLY 0.663 0.309 0.663 N/A
C 1772 LYS 0.763 0.606 0.775 0.753
C 1773 THR 0.690 0.526 0.657 0.733
C 1774 CYS 0.564 0.170 0.519 0.654
C 1775 CYS 0.550 0.186 0.495 0.662
C 1776 TYR 0.630 0.348 0.692 0.598
C 1777 ARG 0.653 0.410 0.630 0.666
C 1778 SER 0.647 0.469 0.690 0.559
C 1779 LEU 0.558 0.081 0.498 0.619
C 1780 GLN 0.714 0.412 0.772 0.668
C 1781 LYS 0.278 -0.068 0.514 0.090
C 1782 ALA 0.506 0.055 0.446 0.747
C 1783 MET 0.678 0.387 0.677 0.679
C 1784 THR 0.675 0.373 0.663 0.691
C 1785 LYS 0.303 -0.409 0.633 0.039
C 1786 LEU 0.607 0.415 0.616 0.597
C 1787 ALA 0.626 0.266 0.583 0.798
C 1788 ALA 0.557 0.334 0.613 0.334
C 1789 ALA 0.511 0.229 0.582 0.229
C 1790 GLY 0.411 0.086 0.411 N/A
C 1791 ASP 0.549 0.086 0.672 0.426
C 1792 SER 0.615 0.196 0.545 0.753
C 1793 LYS 0.377 -0.581 0.613 0.188
C 1794 TYR 0.596 -0.019 0.321 0.734
C 1795 GLU 0.544 0.276 0.547 0.542
C 1796 ARG 0.565 0.342 0.420 0.647
C 1797 VAL 0.544 0.278 0.527 0.567
C 1798 ARG 0.621 0.477 0.650 0.605
C 1799 VAL 0.613 0.381 0.616 0.610
C 1800 VAL 0.474 -0.076 0.540 0.385
C 1801 ALA 0.606 0.096 0.615 0.569
C 1802 LEU 0.645 0.485 0.668 0.622
C 1803 ASN 0.615 0.503 0.582 0.647
C 1804 PRO 0.655 0.333 0.601 0.726
C 1805 LYS 0.673 0.506 0.633 0.704
C 1806 SER 0.665 0.036 0.783 0.428
C 1807 ILE 0.600 0.214 0.661 0.538
C 1808 THR 0.608 0.337 0.671 0.525
C 1809 MET 0.467 -0.063 0.609 0.324
C 1810 GLY 0.682 0.553 0.682 N/A
C 1811 GLN 0.596 0.337 0.656 0.549
C 1812 LEU 0.578 -0.118 0.455 0.701
C 1813 TYR 0.648 0.271 0.545 0.700
C 1814 GLY 0.678 0.502 0.678 N/A
C 1815 GLU 0.211 -0.342 0.163 0.249
C 1816 PHE 0.331 -0.602 0.566 0.196
C 1817 ASP 0.460 -0.250 0.372 0.548
C 1818 GLU 0.011 -0.740 -0.134 0.127
C 1819 ASN 0.117 -0.624 0.482 -0.248
C 1820 THR 0.107 -0.385 0.219 -0.043
C 1821 HIS 0.267 -0.749 0.204 0.310
C 1822 GLU 0.267 -0.359 0.268 0.266
C 1823 TRP 0.556 0.263 0.589 0.543
C 1824 THR 0.455 -0.281 0.614 0.242
C 1825 ASP 0.292 -0.223 0.466 0.117
C 1826 GLY 0.383 -0.485 0.383 N/A
C 1827 VAL 0.665 0.345 0.720 0.591
C 1828 LEU 0.520 -0.289 0.320 0.720
C 1829 ALA 0.660 0.384 0.643 0.725
C 1830 CYS 0.577 -0.177 0.542 0.646
C 1831 TYR 0.552 0.257 0.518 0.569
C 1832 MET 0.585 0.266 0.465 0.704
C 1833 ARG 0.537 0.149 0.494 0.562
C 1834 GLU 0.631 0.320 0.582 0.670
C 1835 CYS 0.333 -0.229 0.236 0.527
C 1836 SER 0.387 0.109 0.486 0.189
C 1837 GLU 0.371 -0.637 0.517 0.254
C 1838 ASP 0.317 -0.653 0.524 0.110
C 1839 THR 0.354 0.153 0.382 0.316
C 1840 LYS 0.622 0.403 0.690 0.568
C 1841 PRO 0.452 -0.199 0.335 0.609
C 1842 ASP 0.342 -0.144 0.422 0.263
C 1843 LYS 0.570 0.049 0.403 0.704
C 1844 LYS 0.599 0.262 0.677 0.537
C 1845 TRP 0.736 0.564 0.688 0.756
C 1846 ILE 0.669 0.395 0.685 0.653
C 1847 MET 0.649 0.194 0.662 0.635
C 1848 PHE 0.727 0.609 0.705 0.740
C 1849 ASP 0.441 -0.173 0.331 0.551
C 1850 GLY 0.276 0.132 0.276 N/A
C 1851 PRO 0.544 0.256 0.665 0.384
C 1852 VAL 0.554 0.185 0.534 0.580
C 1853 ASP 0.391 0.055 0.543 0.240
C 1854 ALA 0.608 0.485 0.567 0.775
C 1855 VAL 0.197 -0.279 0.475 -0.174
C 1856 TRP 0.704 0.427 0.636 0.731
C 1857 ILE 0.594 0.134 0.575 0.613
C 1858 GLU -0.055 -0.668 0.142 -0.212
C 1859 ASN 0.673 0.164 0.765 0.581
C 1860 MET 0.597 0.311 0.609 0.585
C 1861 ASN 0.481 -0.157 0.706 0.257
C 1862 THR 0.417 -0.149 0.373 0.475
C 1863 VAL 0.594 0.294 0.720 0.426
C 1864 LEU 0.464 0.125 0.540 0.387
C 1865 ASP 0.606 0.485 0.575 0.636
C 1866 ASP 0.364 -0.588 0.587 0.141
C 1867 ASN 0.337 0.016 0.403 0.271
C 1868 LYS 0.634 0.413 0.598 0.663
C 1869 LYS 0.379 -0.207 0.604 0.198
C 1870 LEU 0.639 0.239 0.768 0.510
C 1871 CYS 0.498 -0.093 0.681 0.131
C 1872 LEU 0.626 0.360 0.677 0.575
C 1873 VAL 0.078 -0.541 0.390 -0.338
C 1874 SER 0.388 -0.022 0.511 0.141
C 1875 GLY 0.322 0.077 0.322 N/A
C 1876 GLU 0.592 0.353 0.673 0.527
C 1877 ILE 0.510 0.117 0.649 0.372
C 1878 ILE 0.583 0.056 0.689 0.476
C 1879 GLN 0.409 -0.017 0.448 0.377
C 1880 LEU 0.660 0.472 0.676 0.643
C 1881 SER 0.585 0.214 0.653 0.450
C 1882 ALA 0.452 -0.358 0.654 -0.358
C 1883 SER 0.559 0.198 0.552 0.574
C 1884 MET 0.688 0.304 0.762 0.615
C 1885 THR 0.604 0.180 0.644 0.550
C 1886 MET 0.607 0.136 0.548 0.666
C 1887 MET 0.602 0.276 0.643 0.560
C 1888 PHE 0.647 0.373 0.602 0.672
C 1889 GLU 0.680 0.423 0.654 0.701
C 1890 VAL 0.563 -0.170 0.686 0.399
C 1891 GLU 0.713 0.422 0.703 0.720
C 1892 ASP 0.605 0.327 0.696 0.514
C 1893 LEU 0.625 0.198 0.681 0.568
C 1894 ALA 0.742 0.670 0.727 0.806
C 1895 VAL 0.528 0.079 0.543 0.509
C 1896 ALA 0.583 0.274 0.618 0.444
C 1897 SER 0.515 -0.040 0.376 0.792
C 1898 PRO 0.639 0.144 0.556 0.751
C 1899 ALA 0.743 0.659 0.764 0.659
C 1900 THR 0.626 0.434 0.596 0.666
C 1901 VAL 0.554 0.067 0.475 0.660
C 1902 SER 0.539 0.102 0.548 0.521
C 1903 ARG 0.500 0.133 0.496 0.502
C 1904 CYS 0.652 0.304 0.655 0.646
C 1905 GLY 0.697 0.496 0.697 N/A
C 1906 MET 0.672 0.434 0.679 0.665
C 1907 VAL 0.683 0.433 0.630 0.753
C 1908 TYR 0.713 0.338 0.644 0.748
C 1909 MET 0.704 0.580 0.674 0.735
C 1910 GLU 0.633 0.420 0.692 0.585
C 1911 PRO 0.670 0.502 0.680 0.658
C 1912 THR 0.617 0.449 0.577 0.671
C 1913 ALA 0.651 0.265 0.630 0.733
C 1914 LEU 0.583 0.254 0.647 0.518
C 1915 GLY 0.610 0.548 0.610 N/A
C 1916 LEU 0.458 -0.008 0.492 0.424
C 1917 GLU 0.518 -0.270 0.713 0.363
C 1918 PRO 0.631 0.253 0.606 0.664
C 1919 LEU 0.672 0.464 0.626 0.718
C 1920 LEU 0.620 -0.031 0.491 0.750
C 1921 THR 0.680 0.543 0.711 0.639
C 1922 SER 0.639 0.363 0.658 0.600
C 1923 TRP 0.692 0.381 0.577 0.739
C 1924 LEU 0.751 0.569 0.805 0.698
C 1925 ALA 0.754 0.669 0.776 0.669
C 1926 ARG 0.668 0.252 0.603 0.706
C 1927 LEU 0.691 0.362 0.636 0.745
C 1928 PRO 0.588 0.264 0.633 0.527
C 1929 PRO 0.661 0.401 0.659 0.663
C 1930 GLY 0.533 0.419 0.533 N/A
C 1931 GLY 0.555 0.171 0.555 N/A
C 1932 VAL 0.513 0.284 0.605 0.391
C 1933 ALA 0.025 -0.281 0.050 -0.077
