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lib_40_z_6.txt
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501 lines (496 loc) · 15.2 KB
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*******************************************************************************
*
* Library of 40 fragments, each 6 residues long
*
*******************************************************************************
*******************************************************************************
* REFERENCE
*******************************************************************************
*
* If you use this data in research, please cite:
*
* Rachel Kolodny, Patrice Koehl, Leonidas Guibas, Michael Levitt
* Small Libraries of Protein Fragments Accurately Model Native Protein
* Structures
*******************************************************************************
******************************************************************************
* Cluster number: 0
* Size (out of 1.0): 0.035327
* Centeroid fragment (coordinates of CA atoms):
* X-coor Y-coor Z-coor
------ ------ ------
21.197 10.721 47.846
18.952 9.107 50.431
17.373 12.485 51.169
16.378 13.323 47.581
12.751 12.667 46.642
12.404 11.675 43.041
******************************************************************************
* Cluster number: 1
* Size (out of 1.0): 0.266729
* Centeroid fragment (coordinates of CA atoms):
* X-coor Y-coor Z-coor
------ ------ ------
20.807 11.164 48.300
17.644 9.109 48.876
15.884 12.165 50.397
16.858 14.365 47.431
15.598 11.757 44.934
12.265 11.418 46.772
******************************************************************************
* Cluster number: 2
* Size (out of 1.0): 0.030467
* Centeroid fragment (coordinates of CA atoms):
* X-coor Y-coor Z-coor
------ ------ ------
20.671 9.126 46.654
19.029 11.488 49.118
15.423 10.868 50.389
14.365 14.404 49.218
15.575 13.759 45.690
13.993 10.333 45.641
******************************************************************************
* Cluster number: 3
* Size (out of 1.0): 0.028598
* Centeroid fragment (coordinates of CA atoms):
* X-coor Y-coor Z-coor
------ ------ ------
22.898 10.669 49.119
20.017 9.626 51.363
17.636 12.255 49.952
14.498 11.193 48.073
13.592 13.402 45.104
10.415 12.833 43.100
******************************************************************************
* Cluster number: 4
* Size (out of 1.0): 0.025234
* Centeroid fragment (coordinates of CA atoms):
* X-coor Y-coor Z-coor
------ ------ ------
21.198 10.948 48.497
17.993 9.197 49.557
16.493 12.478 50.755
16.878 14.045 47.323
15.109 11.209 45.494
11.384 12.101 45.084
******************************************************************************
* Cluster number: 5
* Size (out of 1.0): 0.011215
* Centeroid fragment (coordinates of CA atoms):
* X-coor Y-coor Z-coor
------ ------ ------
20.709 9.569 46.785
19.771 10.138 50.391
17.231 12.764 49.331
13.516 12.092 49.661
12.712 13.769 46.310
15.114 11.647 44.232
******************************************************************************
* Cluster number: 6
* Size (out of 1.0): 0.137009
* Centeroid fragment (coordinates of CA atoms):
* X-coor Y-coor Z-coor
------ ------ ------
23.310 9.342 52.055
21.034 11.128 49.557
17.209 11.123 49.486
15.575 12.262 46.223
11.880 13.200 46.358
10.047 12.922 43.031
******************************************************************************
* Cluster number: 7
* Size (out of 1.0): 0.007290
* Centeroid fragment (coordinates of CA atoms):
* X-coor Y-coor Z-coor
------ ------ ------
18.938 10.265 46.409
18.198 9.442 50.055
17.744 13.063 51.147
15.773 14.285 48.164
13.723 11.167 47.312
14.679 11.757 43.623
******************************************************************************
* Cluster number: 8
