*HEADER    ANTITUMOR PROTEIN                       24-JUL-03   1Q2F              
*TITLE     NMR SOLUTION STRUCTURE OF A PEPTIDE FROM THE MDM-2 BINDING            
*TITLE    2 DOMAIN OF THE P53 PROTEIN THAT IS SELECTIVELY CYTOTOXIC TO           
*TITLE    3 CANCER CELLS                                                         
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: PNC27;                                                     
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: P53 MDM-2 BINDING PEPTIDE, ANTENNAPEDIA                    
*COMPND   5 HOMEODOMAIN PEPTIDE;                                                 
*COMPND   6 ENGINEERED: YES;                                                     
*COMPND   7 OTHER_DETAILS: P53 MDM-2 BINDING DOMAIN FRAGMENT LINKED TO           
*COMPND   8 PENETRATIN FRAGMENT                                                  
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 SYNTHETIC: YES;                                                      
*SOURCE   3 OTHER_DETAILS: SYNTHESIZED                                           
*KEYWDS    P53 PROTEIN, MDM-2 BINDING DOMAIN, PENETRATIN, ANTITUMOR,             
*KEYWDS   2 NMR                                                                  
*EXPDTA    NMR, 30 STRUCTURES                                                    
*AUTHOR    R.ROSAL, M.R.PINCUS, P.W.BRANDT-RAUF, R.L.FINE, H.WANG                
*REVDAT   1   16-MAR-04 1Q2F    0                                                
1 PRO HB2 1 PRO HB3      2.507 # noe_37C.524
2 PRO HD3 1 PRO HB2      4.329 # noe_37C.404
2 PRO HB2 2 PRO HB3      2.643 # noe_37C.526
2 PRO HD2 2 PRO HD3      2.371 # noe_37C.415
2 PRO HD3 2 PRO HG3      3.796 # noe_37C.405
2 PRO HD2 2 PRO HG3      3.397 # noe_37C.398
2 PRO HB2 2 PRO HG2      3.281 # noe_37C.530
2 PRO HD3 2 PRO HG2      3.470 # noe_37C.406
2 PRO HD2 2 PRO HG2      3.927 # noe_37C.397
2 PRO HD2 2 PRO HG2      3.677 # noe_37C.399
3 LEU HN 2 PRO HA      3.036 # noe_37C.14
3 LEU HN 2 PRO HG3      4.090 # noe_37C.18
3 LEU HA 3 LEU HB3      3.251 # noe_37C.319
3 LEU HA 3 LEU QD1      3.920 # noe_37C.316
3 LEU HA 3 LEU QD2      4.292 # noe_37C.314
3 LEU HN 3 LEU HA      3.184 # noe_37C.15
3 LEU HN 3 LEU HB3      3.256 # noe_37C.17
3 LEU HN 4 SER HN      3.333 # noe_37C.436
4 SER HN 3 LEU HN      3.306 # noe_37C.439
4 SER HA 4 SER HB3      2.882 # noe_37C.407
4 SER HA 4 SER HB2      3.026 # noe_37C.409
5 GLN HN 2 PRO HG3      4.233 # noe_37C.23
5 GLN HN 4 SER HA      3.020 # noe_37C.24
5 GLN HN 4 SER HB3      4.410 # noe_37C.19
5 GLN HN 4 SER HB2      3.761 # noe_37C.20
5 GLN HA 5 GLN HB3      3.048 # noe_37C.335
5 GLN HA 5 GLN HG3      3.544 # noe_37C.327
5 GLN HG3 5 GLN HB2      3.075 # noe_37C.527
5 GLN HN 5 GLN HA      3.026 # noe_37C.25
5 GLN HN 5 GLN HB3      3.184 # noe_37C.22
5 GLN HN 5 GLN HG3      3.761 # noe_37C.21
6 GLU- HN 5 GLN HG3      4.072 # noe_37C.54
6 GLU- HA 6 GLU- HG3      3.988 # noe_37C.339