C 1934 GLU 0.331 -0.280 0.517 0.183
C 1935 ASN 0.611 0.353 0.710 0.512
C 1936 SER 0.631 0.390 0.597 0.700
C 1937 GLY 0.750 0.714 0.750 N/A
C 1938 LYS 0.444 -0.161 0.341 0.526
C 1939 LEU 0.684 0.424 0.636 0.732
C 1940 GLY 0.715 0.528 0.715 N/A
C 1941 ALA 0.584 0.309 0.653 0.309
C 1942 ILE 0.422 -0.216 0.670 0.175
C 1943 PHE 0.692 0.516 0.692 0.692
C 1944 ASN 0.497 0.172 0.354 0.639
C 1945 ALA 0.589 0.074 0.539 0.790
C 1946 LEU 0.665 0.312 0.647 0.683
C 1947 VAL 0.648 0.336 0.579 0.740
C 1948 PRO 0.606 0.182 0.512 0.730
C 1949 ASP 0.585 0.235 0.652 0.517
C 1950 ALA 0.729 0.502 0.728 0.732
C 1951 LEU 0.692 0.424 0.766 0.618
C 1952 ARG 0.559 -0.133 0.351 0.678
C 1953 PHE 0.457 0.035 0.442 0.466
C 1954 LEU 0.633 0.183 0.551 0.715
C 1955 ARG 0.726 0.386 0.757 0.708
C 1956 LYS 0.316 0.015 0.549 0.129
C 1957 ASN 0.521 0.085 0.628 0.414
C 1958 LEU 0.751 0.523 0.767 0.735
C 1959 LYS 0.566 -0.235 0.766 0.407
C 1960 GLU 0.565 -0.168 0.678 0.475
C 1961 THR 0.607 -0.071 0.717 0.460
C 1962 VAL 0.620 0.374 0.539 0.727
C 1963 THR 0.602 0.144 0.696 0.477
C 1964 THR 0.475 0.284 0.448 0.512
C 1965 VAL 0.436 -0.558 0.670 0.124
C 1966 ASN 0.721 0.365 0.804 0.638
C 1967 ASN 0.700 0.441 0.766 0.635
C 1968 ASN 0.717 0.562 0.722 0.712
C 1969 LEU 0.670 0.278 0.639 0.701
C 1970 VAL 0.708 0.425 0.652 0.783
C 1971 ALA 0.637 0.400 0.617 0.715
C 1972 SER 0.593 0.044 0.565 0.648
C 1973 CYS 0.734 0.562 0.700 0.801
C 1974 PHE 0.737 0.640 0.724 0.745
C 1975 GLY 0.646 0.347 0.646 N/A
C 1976 LEU 0.568 0.233 0.506 0.629
C 1977 MET 0.629 0.377 0.654 0.604
C 1978 ASP 0.449 -0.202 0.636 0.262
C 1979 SER 0.637 0.427 0.661 0.591
C 1980 LEU 0.669 0.197 0.600 0.738
C 1981 THR 0.498 0.174 0.441 0.574
C 1982 LYS 0.582 0.133 0.516 0.634
C 1983 PRO 0.582 0.182 0.770 0.332
C 1984 PHE 0.589 0.376 0.624 0.568
C 1985 VAL 0.533 0.364 0.580 0.471
C 1986 ARG 0.607 0.262 0.553 0.638
C 1987 GLY 0.395 0.282 0.395 N/A
C 1988 GLU 0.435 -0.389 0.597 0.306
C 1989 GLY 0.272 0.069 0.272 N/A
C 1990 GLU 0.309 -0.419 0.646 0.040
C 1991 ASP 0.528 -0.004 0.626 0.430
C 1992 PRO 0.668 0.504 0.721 0.596
C 1993 LEU 0.595 0.410 0.629 0.562
C 1994 THR 0.375 -0.295 0.358 0.396
C 1995 ALA 0.645 0.357 0.717 0.357
C 1996 ASP 0.285 -0.251 0.354 0.215
C 1997 GLU 0.380 0.000 0.361 0.395
C 1998 LYS 0.488 -0.187 0.736 0.290
C 1999 VAL 0.460 -0.365 0.678 0.171
C 2000 LYS 0.179 -0.548 0.508 -0.083
C 2001 LEU 0.636 0.369 0.584 0.688
C 2002 GLY 0.695 0.479 0.695 N/A
C 2003 GLY 0.509 0.364 0.509 N/A
C 2004 PHE 0.495 -0.257 0.235 0.644
C 2005 LEU 0.693 0.533 0.647 0.738
C 2006 PRO 0.640 0.272 0.593 0.702
C 2007 SER 0.405 -0.086 0.421 0.372
C 2008 LEU 0.649 0.421 0.648 0.650
C 2009 MET 0.507 -0.109 0.328 0.686
C 2010 LEU 0.674 0.500 0.714 0.634
C 2011 PHE 0.630 -0.044 0.442 0.738
C 2012 SER 0.685 0.605 0.705 0.646
C 2013 ILE 0.737 0.463 0.690 0.784
C 2014 VAL 0.588 0.326 0.552 0.636
C 2015 TRP 0.623 0.301 0.723 0.583
C 2016 SER 0.664 0.555 0.675 0.641
C 2017 LEU 0.704 0.328 0.636 0.771
C 2018 GLY 0.572 0.445 0.572 N/A
C 2019 ALA 0.667 0.456 0.720 0.456
C 2020 SER 0.752 0.604 0.822 0.612
C 2021 CYS 0.590 0.253 0.536 0.699
C 2022 ASP 0.455 0.168 0.512 0.399
C 2023 LYS 0.432 -0.128 0.657 0.252
C 2024 ALA 0.626 0.517 0.654 0.517
C 2025 GLY 0.505 0.444 0.505 N/A
C 2026 ARG 0.730 0.519 0.729 0.730
C 2027 THR 0.603 0.228 0.607 0.598
C 2028 LEU 0.563 0.253 0.576 0.550
C 2029 PHE 0.665 0.314 0.689 0.651
C 2030 ASP 0.587 0.434 0.562 0.612
C 2031 GLU 0.366 -0.145 0.409 0.331
C 2032 TRP 0.426 -0.415 0.139 0.540
C 2033 PHE 0.609 0.245 0.484 0.681
C 2034 ARG 0.591 -0.154 0.748 0.501
C 2035 LYS 0.429 -0.141 0.539 0.340
C 2036 HIS 0.427 0.058 0.516 0.367
C 2037 ALA 0.480 0.069 0.531 0.274
C 2038 ALA 0.546 0.188 0.535 0.589
C 2039 GLU 0.428 0.048 0.451 0.410
C 2040 CYS 0.686 0.579 0.731 0.595
C 2041 GLY 0.360 -0.019 0.360 N/A
C 2042 LEU 0.460 0.014 0.496 0.424
C 2043 PRO 0.568 0.273 0.611 0.510
C 2044 LEU 0.526 0.142 0.482 0.570
C 2045 GLU 0.599 0.409 0.641 0.565
C 2046 GLY 0.680 0.530 0.680 N/A
C 2047 ALA 0.663 0.505 0.703 0.505
C 2048 MET 0.463 -0.129 0.393 0.533
C 2049 PHE 0.594 0.238 0.457 0.672
C 2050 PRO 0.592 0.348 0.586 0.600
C 2051 GLY 0.563 0.083 0.563 N/A
C 2052 GLU 0.076 -0.472 0.285 -0.091
C 2053 GLY 0.550 0.195 0.550 N/A
C 2054 THR 0.538 0.169 0.494 0.596
C 2055 VAL 0.632 0.376 0.671 0.580
C 2056 TYR 0.736 0.492 0.674 0.768
C 2057 ASP 0.364 0.063 0.393 0.334
C 2058 TRP 0.671 0.185 0.572 0.710
C 2059 VAL 0.400 -0.281 0.335 0.488
C 2060 TYR 0.616 0.257 0.718 0.565
C 2061 ASP 0.542 0.125 0.413 0.670
C 2062 THR 0.522 0.176 0.448 0.621
C 2063 ASP 0.465 -0.011 0.664 0.265
C 2064 GLY 0.385 0.095 0.385 N/A
C 2065 THR 0.506 0.208 0.558 0.437
C 2066 PHE 0.668 0.508 0.670 0.667
C 2067 ALA 0.664 0.422 0.635 0.780
C 2068 GLU 0.513 0.139 0.597 0.447
C 2069 GLY 0.384 0.076 0.384 N/A
C 2070 GLY 0.553 0.261 0.553 N/A
C 2071 ALA 0.555 0.253 0.506 0.753
C 2072 PRO 0.388 -0.216 0.424 0.342
C 2073 GLY 0.655 0.550 0.655 N/A
C 2074 TRP 0.580 0.224 0.579 0.580
C 2075 VAL 0.583 0.271 0.601 0.559
C 2076 GLY 0.530 0.267 0.530 N/A
C 2077 TRP 0.667 0.439 0.694 0.656
C 2078 MET 0.507 0.146 0.625 0.389
C 2079 ALA 0.716 0.598 0.718 0.705
C 2080 THR 0.677 0.492 0.744 0.587
C 2081 VAL 0.635 0.336 0.633 0.636
C 2082 PRO 0.647 0.312 0.717 0.554
C 2083 GLU 0.146 -0.604 0.232 0.077
C 2084 PHE 0.616 0.035 0.479 0.694
C 2085 LYS 0.595 0.278 0.779 0.448
C 2086 CYS 0.755 0.648 0.758 0.750
C 2087 ASP 0.576 0.390 0.532 0.619
C 2088 PRO 0.644 0.241 0.594 0.711
C 2089 ASP 0.321 -0.211 0.649 -0.008
C 2090 ARG 0.521 0.066 0.635 0.456
C 2091 PRO 0.669 0.189 0.632 0.718
C 2092 PHE 0.705 0.549 0.635 0.745
C 2093 SER 0.473 -0.130 0.398 0.624
C 2094 GLU 0.600 0.258 0.625 0.581
C 2095 ILE 0.474 0.166 0.580 0.369
C 2096 ILE 0.474 0.185 0.488 0.461