* Size (out of 1.0): 0.014206
* Centeroid fragment (coordinates of CA atoms):
* X-coor Y-coor Z-coor
------ ------ ------
19.442 10.237 46.671
19.998 10.372 50.433
17.237 12.957 51.020
14.581 10.974 49.186
14.196 13.554 46.392
13.601 11.884 43.008
******************************************************************************
* Cluster number: 9
* Size (out of 1.0): 0.014019
* Centeroid fragment (coordinates of CA atoms):
* X-coor Y-coor Z-coor
------ ------ ------
19.527 10.718 46.546
17.329 9.295 49.299
17.479 12.644 51.150
16.322 14.506 48.039
13.470 12.029 47.496
14.928 10.787 44.180
******************************************************************************
* Cluster number: 10
* Size (out of 1.0): 0.006355
* Centeroid fragment (coordinates of CA atoms):
* X-coor Y-coor Z-coor
------ ------ ------
22.224 9.129 48.585
20.399 11.629 50.801
17.220 12.595 48.930
14.223 10.259 48.647
12.041 12.768 46.691
12.947 13.598 43.056
******************************************************************************
* Cluster number: 11
* Size (out of 1.0): 0.003551
* Centeroid fragment (coordinates of CA atoms):
* X-coor Y-coor Z-coor
------ ------ ------
18.368 9.139 47.242
20.520 10.918 49.807
17.387 12.121 51.570
15.856 13.806 48.506
12.889 12.370 46.562
14.034 11.624 43.023
******************************************************************************
* Cluster number: 12
* Size (out of 1.0): 0.019065
* Centeroid fragment (coordinates of CA atoms):
* X-coor Y-coor Z-coor
------ ------ ------
20.488 8.696 47.241
19.678 11.749 49.363
16.440 11.560 51.386
14.405 13.963 49.238
15.425 12.724 45.794
12.618 11.287 43.689
******************************************************************************
* Cluster number: 13
* Size (out of 1.0): 0.025047
* Centeroid fragment (coordinates of CA atoms):
* X-coor Y-coor Z-coor
------ ------ ------
22.411 9.119 49.591
19.154 9.884 47.700
17.270 13.082 48.557
13.652 13.076 49.747
12.430 13.958 46.254
14.139 10.860 44.861
******************************************************************************
* Cluster number: 14
* Size (out of 1.0): 0.016075
* Centeroid fragment (coordinates of CA atoms):
* X-coor Y-coor Z-coor
------ ------ ------
21.582 8.139 49.392
19.583 11.186 48.270
17.643 13.139 50.888
14.821 13.810 48.409
12.667 11.211 46.662
12.758 12.494 43.090
******************************************************************************
* Cluster number: 15
* Size (out of 1.0): 0.021308
* Centeroid fragment (coordinates of CA atoms):
* X-coor Y-coor Z-coor
------ ------ ------
23.429 9.515 49.589
19.826 10.382 50.463
16.885 10.838 48.055
14.964 13.972 49.018
12.417 13.894 46.144
11.533 11.376 43.441
******************************************************************************
* Cluster number: 16
* Size (out of 1.0): 0.003364
* Centeroid fragment (coordinates of CA atoms):
* X-coor Y-coor Z-coor
------ ------ ------
18.589 8.115 46.990
18.969 11.721 48.059
17.346 13.044 51.203
14.536 14.364 49.053
13.917 11.007 47.380
15.698 11.726 44.025
******************************************************************************
* Cluster number: 17
* Size (out of 1.0): 0.026916
* Centeroid fragment (coordinates of CA atoms):
* X-coor Y-coor Z-coor
------ ------ ------
23.168 9.839 49.613
19.380 9.679 49.558
17.277 12.200 47.643
13.977 12.695 49.461
12.398 14.259 46.402
12.854 11.305 44.033
******************************************************************************
* Cluster number: 18
* Size (out of 1.0): 0.008037
* Centeroid fragment (coordinates of CA atoms):
* X-coor Y-coor Z-coor
------ ------ ------
20.332 11.073 47.360
18.211 9.037 49.767
16.594 12.103 51.274
16.363 14.380 48.244