6 GLU- HG3 6 GLU- HB3      3.761 # noe_37C.528
6 GLU- HA 6 GLU- HG2      3.820 # noe_37C.336
6 GLU- HN 6 GLU- HG2      4.004 # noe_37C.58
5 GLN HN 7 THR HN      4.279 # noe_37C.466
7 THR HN 5 GLN HN      4.304 # noe_37C.468
7 THR HN 6 GLU- HB3      2.800 # noe_37C.131
7 THR HB 7 THR HA      3.237 # noe_37C.412
7 THR HA 7 THR QG2      3.221 # noe_37C.380
7 THR HB 7 THR QG2      3.031 # noe_37C.331
7 THR HN 7 THR HA      2.952 # noe_37C.127
7 THR HN 7 THR QG2      4.119 # noe_37C.128
8 PHE HE1 4 SER HB2      4.355 # noe_37C.515
5 GLN HA 8 PHE HB3      2.824 # noe_37C.328
7 THR HA 8 PHE HB3      2.985 # noe_37C.375
7 THR HN 8 PHE HB3      3.845 # noe_37C.130
8 PHE HD1 7 THR QG2      4.744 # noe_37C.237
8 PHE HE1 7 THR HA      4.382 # noe_37C.516
8 PHE HE1 7 THR HN      4.304 # noe_37C.490
8 PHE HN 7 THR HA      3.193 # noe_37C.103
8 PHE HN 7 THR QG2      4.292 # noe_37C.106
7 THR HN 8 PHE HN      2.858 # noe_37C.296
8 PHE HA 8 PHE HB3      2.626 # noe_37C.320
8 PHE HN 8 PHE HA      2.860 # noe_37C.101
8 PHE HN 8 PHE HB3      2.304 # noe_37C.104
8 PHE HD1 8 PHE HN      4.004 # noe_37C.495
5 GLN HN 9 SER HN      4.211 # noe_37C.467
6 GLU- HA 9 SER HB2      3.491 # noe_37C.413
9 SER HB2 8 PHE HB3      4.109 # noe_37C.352
9 SER HN 8 PHE HA      3.470 # noe_37C.79
9 SER HN 8 PHE HB3      2.806 # noe_37C.81
8 PHE HD1 9 SER HN      4.189 # noe_37C.494
9 SER HN 8 PHE HN      2.765 # noe_37C.284
8 PHE HN 9 SER HN      2.642 # noe_37C.290
9 SER HA 9 SER HB3      3.036 # noe_37C.411
9 SER HA 9 SER HB2      2.834 # noe_37C.410
9 SER HN 9 SER HA      2.770 # noe_37C.80
9 SER HN 9 SER HB2      2.996 # noe_37C.507
10 ASP- HN 7 THR QG2      5.026 # noe_37C.56
10 ASP- HN 8 PHE HB3      3.005 # noe_37C.53
10 ASP- HN 9 SER HA      3.271 # noe_37C.49
10 ASP- HN 9 SER HB2      3.339 # noe_37C.45
10 ASP- HN 10 ASP- HA      3.224 # noe_37C.48
10 ASP- HN 10 ASP- HB3      3.667 # noe_37C.508
11 LEU HN 7 THR HB      3.739 # noe_37C.94
8 PHE HD1 11 LEU HB3      4.534 # noe_37C.236
8 PHE HD1 11 LEU QD1      4.189 # noe_37C.239
8 PHE HA 11 LEU QD2      4.200 # noe_37C.321
11 LEU HN 8 PHE HA      3.404 # noe_37C.93
10 ASP- HN 11 LEU QD2      4.939 # noe_37C.47
11 LEU HN 10 ASP- HA      3.899 # noe_37C.96
11 LEU HN 10 ASP- HB3      4.233 # noe_37C.95
10 ASP- HN 11 LEU HN      2.840 # noe_37C.278
11 LEU HN 10 ASP- HN      2.830 # noe_37C.289
11 LEU HA 11 LEU HB3      3.026 # noe_37C.356
11 LEU HA 11 LEU HB2      2.999 # noe_37C.355
11 LEU HA 11 LEU QD1      3.456 # noe_37C.357
11 LEU HN 11 LEU HA      2.976 # noe_37C.97
11 LEU HN 11 LEU HB3      3.291 # noe_37C.99
11 LEU HN 11 LEU HB2      3.114 # noe_37C.98
11 LEU HN 11 LEU QD1      4.485 # noe_37C.100
8 PHE HD1 12 TRP HN      4.681 # noe_37C.492
12 TRP HA 11 LEU HB2      3.513 # noe_37C.322
12 TRP HN 11 LEU HB3      3.328 # noe_37C.33
12 TRP HN 11 LEU HN      2.957 # noe_37C.274
11 LEU HN 12 TRP HN      2.979 # noe_37C.288
12 TRP HA 12 TRP HB3      2.918 # noe_37C.325
12 TRP HD1 12 TRP HB3      3.620 # noe_37C.256