C 2097 VAL 0.603 0.188 0.685 0.494
C 2098 PRO 0.709 0.553 0.764 0.637
C 2099 THR 0.645 0.422 0.709 0.560
C 2100 ALA 0.585 0.122 0.558 0.693
C 2101 ASP 0.562 0.369 0.697 0.427
C 2102 THR 0.607 0.394 0.608 0.606
C 2103 VAL 0.495 0.122 0.638 0.305
C 2104 ARG 0.619 -0.259 0.382 0.755
C 2105 TYR 0.744 0.425 0.767 0.733
C 2106 THR 0.649 0.471 0.678 0.611
C 2107 TYR 0.636 0.301 0.547 0.681
C 2108 VAL 0.619 0.258 0.609 0.632
C 2109 VAL 0.688 0.213 0.781 0.565
C 2110 ASP 0.677 0.215 0.645 0.708
C 2111 LYS 0.642 -0.181 0.479 0.773
C 2112 LEU 0.729 0.326 0.691 0.767
C 2113 VAL 0.752 0.571 0.734 0.775
C 2114 ALA 0.549 0.163 0.526 0.644
C 2115 ASN 0.616 0.213 0.583 0.649
C 2116 GLN 0.717 0.606 0.719 0.716
C 2117 ARG 0.679 0.371 0.715 0.659
C 2118 HIS 0.748 0.577 0.765 0.737
C 2119 VAL 0.732 0.607 0.734 0.729
C 2120 LEU 0.792 0.716 0.791 0.793
C 2121 CYS 0.662 0.391 0.609 0.767
C 2122 VAL 0.650 0.445 0.562 0.768
C 2123 GLY 0.528 0.441 0.528 N/A
C 2124 GLU 0.573 0.062 0.600 0.551
C 2125 THR 0.645 0.418 0.673 0.609
C 2126 GLY 0.656 0.391 0.656 N/A
C 2127 THR 0.744 0.630 0.732 0.760
C 2128 GLY 0.717 0.567 0.717 N/A
C 2129 LYS 0.734 0.580 0.772 0.704
C 2130 THR 0.680 0.391 0.677 0.684
C 2131 LEU 0.610 0.366 0.682 0.539
C 2132 ASN 0.750 0.464 0.731 0.769
C 2133 VAL 0.639 0.233 0.576 0.724
C 2134 SER 0.769 0.688 0.785 0.737
C 2135 ASN 0.462 -0.208 0.325 0.599
C 2136 LYS 0.583 0.090 0.564 0.599
C 2137 LEU 0.729 0.647 0.724 0.734
C 2138 LEU 0.529 0.404 0.510 0.548
C 2139 ASN 0.622 0.514 0.593 0.651
C 2140 ASP 0.604 0.288 0.773 0.435
C 2141 MET 0.566 0.183 0.581 0.551
C 2142 PRO 0.668 0.467 0.705 0.620
C 2143 PRO 0.668 0.567 0.662 0.677
C 2144 GLU 0.624 0.442 0.591 0.650
C 2145 VAL 0.669 0.379 0.679 0.657
C 2146 GLN 0.581 0.204 0.601 0.565
C 2147 PRO 0.642 0.528 0.694 0.573
C 2148 VAL 0.697 0.567 0.691 0.706
C 2149 PHE 0.691 0.462 0.690 0.691
C 2150 MET 0.633 0.323 0.734 0.533
C 2151 THR 0.468 -0.147 0.647 0.229
C 2152 PHE 0.668 0.265 0.606 0.704
C 2153 SER 0.603 0.128 0.700 0.409
C 2154 ALA 0.663 0.490 0.681 0.589
C 2155 ARG 0.436 -0.190 0.825 0.213
C 2156 THR 0.715 0.586 0.684 0.757
C 2157 SER 0.541 -0.169 0.448 0.728
C 2158 ALA 0.669 0.457 0.721 0.457
C 2159 ASN 0.633 0.325 0.573 0.693
C 2160 GLN 0.688 0.261 0.603 0.755
C 2161 THR 0.683 0.381 0.635 0.746
C 2162 GLN 0.439 -0.035 0.459 0.422
C 2163 ASP 0.530 0.056 0.677 0.383
C 2164 ILE 0.629 0.410 0.712 0.547
C 2165 ILE 0.549 0.080 0.634 0.464
C 2166 ASP 0.484 -0.214 0.551 0.417
C 2167 ALA 0.659 0.490 0.693 0.522
C 2168 LYS 0.432 0.066 0.438 0.428
C 2169 MET 0.393 -0.145 0.287 0.499
C 2170 ASP 0.302 -0.333 0.382 0.222
C 2171 LYS 0.338 0.017 0.450 0.248
C 2172 ARG 0.576 -0.286 0.390 0.682
C 2173 ARG 0.545 0.208 0.624 0.499
C 2174 LYS 0.536 0.233 0.562 0.515
C 2175 GLY 0.633 0.394 0.633 N/A
C 2176 VAL 0.536 0.155 0.408 0.707
C 2177 PHE 0.526 -0.047 0.501 0.540
C 2178 GLY 0.642 0.455 0.642 N/A
C 2179 PRO 0.674 0.519 0.658 0.697
C 2180 PRO 0.627 0.467 0.639 0.611
C 2181 ALA 0.493 0.101 0.591 0.101
C 2182 GLY 0.665 0.569 0.665 N/A
C 2183 LYS 0.395 -0.023 0.691 0.158
C 2184 ARG 0.519 0.148 0.625 0.458
C 2185 MET 0.647 0.151 0.613 0.682
C 2186 VAL 0.749 0.539 0.727 0.779
C 2187 ILE 0.738 0.569 0.739 0.736
C 2188 PHE 0.691 0.563 0.735 0.667
C 2189 ILE 0.701 0.446 0.746 0.656
C 2190 ASP 0.646 0.404 0.699 0.594
C 2191 ASP 0.547 0.310 0.591 0.503
C 2192 LEU 0.584 0.025 0.482 0.686
C 2193 ASN 0.723 0.509 0.759 0.686
C 2194 MET 0.547 -0.029 0.448 0.646
C 2195 PRO 0.745 0.515 0.713 0.788
C 2196 GLN 0.650 0.360 0.735 0.581
C 2197 ARG 0.708 0.036 0.598 0.770
C 2198 GLU 0.726 0.555 0.786 0.678
C 2199 LYS 0.656 0.366 0.669 0.645
C 2200 TYR 0.683 0.368 0.723 0.663
C 2201 PHE 0.754 0.655 0.759 0.752
C 2202 ALA 0.587 0.269 0.629 0.417
C 2203 GLN 0.657 0.264 0.511 0.773
C 2204 PRO 0.530 -0.254 0.430 0.663
C 2205 PRO 0.679 0.499 0.703 0.646
C 2206 ILE 0.639 0.555 0.643 0.634
C 2207 GLU 0.646 0.318 0.551 0.722
C 2208 LEU 0.613 0.161 0.579 0.648
C 2209 LEU 0.549 0.157 0.581 0.517
C 2210 ARG 0.626 0.334 0.652 0.611
C 2211 GLN 0.680 0.450 0.713 0.653
C 2212 TRP 0.702 0.147 0.606 0.740
C 2213 MET 0.622 0.387 0.664 0.579
C 2214 ASP 0.638 0.084 0.558 0.717
C 2215 HIS 0.760 0.454 0.738 0.775
C 2216 GLY 0.640 0.531 0.640 N/A
C 2217 GLY 0.759 0.583 0.759 N/A
C 2218 TRP 0.668 0.534 0.702 0.654
C 2219 TYR 0.566 0.281 0.468 0.615
C 2220 GLU 0.507 -0.261 0.364 0.622
C 2221 ARG 0.053 -0.806 0.437 -0.166
C 2222 LYS 0.332 -0.563 0.405 0.273
C 2223 PRO 0.526 0.018 0.656 0.354
C 2224 PRO 0.637 0.301 0.644 0.628
C 2225 CYS 0.476 -0.157 0.630 0.168
C 2226 PRO 0.745 0.579 0.738 0.756
C 2227 PHE 0.654 0.465 0.565 0.704
C 2228 ARG 0.666 0.429 0.686 0.656
C 2229 THR 0.556 0.267 0.579 0.525
C 2230 ILE 0.654 0.132 0.672 0.636
C 2231 VAL 0.677 0.576 0.650 0.714
C 2232 ASP 0.609 0.373 0.662 0.556
C 2233 THR 0.685 0.428 0.695 0.671
C 2234 GLN 0.758 0.559 0.782 0.738
C 2235 PHE 0.767 0.657 0.779 0.760
C 2236 VAL 0.678 0.362 0.696 0.655
C 2237 ALA 0.706 0.534 0.750 0.534
C 2238 ALA 0.707 0.500 0.739 0.581
C 2239 MET 0.616 -0.097 0.831 0.401
C 2240 GLY 0.747 0.594 0.747 N/A
C 2241 PRO 0.617 0.096 0.489 0.787
C 2242 PRO 0.713 0.602 0.729 0.692
C 2243 GLY 0.745 0.650 0.745 N/A
C 2244 GLY 0.733 0.588 0.733 N/A
C 2245 GLY 0.790 0.761 0.790 N/A
C 2246 ARG 0.661 0.031 0.800 0.582
C 2247 ASN 0.648 0.278 0.542 0.753
C 2248 PRO 0.716 0.339 0.632 0.828
C 2249 VAL 0.700 0.538 0.716 0.677
C 2250 THR 0.594 0.368 0.632 0.544
C 2251 ASN 0.728 0.493 0.794 0.661
C 2252 ARG 0.670 0.468 0.704 0.650
C 2253 LEU 0.691 0.222 0.613 0.769
C 2254 LEU 0.700 0.293 0.680 0.720
C 2255 ARG 0.656 0.101 0.722 0.618
C 2256 HIS 0.701 0.489 0.762 0.661
C 2257 PHE 0.752 0.520 0.649 0.811
C 2258 ASN 0.698 0.256 0.663 0.732
C 2259 PHE 0.788 0.715 0.782 0.791