15.539 12.378 45.109
12.016 11.007 44.955
******************************************************************************
* Cluster number: 19
* Size (out of 1.0): 0.007850
* Centeroid fragment (coordinates of CA atoms):
* X-coor Y-coor Z-coor
------ ------ ------
21.050 8.895 47.596
20.340 11.457 50.327
17.055 12.828 49.001
13.802 10.839 49.101
11.943 12.962 46.555
14.865 12.996 44.129
******************************************************************************
* Cluster number: 20
* Size (out of 1.0): 0.020000
* Centeroid fragment (coordinates of CA atoms):
* X-coor Y-coor Z-coor
------ ------ ------
22.256 9.993 48.578
20.265 10.697 51.752
17.346 12.334 49.921
14.380 10.930 47.999
13.933 11.878 44.354
10.876 14.146 44.106
******************************************************************************
* Cluster number: 21
* Size (out of 1.0): 0.008224
* Centeroid fragment (coordinates of CA atoms):
* X-coor Y-coor Z-coor
------ ------ ------
22.215 8.957 47.848
18.768 9.625 49.249
17.302 13.085 48.765
13.781 14.227 49.676
12.053 12.720 46.627
14.936 11.364 44.546
******************************************************************************
* Cluster number: 22
* Size (out of 1.0): 0.000374
* Centeroid fragment (coordinates of CA atoms):
* X-coor Y-coor Z-coor
------ ------ ------
18.680 8.953 46.683
19.388 11.077 49.751
17.854 13.041 51.236
14.496 13.538 49.505
14.634 11.122 46.555
14.003 12.247 42.980
******************************************************************************
* Cluster number: 23
* Size (out of 1.0): 0.008411
* Centeroid fragment (coordinates of CA atoms):
* X-coor Y-coor Z-coor
------ ------ ------
19.858 10.485 47.059
18.332 9.426 50.353
17.367 12.958 51.388
16.034 14.000 47.958
14.876 10.787 46.267
12.589 12.321 43.686
******************************************************************************
* Cluster number: 24
* Size (out of 1.0): 0.023178
* Centeroid fragment (coordinates of CA atoms):
* X-coor Y-coor Z-coor
------ ------ ------
22.818 8.946 50.872
19.908 10.143 48.745
17.978 12.949 50.433
14.953 13.619 48.189
12.936 11.718 45.608
10.462 12.603 42.863
******************************************************************************
* Cluster number: 25
* Size (out of 1.0): 0.003551
* Centeroid fragment (coordinates of CA atoms):
* X-coor Y-coor Z-coor
------ ------ ------
18.058 9.106 46.283
19.402 11.923 48.476
17.465 13.088 51.533
14.268 11.507 50.192
14.489 13.083 46.732
15.373 11.272 43.494
******************************************************************************
* Cluster number: 26
* Size (out of 1.0): 0.001121
* Centeroid fragment (coordinates of CA atoms):
* X-coor Y-coor Z-coor
------ ------ ------
18.445 9.489 47.170
20.171 10.316 50.455
18.278 13.639 50.251
14.836 12.200 49.439
12.962 11.342 46.259
14.363 12.992 43.137
******************************************************************************
* Cluster number: 27
* Size (out of 1.0): 0.038692
* Centeroid fragment (coordinates of CA atoms):
* X-coor Y-coor Z-coor
------ ------ ------
22.500 8.399 49.183
20.609 11.635 49.903
16.884 11.418 50.587
15.327 13.443 47.749
11.720 12.777 46.548
12.016 12.306 42.739
******************************************************************************
* Cluster number: 28
* Size (out of 1.0): 0.021121
* Centeroid fragment (coordinates of CA atoms):
* X-coor Y-coor Z-coor
------ ------ ------
21.459 10.876 49.289
18.066 9.250 48.459
15.965 11.961 50.132
16.730 14.362 47.287
14.948 12.160 44.693
11.886 11.370 46.849
******************************************************************************
* Cluster number: 29
* Size (out of 1.0): 0.019626
* Centeroid fragment (coordinates of CA atoms):
* X-coor Y-coor Z-coor