C 2260 ILE 0.521 0.163 0.387 0.656
C 2261 SER 0.599 0.007 0.544 0.710
C 2262 PHE 0.701 0.554 0.703 0.700
C 2263 THR 0.543 -0.220 0.430 0.693
C 2264 GLU 0.632 0.218 0.729 0.554
C 2265 MET 0.706 0.475 0.754 0.657
C 2266 SER 0.589 0.310 0.622 0.522
C 2267 ASP 0.532 -0.215 0.426 0.638
C 2268 SER 0.739 0.658 0.772 0.671
C 2269 SER 0.501 -0.142 0.657 0.187
C 2270 VAL 0.646 0.426 0.711 0.560
C 2271 SER 0.707 0.465 0.670 0.783
C 2272 ARG 0.695 0.387 0.705 0.688
C 2273 ILE 0.617 0.215 0.564 0.671
C 2274 PHE 0.718 0.330 0.619 0.775
C 2275 THR 0.735 0.577 0.752 0.712
C 2276 THR 0.640 0.022 0.549 0.760
C 2277 ILE 0.629 0.266 0.679 0.580
C 2278 LEU 0.531 -0.028 0.501 0.561
C 2279 GLY 0.601 0.511 0.601 N/A
C 2280 ALA 0.550 0.000 0.575 0.450
C 2281 PHE 0.699 0.516 0.710 0.693
C 2282 PHE 0.699 0.264 0.608 0.751
C 2283 ARG 0.418 -0.760 0.647 0.287
C 2284 LYS 0.633 0.317 0.639 0.628
C 2285 TYR 0.701 0.327 0.588 0.758
C 2286 PHE 0.652 0.380 0.682 0.636
C 2287 GLY 0.708 0.569 0.708 N/A
C 2288 ASP 0.419 -0.274 0.353 0.484
C 2289 ALA 0.563 0.192 0.655 0.192
C 2290 ILE 0.559 0.341 0.579 0.539
C 2291 GLN 0.610 0.013 0.538 0.667
C 2292 ALA 0.651 0.336 0.730 0.336
C 2293 LEU 0.472 0.080 0.395 0.549
C 2294 THR 0.312 0.040 0.278 0.357
C 2295 ASP 0.363 -0.543 0.546 0.179
C 2296 PRO 0.617 0.457 0.602 0.636
C 2297 VAL 0.679 0.526 0.666 0.696
C 2298 VAL 0.566 0.390 0.546 0.593
C 2299 THR 0.588 0.325 0.676 0.470
C 2300 ALA 0.586 0.358 0.642 0.358
C 2301 THR 0.628 0.290 0.669 0.574
C 2302 VAL 0.680 0.485 0.696 0.660
C 2303 ARG 0.672 0.392 0.743 0.631
C 2304 LEU 0.605 0.259 0.572 0.639
C 2305 TYR 0.588 0.196 0.554 0.605
C 2306 ASN 0.519 -0.094 0.402 0.637
C 2307 SER 0.556 0.146 0.543 0.583
C 2308 ILE 0.506 0.005 0.424 0.588
C 2309 ARG 0.586 -0.028 0.394 0.696
C 2310 ALA 0.733 0.558 0.749 0.672
C 2311 GLU 0.686 0.519 0.694 0.680
C 2312 LEU 0.678 0.467 0.706 0.651
C 2313 LEU 0.607 -0.204 0.699 0.515
C 2314 PRO 0.681 0.325 0.669 0.697
C 2315 THR 0.586 -0.081 0.667 0.478
C 2316 PRO 0.563 -0.128 0.483 0.669
C 2317 THR 0.626 0.337 0.616 0.639
C 2318 ARG 0.706 0.424 0.730 0.692
C 2319 SER 0.615 0.390 0.581 0.684
C 2320 HIS 0.657 0.432 0.628 0.677
C 2321 TYR 0.764 0.629 0.773 0.760
C 2322 THR 0.635 0.214 0.750 0.481
C 2323 PHE 0.634 0.055 0.533 0.691
C 2324 ASN 0.546 0.183 0.488 0.604
C 2325 LEU 0.714 0.562 0.697 0.730
C 2326 ARG 0.737 0.386 0.713 0.751
C 2327 ASP 0.661 0.039 0.520 0.803
C 2328 LEU 0.716 0.588 0.748 0.683
C 2329 SER 0.670 0.404 0.734 0.542
C 2330 LYS 0.597 -0.076 0.673 0.536
C 2331 VAL 0.677 0.295 0.717 0.623
C 2332 VAL 0.621 0.358 0.524 0.749
C 2333 GLN 0.777 0.468 0.713 0.828
C 2334 GLY 0.391 0.139 0.391 N/A
C 2335 VAL 0.694 0.440 0.671 0.726
C 2336 MET 0.505 -0.378 0.400 0.610
C 2337 ARG 0.587 -0.021 0.728 0.507
C 2338 ALA 0.636 0.376 0.597 0.794
C 2339 ASP 0.578 0.005 0.672 0.484
C 2340 PRO 0.452 0.118 0.520 0.361
C 2341 ARG 0.464 -0.005 0.643 0.362
C 2342 SER 0.233 -0.249 0.117 0.467
C 2343 THR 0.320 -0.112 0.075 0.646
C 2344 GLY 0.214 -0.056 0.214 N/A
C 2345 ASP 0.240 -0.301 0.422 0.059
C 2346 SER 0.688 0.426 0.675 0.713
C 2347 LYS 0.338 -0.423 0.541 0.176
C 2348 GLN 0.331 -0.352 0.749 -0.003
C 2349 VAL 0.553 0.329 0.650 0.425
C 2350 LEU 0.640 0.428 0.601 0.678
C 2351 SER 0.562 0.327 0.580 0.527
C 2352 LEU 0.618 0.445 0.562 0.674
C 2353 TRP 0.688 0.212 0.587 0.729
C 2354 LEU 0.645 0.180 0.575 0.716
C 2355 HIS 0.800 0.662 0.761 0.827
C 2356 GLU 0.645 0.050 0.495 0.765
C 2357 CYS 0.642 0.329 0.680 0.566
C 2358 SER 0.675 0.292 0.760 0.504
C 2359 ARG 0.621 0.102 0.808 0.514
C 2360 VAL 0.592 0.432 0.632 0.538
C 2361 PHE 0.650 0.203 0.762 0.585
C 2362 GLU 0.640 0.472 0.665 0.621
C 2363 ASP 0.618 0.194 0.628 0.609
C 2364 ARG 0.530 0.124 0.557 0.515
C 2365 LEU 0.708 0.360 0.693 0.723
C 2366 ILE 0.523 0.149 0.687 0.359
C 2367 ASN 0.696 0.541 0.768 0.624
C 2368 ASP 0.626 0.181 0.729 0.522
C 2369 GLU 0.733 0.637 0.727 0.739
C 2370 ASP 0.607 0.284 0.712 0.502
C 2371 HIS 0.674 0.538 0.657 0.685
C 2372 GLY 0.719 0.577 0.719 N/A
C 2373 TRP 0.657 0.323 0.509 0.716
C 2374 PHE 0.590 0.279 0.561 0.607
C 2375 ARG 0.682 0.351 0.718 0.661
C 2376 ALA 0.394 -0.386 0.346 0.583
C 2377 ARG 0.656 0.422 0.713 0.623
C 2378 GLN 0.647 0.348 0.593 0.691
C 2379 GLU 0.479 -0.337 0.586 0.394
C 2380 ALA 0.568 0.008 0.570 0.562
C 2381 LEU 0.555 -0.228 0.652 0.458
C 2382 LEU 0.558 0.048 0.544 0.572
C 2383 THR 0.530 0.185 0.537 0.521
C 2384 GLU 0.526 -0.103 0.658 0.421
C 2385 ASN 0.656 0.443 0.747 0.564
C 2386 PHE 0.620 0.301 0.542 0.664
C 2387 GLY 0.168 -0.379 0.168 N/A
C 2388 LEU 0.486 -0.039 0.319 0.652
C 2389 GLY 0.699 0.668 0.699 N/A
C 2390 TYR 0.589 0.142 0.691 0.538
C 2391 GLY 0.338 0.133 0.338 N/A
C 2392 ASP 0.403 0.025 0.572 0.233
C 2393 VAL 0.564 0.245 0.687 0.399
C 2394 VAL 0.309 -0.156 0.561 -0.029
C 2395 THR 0.538 0.389 0.582 0.478
C 2396 SER 0.502 0.258 0.539 0.427
C 2397 GLU 0.206 -0.309 0.147 0.253
C 2398 ARG 0.532 0.219 0.552 0.520
C 2399 LEU 0.584 0.301 0.423 0.745
C 2400 ILE 0.664 0.517 0.702 0.625
C 2401 PHE 0.778 0.465 0.708 0.818
C 2402 GLY 0.751 0.621 0.751 N/A
C 2403 ASP 0.341 -0.165 0.452 0.231
C 2404 PHE 0.591 0.138 0.574 0.601
C 2405 MET 0.520 0.047 0.430 0.611
C 2406 VAL 0.574 0.180 0.597 0.544
C 2407 PRO 0.666 0.439 0.632 0.712
C 2408 GLY 0.507 0.278 0.507 N/A
C 2409 ALA 0.451 0.162 0.408 0.623
C 2410 ASP 0.432 0.150 0.473 0.392
C 2411 PRO 0.438 -0.015 0.446 0.428
C 2412 ARG 0.679 0.370 0.630 0.707
C 2413 VAL 0.579 0.081 0.610 0.537
C 2414 TYR 0.667 0.428 0.634 0.683
C 2415 SER 0.435 -0.189 0.692 -0.079
C 2416 GLN 0.643 -0.086 0.456 0.793
C 2417 ILE 0.639 0.294 0.541 0.738
C 2418 THR 0.654 0.395 0.761 0.510
C 2419 ASP 0.524 0.111 0.661 0.388
C 2420 MET 0.614 0.262 0.542 0.687
C 2421 PRO 0.681 0.353 0.676 0.688
C 2422 LYS 0.383 -0.391 0.641 0.177
C 2423 LEU 0.717 0.396 0.771 0.663
C 2424 VAL 0.565 0.177 0.704 0.380
C 2425 LYS 0.574 0.165 0.733 0.447
C 2426 VAL 0.676 0.577 0.690 0.657
C 2427 VAL 0.647 0.490 0.600 0.709
C 2428 GLU 0.499 -0.177 0.710 0.331
C 2429 GLU 0.636 0.443 0.687 0.594
C 2430 TYR 0.716 0.572 0.701 0.724
C 2431 LEU 0.582 0.046 0.623 0.541
C 2432 GLU 0.574 0.368 0.706 0.469
C 2433 ASP 0.577 0.193 0.688 0.466
C 2434 TYR 0.578 0.444 0.637 0.548
C 2435 ASN 0.590 0.372 0.662 0.519
C 2436 SER 0.661 0.465 0.757 0.469
C 2437 VAL 0.481 -0.303 0.283 0.746
C 2438 SER 0.528 0.134 0.619 0.346
C 2439 SER 0.663 0.440 0.734 0.520
C 2440 ALA 0.689 0.413 0.683 0.713
C 2441 PRO 0.651 0.397 0.736 0.539
C 2442 MET 0.429 -0.452 0.618 0.239
C 2443 LYS 0.339 -0.292 0.573 0.152
C 2444 LEU 0.481 -0.094 0.746 0.215
C 2445 VAL 0.666 0.394 0.586 0.772
C 2446 MET 0.627 0.368 0.725 0.528
C 2447 PHE 0.704 0.615 0.763 0.670
C 2448 LEU 0.619 0.185 0.535 0.703
C 2449 ASP 0.595 0.353 0.620 0.570
C 2450 ALA 0.547 0.295 0.609 0.295
C 2451 ILE 0.420 0.116 0.538 0.302
C 2452 GLU 0.504 -0.397 0.625 0.407
C 2453 HIS 0.708 0.539 0.777 0.662
C 2454 VAL 0.545 0.309 0.593 0.482
C 2455 SER 0.629 0.416 0.623 0.641
C 2456 ARG 0.593 0.109 0.592 0.593
C 2457 ILE 0.586 0.152 0.516 0.656
C 2458 THR 0.609 0.266 0.513 0.736
C 2459 ARG 0.654 0.427 0.695 0.630
C 2460 VAL 0.508 0.170 0.504 0.513
C 2461 ILE 0.619 -0.081 0.517 0.721
C 2462 ARG 0.537 -0.072 0.645 0.475
C 2463 LEU 0.678 0.386 0.707 0.649
C 2464 PRO 0.548 -0.052 0.491 0.625
C 2465 ALA 0.321 -0.161 0.442 -0.161
C 2466 LEU 0.553 0.151 0.534 0.571
C 2467 ASN 0.727 0.566 0.775 0.678
C 2468 ALA 0.708 0.542 0.749 0.542
C 2469 LEU 0.696 0.488 0.668 0.724
C 2470 LEU 0.681 0.373 0.741 0.621
C 2471 LEU 0.654 0.251 0.558 0.750
C 2472 GLY 0.459 -0.049 0.459 N/A
C 2473 VAL 0.514 0.275 0.523 0.503
C 2474 GLY 0.705 0.376 0.705 N/A
C 2475 GLY 0.674 0.432 0.674 N/A
C 2476 SER 0.630 0.446 0.674 0.541
C 2477 GLY 0.367 -0.450 0.367 N/A
C 2478 ARG 0.683 0.162 0.554 0.757
C 2479 GLN 0.636 0.086 0.530 0.721
C 2480 SER 0.600 0.284 0.669 0.461
C 2481 LEU 0.682 0.587 0.678 0.686
C 2482 THR 0.593 0.137 0.496 0.722
C 2483 ARG 0.726 0.588 0.690 0.747
C 2484 LEU 0.531 -0.087 0.391 0.670
C 2485 ALA 0.619 0.384 0.678 0.384
C 2486 ALA 0.618 0.095 0.568 0.818
C 2487 TYR 0.727 0.582 0.721 0.730
C 2488 MET 0.727 0.420 0.660 0.795
C 2489 GLU 0.642 0.079 0.584 0.689
C 2490 GLU 0.560 0.179 0.667 0.474
C 2491 TYR 0.691 0.394 0.660 0.707
C 2492 ASP 0.620 0.275 0.692 0.549
C 2493 VAL 0.674 0.538 0.723 0.609
C 2494 VAL 0.635 0.389 0.600 0.681
C 2495 GLN 0.672 0.578 0.683 0.663
C 2496 ILE 0.631 0.297 0.557 0.705
C 2497 GLU 0.474 -0.111 0.647 0.336
C 2498 ILE 0.663 0.266 0.606 0.720
C 2499 ALA 0.644 0.341 0.650 0.622
C 2500 LYS 0.243 -0.312 0.353 0.155
C 2501 GLY 0.648 0.585 0.648 N/A
C 2502 TYR 0.641 0.332 0.497 0.713
C 2503 GLY 0.385 0.108 0.385 N/A
C 2504 SER 0.559 0.160 0.550 0.578
C 2505 ASN 0.603 0.395 0.581 0.624
C 2506 GLU 0.458 0.139 0.522 0.407
C 2507 TRP 0.618 0.134 0.392 0.709
C 2508 ARG 0.715 0.458 0.606 0.777
C 2509 ASP 0.647 0.130 0.696 0.599
C 2510 ASP 0.587 0.238 0.578 0.597
C 2511 LEU 0.637 0.467 0.657 0.616
C 2512 ARG 0.591 0.291 0.527 0.628
C 2513 LYS 0.626 0.441 0.647 0.609
C 2514 VAL 0.627 0.282 0.682 0.553
C 2515 LEU 0.602 0.202 0.506 0.697
C 2516 ARG 0.616 -0.185 0.747 0.542
C 2517 LYS 0.355 -0.501 0.464 0.268
C 2518 THR 0.628 0.272 0.726 0.497
C 2519 GLY 0.708 0.568 0.708 N/A
C 2520 LEU 0.517 -0.006 0.409 0.626
C 2521 ASP 0.532 0.245 0.668 0.396
C 2522 GLY 0.640 0.390 0.640 N/A
C 2523 ARG 0.706 0.492 0.697 0.712
C 2524 ASP 0.667 0.397 0.676 0.658
C 2525 THR 0.713 0.487 0.705 0.723
C 2526 VAL 0.695 0.442 0.742 0.633
C 2527 PHE 0.655 0.235 0.486 0.751
C 2528 LEU 0.630 0.451 0.644 0.616
C 2529 PHE 0.662 0.342 0.586 0.704
C 2530 THR 0.625 0.359 0.681 0.550
C 2531 ASP 0.639 0.120 0.739 0.539
C 2532 THR 0.730 0.499 0.776 0.667
C 2533 GLN 0.618 0.126 0.494 0.717
C 2534 ILE 0.677 0.387 0.629 0.725
C 2535 VAL 0.601 0.428 0.596 0.608
C 2536 GLN 0.754 0.584 0.745 0.762
C 2537 GLU 0.709 0.524 0.722 0.698
C 2538 ASN 0.499 0.108 0.546 0.452
C 2539 PHE 0.701 0.451 0.588 0.766
C 2540 LEU 0.664 0.413 0.631 0.696
C 2541 GLU 0.499 0.233 0.491 0.506
C 2542 ASP 0.686 0.503 0.682 0.689
C 2543 ILE 0.725 0.563 0.707 0.743
C 2544 ASN 0.687 0.518 0.684 0.690
C 2545 ASN 0.679 0.392 0.762 0.596
C 2546 ILE 0.735 0.663 0.692 0.777
C 2547 LEU 0.686 0.517 0.693 0.679
C 2548 ASN 0.793 0.749 0.784 0.802
C 2549 SER 0.590 0.352 0.593 0.585
C 2550 GLY 0.712 0.666 0.712 N/A
C 2551 GLU 0.499 -0.010 0.579 0.434
C 2552 VAL 0.584 0.380 0.555 0.623
C 2553 PRO 0.598 0.360 0.597 0.600
C 2554 ASN 0.746 0.617 0.746 0.747
C 2555 LEU 0.621 0.455 0.668 0.573
C 2556 TRP 0.738 0.536 0.638 0.778
C 2557 GLY 0.588 0.316 0.588 N/A
C 2558 ASN 0.515 -0.049 0.745 0.285
C 2559 ASP 0.594 0.328 0.669 0.520
C 2560 ASP 0.575 0.207 0.668 0.481
C 2561 GLN 0.619 0.237 0.702 0.553
C 2562 GLU 0.346 -0.251 0.339 0.352
C 2563 ALA 0.523 0.099 0.494 0.643
C 2564 ILE 0.541 0.186 0.627 0.455
C 2565 ALA 0.539 0.365 0.581 0.373
C 2566 ASN 0.611 0.429 0.552 0.669
C 2567 ALA 0.633 0.542 0.653 0.553
C 2568 MET 0.568 -0.073 0.482 0.654
C 2569 ARG 0.332 -0.330 0.475 0.251
C 2570 PRO 0.535 0.352 0.547 0.519
C 2571 LEU 0.486 0.214 0.595 0.376
C 2572 MET 0.260 -0.223 0.151 0.370
C 2573 ALA 0.285 -0.116 0.299 0.231
C 2574 ALA 0.567 0.415 0.603 0.421
C 2575 ALA 0.420 0.012 0.522 0.012
C 2576 GLY -0.030 -0.536 -0.030 N/A
C 2577 LEU 0.483 0.049 0.511 0.455
C 2578 PRO 0.582 0.352 0.617 0.535
C 2579 ILE 0.626 0.463 0.685 0.566
C 2580 THR 0.498 0.016 0.628 0.326
C 2581 LYS 0.478 0.027 0.509 0.453
C 2582 MET 0.506 0.116 0.637 0.375
C 2583 GLY 0.110 -0.274 0.110 N/A
C 2584 ILE 0.582 0.456 0.586 0.579
C 2585 SER 0.614 0.258 0.721 0.400