------ ------ ------
21.715 8.877 48.786
19.246 11.690 48.149
15.918 10.778 49.629
14.470 14.274 49.124
14.747 13.866 45.355
12.960 10.494 45.667
******************************************************************************
* Cluster number: 30
* Size (out of 1.0): 0.014393
* Centeroid fragment (coordinates of CA atoms):
* X-coor Y-coor Z-coor
------ ------ ------
21.543 11.327 49.029
18.612 9.274 50.353
16.153 12.165 49.856
17.133 12.751 46.216
14.021 11.220 44.605
11.593 13.241 46.651
******************************************************************************
* Cluster number: 31
* Size (out of 1.0): 0.020000
* Centeroid fragment (coordinates of CA atoms):
* X-coor Y-coor Z-coor
------ ------ ------
20.461 11.127 47.427
17.389 9.208 48.563
16.166 11.871 50.911
16.558 14.678 48.373
15.400 12.956 45.233
13.081 10.139 46.203
******************************************************************************
* Cluster number: 32
* Size (out of 1.0): 0.021869
* Centeroid fragment (coordinates of CA atoms):
* X-coor Y-coor Z-coor
------ ------ ------
22.935 11.024 49.328
20.115 9.266 51.196
17.020 11.339 50.385
15.639 12.177 46.956
12.889 14.212 45.349
10.458 11.961 43.495
******************************************************************************
* Cluster number: 33
* Size (out of 1.0): 0.054766
* Centeroid fragment (coordinates of CA atoms):
* X-coor Y-coor Z-coor
------ ------ ------
23.667 9.062 50.602
20.220 10.603 51.092
17.943 11.621 48.214
14.653 13.469 47.897
11.885 11.682 46.009
10.687 13.542 42.896
******************************************************************************
* Cluster number: 34
* Size (out of 1.0): 0.004673
* Centeroid fragment (coordinates of CA atoms):
* X-coor Y-coor Z-coor
------ ------ ------
21.599 10.494 48.388
19.430 11.291 51.405
16.241 11.932 49.486
16.353 10.403 46.015
12.728 11.087 45.203
12.706 14.770 46.213
******************************************************************************
* Cluster number: 35
* Size (out of 1.0): 0.008037
* Centeroid fragment (coordinates of CA atoms):
* X-coor Y-coor Z-coor
------ ------ ------
22.195 9.712 49.537
18.586 9.686 48.362
17.088 12.354 50.619
15.115 14.718 48.375
14.775 12.300 45.448
11.296 11.208 44.370
******************************************************************************
* Cluster number: 36
* Size (out of 1.0): 0.008598
* Centeroid fragment (coordinates of CA atoms):
* X-coor Y-coor Z-coor
------ ------ ------
20.883 9.375 47.800
20.599 10.822 51.294
17.353 12.637 50.477
14.034 11.839 48.863
14.556 11.867 45.079
11.630 13.437 43.197
******************************************************************************
* Cluster number: 37
* Size (out of 1.0): 0.006916
* Centeroid fragment (coordinates of CA atoms):
* X-coor Y-coor Z-coor
------ ------ ------
19.650 9.501 47.032
20.182 10.323 50.742
17.275 12.607 51.775
15.972 13.454 48.320
13.220 11.732 46.296
12.756 12.361 42.545
******************************************************************************
* Cluster number: 38
* Size (out of 1.0): 0.000374
* Centeroid fragment (coordinates of CA atoms):
* X-coor Y-coor Z-coor
------ ------ ------
20.938 11.977 48.180
19.159 10.606 51.249
15.737 11.168 49.673
16.136 9.755 46.096
15.081 13.162 44.693
12.004 13.311 46.819
******************************************************************************
* Cluster number: 39
* Size (out of 1.0): 0.000935
* Centeroid fragment (coordinates of CA atoms):
* X-coor Y-coor Z-coor
------ ------ ------
19.973 10.566 47.175
19.585 11.431 50.883
16.011 12.586 50.150
15.125 9.609 47.916
15.714 11.841 44.837
12.648 13.945 45.749
******************************************************************************