C 2586 THR 0.618 0.254 0.630 0.603
C 2587 PHE 0.580 0.299 0.662 0.534
C 2588 PHE 0.630 0.174 0.527 0.690
C 2589 ILE 0.561 0.137 0.548 0.573
C 2590 ASN 0.541 0.143 0.600 0.481
C 2591 ARG 0.637 0.177 0.637 0.638
C 2592 VAL 0.586 0.010 0.504 0.696
C 2593 ARG 0.581 0.196 0.725 0.498
C 2594 SER 0.609 0.316 0.682 0.463
C 2595 TYR 0.598 0.453 0.612 0.591
C 2596 LEU 0.630 0.510 0.639 0.621
C 2597 HIS 0.744 0.535 0.676 0.789
C 2598 VAL 0.687 0.611 0.686 0.689
C 2599 VAL 0.582 0.250 0.439 0.772
C 2600 LEU 0.645 0.498 0.654 0.635
C 2601 CYS 0.767 0.655 0.781 0.738
C 2602 PHE 0.675 0.467 0.683 0.670
C 2603 SER 0.655 0.317 0.730 0.504
C 2604 PRO 0.721 0.515 0.669 0.790
C 2605 ILE 0.687 0.511 0.690 0.684
C 2606 GLY 0.609 0.528 0.609 N/A
C 2607 ASP 0.514 0.225 0.623 0.405
C 2608 ALA 0.619 0.428 0.667 0.428
C 2609 PHE 0.649 0.295 0.577 0.691
C 2610 ARG 0.690 0.550 0.785 0.636
C 2611 GLN 0.582 0.159 0.761 0.439
C 2612 ARG 0.734 0.455 0.692 0.758
C 2613 LEU 0.700 0.511 0.720 0.680
C 2614 ARG 0.661 0.215 0.676 0.652
C 2615 MET 0.700 0.559 0.758 0.642
C 2616 PHE 0.738 0.459 0.684 0.769
C 2617 PRO 0.738 0.273 0.674 0.823
C 2618 SER 0.502 -0.117 0.452 0.601
C 2619 LEU 0.683 0.333 0.632 0.733
C 2620 VAL 0.712 0.497 0.702 0.724
C 2621 ASN 0.714 0.372 0.727 0.701
C 2622 CYS 0.684 0.554 0.689 0.675
C 2623 CYS 0.738 0.645 0.695 0.823
C 2624 THR 0.554 -0.023 0.439 0.709
C 2625 ILE 0.595 0.427 0.619 0.571
C 2626 ASP 0.671 0.220 0.790 0.552
C 2627 TRP 0.507 0.239 0.454 0.528
C 2628 PHE 0.678 0.422 0.719 0.655
C 2629 ARG 0.585 0.167 0.642 0.552
C 2630 GLU 0.590 0.272 0.607 0.576
C 2631 TRP 0.670 -0.133 0.453 0.756
C 2632 PRO 0.652 0.508 0.619 0.695
C 2633 GLU 0.629 0.514 0.587 0.662
C 2634 GLU 0.451 -0.096 0.653 0.288
C 2635 ALA 0.616 0.395 0.671 0.395
C 2636 LEU 0.623 0.339 0.526 0.719
C 2637 ARG 0.657 0.298 0.764 0.596
C 2638 SER 0.675 0.463 0.665 0.695
C 2639 VAL 0.607 0.459 0.651 0.549
C 2640 ALA 0.431 0.104 0.375 0.659
C 2641 ASP 0.583 0.224 0.718 0.448
C 2642 SER 0.715 0.628 0.752 0.639
C 2643 PHE 0.689 0.434 0.650 0.711
C 2644 TYR 0.716 0.464 0.613 0.768
C 2645 GLY 0.648 0.437 0.648 N/A
C 2646 ASP 0.348 -0.495 0.604 0.092
C 2647 VAL 0.297 -0.358 0.477 0.056
C 2648 ASP 0.325 -0.096 0.448 0.203
C 2649 PHE 0.467 0.140 0.324 0.548
C 2650 GLY 0.454 0.187 0.454 N/A
C 2651 ASP 0.368 0.085 0.440 0.296
C 2652 ASP 0.438 -0.263 0.552 0.324
C 2653 THR 0.075 -0.696 -0.016 0.195
C 2654 GLY 0.513 -0.182 0.513 N/A
C 2655 ALA 0.643 0.373 0.710 0.373
C 2656 ILE 0.293 -0.685 0.084 0.502
C 2657 MET 0.570 0.029 0.524 0.616
C 2658 ALA 0.510 -0.178 0.433 0.815
C 2659 GLY 0.416 -0.159 0.416 N/A
C 2660 VAL 0.525 0.073 0.465 0.604
C 2661 VAL 0.540 -0.397 0.368 0.770
C 2662 ASP 0.579 -0.014 0.746 0.412
C 2663 CYS 0.504 0.186 0.446 0.622
C 2664 CYS 0.687 0.372 0.671 0.719
C 2665 VAL 0.380 -0.237 0.156 0.679
C 2666 GLY 0.574 0.067 0.574 N/A
C 2667 VAL 0.437 -0.236 0.288 0.636
C 2668 HIS 0.744 0.517 0.689 0.781
C 2669 GLN 0.518 0.269 0.534 0.505
C 2670 SER 0.453 -0.254 0.438 0.483
C 2671 VAL 0.497 -0.235 0.367 0.672
C 2672 GLU 0.507 -0.055 0.528 0.490
C 2673 LYS 0.593 0.384 0.585 0.599
C 2674 LYS 0.486 -0.158 0.286 0.646
C 2675 SER 0.718 0.480 0.739 0.677
C 2676 LYS 0.365 -0.223 0.412 0.328
C 2677 LYS 0.521 0.053 0.538 0.507
C 2678 PHE 0.702 0.332 0.694 0.706
C 2679 TYR 0.635 0.350 0.632 0.636
C 2680 ASP 0.321 -0.228 0.443 0.199
C 2681 GLU 0.434 0.061 0.408 0.454
C 2682 LEU 0.521 -0.115 0.663 0.380
C 2683 ARG 0.694 0.412 0.743 0.666
C 2684 ARG 0.751 0.525 0.724 0.766
C 2685 TYR 0.403 -0.399 0.511 0.349
C 2686 ASN 0.596 -0.117 0.505 0.687
C 2687 TYR 0.673 0.522 0.643 0.687
C 2688 VAL 0.552 0.132 0.641 0.434
C 2689 THR 0.428 -0.318 0.535 0.284
C 2690 PRO 0.702 0.362 0.801 0.569
C 2691 THR 0.612 0.344 0.568 0.671
C 2692 SER 0.448 -0.325 0.365 0.612
C 2693 TYR 0.599 0.247 0.585 0.606
C 2694 LEU 0.707 0.521 0.796 0.619
C 2695 GLU 0.775 0.712 0.782 0.769
C 2696 LEU 0.579 0.287 0.567 0.592
C 2697 LEU 0.713 0.530 0.702 0.724
C 2698 THR 0.569 0.018 0.426 0.759
C 2699 THR -0.018 -0.578 0.067 -0.131
C 2700 PHE 0.628 0.246 0.635 0.624
C 2701 ILE 0.554 0.137 0.544 0.565
C 2702 LYS 0.549 -0.203 0.730 0.404
C 2703 LEU 0.411 -0.434 0.226 0.597
C 2704 LEU 0.682 0.475 0.706 0.658
C 2705 GLY 0.437 -0.070 0.437 N/A
C 2706 GLU 0.683 0.374 0.765 0.617
C 2707 LYS 0.547 0.211 0.619 0.489
C 2708 ARG 0.596 0.406 0.554 0.619
C 2709 THR 0.565 0.111 0.518 0.628
C 2710 GLU 0.540 0.101 0.577 0.510
C 2711 ILE 0.398 -0.119 0.462 0.334
C 2712 ALA 0.351 -0.344 0.320 0.473
C 2713 GLU 0.441 -0.023 0.585 0.326
C 2714 LYS 0.302 -0.024 0.242 0.351
C 2715 ARG 0.426 -0.478 0.589 0.333
C 2716 ARG 0.306 -0.147 0.384 0.261
C 2717 ARG 0.605 0.029 0.612 0.601
C 2718 LEU 0.517 0.160 0.477 0.557
C 2719 GLU 0.460 0.035 0.432 0.482
C 2720 VAL 0.354 -0.050 0.524 0.128
C 2721 GLY 0.443 -0.076 0.443 N/A
C 2722 LEU 0.175 -0.300 0.218 0.132
C 2723 GLN 0.228 -0.725 0.271 0.194
C 2724 LYS 0.460 -0.229 0.284 0.600
C 2725 LEU 0.435 0.299 0.424 0.446
C 2726 LEU 0.332 -0.349 0.096 0.569
C 2727 ASN 0.248 -0.314 0.122 0.374
C 2728 THR 0.650 0.196 0.726 0.549
C 2729 ALA 0.314 -0.359 0.305 0.347
C 2730 GLY 0.497 0.204 0.497 N/A
C 2731 GLN 0.424 -0.090 0.395 0.447
C 2732 VAL 0.331 -0.244 0.245 0.446
C 2733 GLU 0.086 -0.514 0.064 0.104
C 2734 VAL 0.006 -0.631 0.162 -0.201
C 2735 MET 0.301 -0.158 0.369 0.233
C 2736 GLN 0.106 -0.512 0.366 -0.102
C 2737 LYS 0.061 -0.176 0.115 0.018
C 2738 GLU 0.051 -0.773 0.400 -0.228
C 2739 LEU 0.026 -0.434 -0.130 0.183
C 2740 GLN -0.085 -0.619 -0.071 -0.096
C 2741 GLU -0.240 -0.703 -0.091 -0.359
C 2742 LEU -0.018 -0.596 0.064 -0.100
C 2743 GLN 0.175 -0.546 -0.014 0.326
C 2744 PRO 0.154 -0.226 0.093 0.237
C 2745 VAL 0.054 -0.381 0.006 0.117
C 2746 LEU 0.154 -0.626 0.100 0.208
C 2747 ALA 0.057 -0.322 0.152 -0.322
C 2748 ALA 0.226 0.046 0.204 0.316
C 2749 THR -0.018 -0.650 -0.015 -0.022
C 2750 ALA -0.187 -0.654 -0.310 0.304
C 2751 LYS 0.129 -0.333 0.021 0.216
C 2752 GLU -0.099 -0.706 -0.180 -0.035
C 2753 VAL -0.169 -0.642 -0.245 -0.068
C 2754 GLU 0.134 -0.482 0.080 0.177
C 2755 ASP 0.077 -0.841 0.199 -0.044
C 2756 MET 0.265 -0.624 0.012 0.519
C 2757 MET 0.044 -0.618 -0.233 0.322
C 2758 VAL 0.129 -0.483 0.284 -0.078
C 2759 VAL 0.117 -0.543 -0.091 0.393
C 2760 ILE 0.185 -0.656 0.114 0.256
C 2761 THR -0.011 -0.628 0.335 -0.471
C 2762 ASN -0.111 -0.873 -0.097 -0.124
C 2763 ASP 0.041 -0.682 -0.065 0.147
C 2764 LYS -0.044 -0.463 -0.088 -0.008
C 2765 LYS -0.031 -0.607 0.066 -0.108
C 2766 GLU "N/A" "N\A" "N/A" "N/A"
Traceback (most recent call last):
File "/home/em301/.local/share/ChimeraX/1.12/lib/python3.11/site-
packages/chimerax/qscore/ui.py", line 248, in recalc
residue_map, (query_atoms, atom_scores) = run_chimerax_command(self.session,
f'qscore #{m.id_string} to #{v.id_string} useGui false pointsPerShell
{self.points_per_shell} shellRadiusStep {self.shell_radius_step:.3f}
maxShellRadius {self.max_shell_radius:.2f} referenceGaussianSigma
{self.reference_sigma:.2f} logDetails {log_details} {outputfile_text}
assignAttr {self.assign_attr}', log=echo_command)
^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^
File "/usr/lib/ucsf-chimerax/lib/python3.11/site-
packages/chimerax/core/commands/run.py", line 49, in run
results = command.run(text, log=log, return_json=return_json)
^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^
File "/usr/lib/ucsf-chimerax/lib/python3.11/site-
packages/chimerax/core/commands/cli.py", line 3245, in run
result = ci.function(session, **kw_args)
^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^
File "/home/em301/.local/share/ChimeraX/1.12/lib/python3.11/site-
packages/chimerax/qscore/cmd.py", line 40, in qscore
residue_map, (query_atoms, atom_scores) = q_score(residues, to_volume,
ref_sigma=reference_gaussian_sigma,
^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^
File "/home/em301/.local/share/ChimeraX/1.12/lib/python3.11/site-
packages/chimerax/qscore/qscore.py", line 256, in q_score
report_results(residue_scores, query_atoms, q_scores, oob_residues,
log=log_details, filename=output_file)
File "/home/em301/.local/share/ChimeraX/1.12/lib/python3.11/site-
packages/chimerax/qscore/qscore.py", line 287, in report_results
qavg, qworst = scores
^^^^^^^^^^^^
TypeError: cannot unpack non-iterable NoneType object
TypeError: cannot unpack non-iterable NoneType object
File "/home/em301/.local/share/ChimeraX/1.12/lib/python3.11/site-
packages/chimerax/qscore/qscore.py", line 287, in report_results
qavg, qworst = scores
^^^^^^^^^^^^
See log for complete Python traceback.
OpenGL version: 3.3.0 NVIDIA 580.173.02
OpenGL renderer: NVIDIA GeForce RTX 3090/PCIe/SSE2
OpenGL vendor: NVIDIA Corporation
Python: 3.11.13
Locale: en_US.UTF-8
Qt version: PyQt6 6.10.2, Qt 6.10.0
Qt runtime version: 6.10.2
Qt platform: xcb
XDG_SESSION_TYPE=x11
DESKTOP_SESSION=ubuntu
XDG_SESSION_DESKTOP=ubuntu
XDG_CURRENT_DESKTOP=ubuntu:GNOME
DISPLAY=:1
Manufacturer: Micro-Star International Co., Ltd.
Model: MS-7D54
OS: Ubuntu 22.04
Architecture: 64bit ELF
Virtual Machine: none
CPU: 16 AMD Ryzen 7 5700X 8-Core Processor
Cache Size: 512 KB
Memory:
total used free shared buff/cache available
Mem: 125Gi 10Gi 10Gi 91Mi 104Gi 113Gi
Swap: 2.0Gi 1.4Gi 579Mi
Graphics:
2d:00.0 VGA compatible controller [0300]: NVIDIA Corporation GA102 [GeForce RTX 3090] [10de:2204] (rev a1)
Subsystem: Palit Microsystems Inc. GA102 [GeForce RTX 3090] [1569:2204]
Kernel driver in use: nvidia
Installed Packages:
accessible-pygments: 0.0.5
aiohappyeyeballs: 2.6.2
aiohttp: 3.13.4
aiosignal: 1.4.0
alabaster: 1.0.0
annotated-types: 0.7.0
anyio: 4.13.0
appdirs: 1.4.4
asttokens: 3.0.1
attrs: 26.1.0
babel: 2.18.0
beautifulsoup4: 4.13.5
blockdiag: 3.0.0
blosc2: 4.4.3
bs4: 0.0.2
build: 1.3.0
certifi: 2026.5.20
cftime: 1.6.5
charset-normalizer: 3.4.7
ChimeraX-AddCharge: 1.5.20
ChimeraX-AddH: 2.2.8
ChimeraX-AlignmentAlgorithms: 2.0.2
ChimeraX-AlignmentHdrs: 3.6.2
ChimeraX-AlignmentMatrices: 2.1
ChimeraX-Alignments: 3.2
ChimeraX-AlphaFold: 1.0.1
ChimeraX-AltlocExplorer: 1.2
ChimeraX-AmberInfo: 1.0
ChimeraX-Animations: 1.0
ChimeraX-Aniso: 1.3.2
ChimeraX-Arrays: 1.1
ChimeraX-Atomic: 1.67.1
ChimeraX-AtomicLibrary: 14.4
ChimeraX-AtomSearch: 2.0.1
ChimeraX-AxesPlanes: 2.4
ChimeraX-BasicActions: 1.1.3
ChimeraX-BILD: 1.0
ChimeraX-BlastProtein: 3.0.0
ChimeraX-Boltz: 1.1
ChimeraX-BondRot: 2.0.4
ChimeraX-BugReporter: 1.0.2
ChimeraX-BuildStructure: 2.13.1
ChimeraX-Bumps: 1.0
ChimeraX-BundleBuilder: 1.6.0
ChimeraX-ButtonPanel: 1.0.1
ChimeraX-CageBuilder: 1.0.1
ChimeraX-CellPack: 1.0
ChimeraX-Centroids: 1.4.1
ChimeraX-ChangeChains: 1.1
ChimeraX-CheckWaters: 1.5
ChimeraX-ChemGroup: 2.0.2
ChimeraX-Clashes: 2.4
ChimeraX-Clipper: 0.27
ChimeraX-Cluster: 1.0
ChimeraX-ColorActions: 1.0.5
ChimeraX-ColorGlobe: 1.0
ChimeraX-ColorKey: 1.5.8
ChimeraX-CommandLine: 1.3.1
ChimeraX-ConnectStructure: 2.0.1
ChimeraX-Contacts: 1.0.1
ChimeraX-Core: 1.12
ChimeraX-CoreFormats: 1.2
ChimeraX-coulombic: 1.4.5
ChimeraX-Crosslinks: 1.0
ChimeraX-Crystal: 1.0
ChimeraX-CrystalContacts: 1.0.1
ChimeraX-DataFormats: 1.2.4
ChimeraX-Dicom: 1.2.7
ChimeraX-DistMonitor: 1.4.2
ChimeraX-DockPrep: 1.2.2
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: 1.4.1
ChimeraX-Hbonds: 2.5.3
ChimeraX-Help: 1.3
ChimeraX-HKCage: 1.3
ChimeraX-IHM: 1.1
ChimeraX-ImageFormats: 1.2
ChimeraX-IMOD: 1.0
ChimeraX-IO: 1.0.4
ChimeraX-ISOLDE: 1.12.0
ChimeraX-ItemsInspection: 1.0.1
ChimeraX-IUPAC: 1.0
ChimeraX-KVFinder: 1.8.2
ChimeraX-Label: 1.5
ChimeraX-LightingGUI: 1.0
ChimeraX-LinuxSupport: 1.0.1
ChimeraX-ListInfo: 1.3.1
ChimeraX-Log: 1.2.2
ChimeraX-LookingGlass: 1.1
ChimeraX-Maestro: 1.9.3
ChimeraX-Map: 1.3
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-MatchAlign: 1.2
ChimeraX-MatchMaker: 2.4.1
ChimeraX-MCopy: 1.0
ChimeraX-MCPServer: 0.2.0
ChimeraX-MDcrds: 2.19
ChimeraX-MedicalToolbar: 1.1
ChimeraX-Meeting: 1.0.1
ChimeraX-Minimize: 1.3.9
ChimeraX-MLP: 1.1.1
ChimeraX-mmCIF: 2.16
ChimeraX-MMTF: 2.2
ChimeraX-ModelArchive: 1.0
ChimeraX-Modeller: 1.5.23
ChimeraX-ModelPanel: 1.6.1
ChimeraX-ModelSeries: 1.0.1
ChimeraX-Mol2: 2.0.3
ChimeraX-Mole: 1.0
ChimeraX-Morph: 1.0.2
ChimeraX-MouseModes: 1.2
ChimeraX-Movie: 1.0.1
ChimeraX-MutationScores: 1.0
ChimeraX-Neuron: 1.0
ChimeraX-Nifti: 1.2
ChimeraX-NMRSTAR: 1.0.2
ChimeraX-NRRD: 1.2
ChimeraX-Nucleotides: 2.0.3
ChimeraX-OpenCommand: 1.15.4
ChimeraX-OpenFold: 1.0
ChimeraX-OrthoPick: 1.0.1
ChimeraX-PDB: 2.7.13
ChimeraX-PDBBio: 1.0.1
ChimeraX-PDBLibrary: 1.0.5
ChimeraX-PDBMatrices: 1.0
ChimeraX-PickBlobs: 1.0.1
ChimeraX-Positions: 1.0
ChimeraX-PresetMgr: 1.1.4
ChimeraX-ProfileGrids: 1.6
ChimeraX-PubChem: 2.2
ChimeraX-QScore: 1.2
ChimeraX-ReadPbonds: 1.0.1
ChimeraX-Registration: 1.1.2
ChimeraX-RemoteControl: 1.0
ChimeraX-RenderByAttr: 1.8.2
ChimeraX-RenumberResidues: 1.1
ChimeraX-ResidueFit: 1.0.1
ChimeraX-RestServer: 1.3.3
ChimeraX-RNALayout: 1.0
ChimeraX-RotamerLibMgr: 4.0
ChimeraX-RotamerLibsDunbrack: 2.0
ChimeraX-RotamerLibsDynameomics: 2.0
ChimeraX-RotamerLibsRichardson: 2.0
ChimeraX-SaveCommand: 1.5.2
ChimeraX-Scenes: 0.3.1
ChimeraX-SchemeMgr: 1.0
ChimeraX-SDF: 2.0.3
ChimeraX-Segger: 1.0
ChimeraX-Segment: 1.0.1
ChimeraX-Segmentations: 3.5.12
ChimeraX-SelInspector: 1.0
ChimeraX-SeqView: 2.18
ChimeraX-Shape: 1.1
ChimeraX-Shell: 1.0.1
ChimeraX-Shortcuts: 1.2.1
ChimeraX-ShowSequences: 1.0.3
ChimeraX-SideView: 1.0.1
ChimeraX-SimilarStructures: 1.0.1
ChimeraX-Smiles: 2.1.2
ChimeraX-SmoothLines: 1.0
ChimeraX-SNFG: 1.0
ChimeraX-SpaceNavigator: 1.0
ChimeraX-StdCommands: 1.19.3
ChimeraX-STL: 1.0.1
ChimeraX-Storm: 1.0
ChimeraX-StructMeasure: 1.2.1
ChimeraX-Struts: 1.0.1
ChimeraX-Surface: 1.0.1
ChimeraX-SwapAA: 2.0.1
ChimeraX-SwapRes: 2.5.3
ChimeraX-TapeMeasure: 1.0
ChimeraX-TaskManager: 1.0
ChimeraX-Test: 1.0
ChimeraX-Toolbar: 1.2.4
ChimeraX-ToolshedUtils: 1.2.4
ChimeraX-Topography: 1.0
ChimeraX-ToQuest: 1.0
ChimeraX-Tug: 1.0.1
ChimeraX-UI: 1.50.8
ChimeraX-Umap: 1.0
ChimeraX-uniprot: 2.3.2
ChimeraX-UnitCell: 1.0.1
ChimeraX-ViewDock: 1.6.2
ChimeraX-VIPERdb: 1.0
ChimeraX-Vive: 1.1
ChimeraX-VolumeMenu: 1.0.1
ChimeraX-vrml: 1.0
ChimeraX-VTK: 1.0
ChimeraX-WavefrontOBJ: 1.0
ChimeraX-WebCam: 1.0.2
ChimeraX-WebServices: 1.1.5
ChimeraX-Zone: 1.0.1
click: 8.4.1
colorama: 0.4.6
comm: 0.2.3
contourpy: 1.3.3
coverage: 7.14.1
cxservices: 1.2.3
cycler: 0.12.1
Cython: 3.2.4
debugpy: 1.8.21
decorator: 5.3.1
distro: 1.9.0
docutils: 0.21.2
executing: 2.2.1
filelock: 3.19.1
fonttools: 4.63.0
frozenlist: 1.8.0
funcparserlib: 2.0.0a0
glfw: 2.10.0
grako: 3.16.5
h11: 0.16.0
h5py: 3.16.0
html2text: 2025.4.15
httpcore: 1.0.9
httpx: 0.28.1
httpx-sse: 0.4.3
idna: 3.18
ihm: 2.2
imagecodecs: 2024.6.1
imagesize: 2.0.0
iniconfig: 2.3.0
ipykernel: 7.1.0
ipython: 9.9.0
ipython_pygments_lexers: 1.1.1
jedi: 0.19.2
Jinja2: 3.1.6
jsonschema: 4.26.0
jsonschema-specifications: 2025.9.1
jupyter_client: 8.8.0
jupyter_core: 5.9.1
kiwisolver: 1.5.0
line_profiler: 5.0.0
lxml: 6.0.2
lz4: 4.3.2
Markdown: 3.8.2
MarkupSafe: 3.0.3
matplotlib: 3.10.7
matplotlib-inline: 0.2.2
mcp: 1.18.0
msgpack: 1.1.1
multidict: 6.7.1
narwhals: 2.22.1
ndindex: 1.10.1
nest-asyncio: 1.6.0
netCDF4: 1.6.5
networkx: 3.3
nibabel: 5.2.0
nptyping: 2.5.0
numexpr: 2.14.1
numpy: 1.26.4
nvidia-nvjitlink-cu12: 12.9.86
OpenMM: 8.4.0
OpenMM-CUDA-12: 8.4.0
openvr: 1.26.701
packaging: 25.0
ParmEd: 4.2.2
parso: 0.8.7
pep517: 0.13.1
pexpect: 4.9.0
pickleshare: 0.7.5
pillow: 11.3.0
pip: 25.2
pkginfo: 1.12.1.2
platformdirs: 4.10.0
plotly: 6.8.0
pluggy: 1.6.0
prompt_toolkit: 3.0.52
propcache: 0.5.2
psutil: 7.0.0
ptyprocess: 0.7.0
pure_eval: 0.2.3
py-cpuinfo: 9.0.0
pybind11: 3.0.1
pycollada: 0.8
pydantic: 2.13.4
pydantic-settings: 2.14.1
pydantic_core: 2.46.4
pydata-sphinx-theme: 0.18.0
pydicom: 2.4.4
Pygments: 2.18.0
pynmrstar: 3.5.1
pynrrd: 1.0.0
PyOpenGL: 3.1.10
PyOpenGL-accelerate: 3.1.10
pyopenxr: 1.1.4501
pyparsing: 3.3.2
pyproject_hooks: 1.2.0
PyQt6: 6.10.2
PyQt6-Qt6: 6.10.2
PyQt6-WebEngine: 6.10.0
PyQt6-WebEngine-Qt6: 6.10.2
PyQt6_sip: 13.10.3
pytest: 9.0.3
pytest-cov: 7.1.0
python-dateutil: 2.9.0.post0
python-dotenv: 1.2.2
python-multipart: 0.0.32
pyzmq: 27.1.0
qtconsole: 5.7.0
QtPy: 2.4.3
qtshim: 1.2.2
RandomWords: 0.4.0
referencing: 0.37.0
requests: 2.32.5
roman-numerals: 4.1.0
rpds-py: 2026.5.1
scipy: 1.14.0
setuptools: 80.9.0
sfftk-rw: 0.8.1
six: 1.17.0
snowballstemmer: 3.1.1
sortedcontainers: 2.4.0
soupsieve: 2.8.4
Sphinx: 9.0.4
sphinx-autodoc-typehints: 3.6.1
sphinxcontrib-applehelp: 2.0.0
sphinxcontrib-blockdiag: 3.0.0
sphinxcontrib-devhelp: 2.0.0
sphinxcontrib-htmlhelp: 2.1.0
sphinxcontrib-jsmath: 1.0.1
sphinxcontrib-qthelp: 2.0.0
sphinxcontrib-serializinghtml: 2.0.0
sse-starlette: 3.4.4
stack-data: 0.6.3
starlette: 1.3.0
superqt: 0.7.6
tables: 3.10.2
tcia_utils: 3.2.1
threadpoolctl: 3.6.0
tifffile: 2025.3.13
tinyarray: 1.2.5
tornado: 6.5.7
tqdm: 4.68.2
traitlets: 5.14.3
typing-inspection: 0.4.2
typing_extensions: 4.15.0
Unidecode: 1.4.0
urllib3: 2.7.0
uvicorn: 0.49.0
wcwidth: 0.8.1
webcolors: 24.11.1
wheel: 0.45.1
wheel-filename: 1.4.2
yarl: 1.24.2
Change History (1)
comment:1 by , 15 hours ago
| Component: | Unassigned → Third Party |
|---|---|
| Owner: | set to |
| Platform: | → all |
| Project: | → ChimeraX |
| Status: | new → assigned |
| Summary: | ChimeraX bug report submission → QScore: 'scores' is None |
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