12 TRP HD1 12 TRP HB2      3.544 # noe_37C.255
12 TRP HE1 12 TRP HD1      2.670 # noe_37C.427
12 TRP HD1 12 TRP HE1      2.533 # noe_37C.433
12 TRP HE3 12 TRP HA      3.436 # noe_37C.210
12 TRP HE3 12 TRP HA      3.410 # noe_37C.214
12 TRP HE3 12 TRP HB3      4.020 # noe_37C.213
12 TRP HE3 12 TRP HB3      4.037 # noe_37C.217
12 TRP HE3 12 TRP HB2      3.832 # noe_37C.212
12 TRP HE3 12 TRP HB2      3.957 # noe_37C.216
12 TRP HN 12 TRP HB3      2.954 # noe_37C.36
12 TRP HN 12 TRP HB2      3.107 # noe_37C.35
12 TRP HN 12 TRP HD1      4.168 # noe_37C.446
12 TRP HD1 12 TRP HN      3.717 # noe_37C.500
12 TRP HN 12 TRP HE3      4.568 # noe_37C.447
12 TRP HE3 12 TRP HN      4.604 # noe_37C.488
12 TRP HE1 12 TRP HZ2      3.638 # noe_37C.426
12 TRP HZ2 12 TRP HE1      4.055 # noe_37C.428
13 LYS+ HN 10 ASP- HA      4.020 # noe_37C.110
13 LYS+ HN 11 LEU HB2      3.761 # noe_37C.113
12 TRP HE3 13 LYS+ HA      3.988 # noe_37C.211
12 TRP HE3 13 LYS+ HA      4.109 # noe_37C.215
13 LYS+ HN 12 TRP HB2      3.585 # noe_37C.111
12 TRP HD1 13 LYS+ HN      4.470 # noe_37C.501
13 LYS+ HN 12 TRP HE3      4.722 # noe_37C.477
12 TRP HE3 13 LYS+ HN      5.852 # noe_37C.487
12 TRP HN 13 LYS+ HN      3.045 # noe_37C.275
13 LYS+ HA 13 LYS+ HB3      3.291 # noe_37C.387
13 LYS+ HA 13 LYS+ HB2      3.568 # noe_37C.389
13 LYS+ HA 13 LYS+ HG3      3.552 # noe_37C.388
13 LYS+ HN 13 LYS+ HA      3.148 # noe_37C.114
13 LYS+ HN 13 LYS+ HB3      3.276 # noe_37C.112
13 LYS+ HN 13 LYS+ HB2      3.233 # noe_37C.109
13 LYS+ HN 13 LYS+ HG3      4.233 # noe_37C.511
14 LEU HN 11 LEU HA      3.620 # noe_37C.138
11 LEU HN 14 LEU HN      3.957 # noe_37C.287
14 LEU HN 11 LEU HN      3.885 # noe_37C.301
14 LEU HN 13 LYS+ HA      3.858 # noe_37C.137
14 LEU HN 13 LYS+ HB3      3.832 # noe_37C.141
14 LEU HN 13 LYS+ HB2      3.796 # noe_37C.140
14 LEU HN 13 LYS+ HN      2.988 # noe_37C.298
14 LEU HA 14 LEU HB3      3.029 # noe_37C.368
14 LEU HA 14 LEU QD1      3.528 # noe_37C.371
14 LEU HA 14 LEU QD2      3.871 # noe_37C.370
14 LEU HA 14 LEU HG      3.470 # noe_37C.329
14 LEU HG 14 LEU QD2      3.906 # noe_37C.534
14 LEU HN 14 LEU HA      2.939 # noe_37C.139
14 LEU HN 14 LEU HB2      3.045 # noe_37C.142
14 LEU HN 14 LEU QD1      4.661 # noe_37C.144
12 TRP HA 15 LEU HB3      3.927 # noe_37C.323
12 TRP HE3 15 LEU QD1      4.744 # noe_37C.218
15 LEU HN 13 LYS+ HA      4.501 # noe_37C.32
15 LEU HN 14 LEU HA      3.761 # noe_37C.27
15 LEU HN 14 LEU HN      3.029 # noe_37C.273
15 LEU HA 15 LEU HB2      3.184 # noe_37C.354
15 LEU HA 15 LEU QD1      3.419 # noe_37C.348
15 LEU HB3 15 LEU QD1      3.707 # noe_37C.533
15 LEU HN 15 LEU HB3      3.528 # noe_37C.30
14 LEU HN 16 LYS+ HN      3.568 # noe_37C.300
16 LYS+ HA 15 LEU HB3      4.072 # noe_37C.384
15 LEU HN 16 LYS+ HN      2.899 # noe_37C.272
16 LYS+ HN 15 LEU HN      2.921 # noe_37C.281
16 LYS+ HA 16 LYS+ HB3      3.023 # noe_37C.383
16 LYS+ HA 16 LYS+ HB2      3.121 # noe_37C.382
16 LYS+ HA 16 LYS+ HG3      4.004 # noe_37C.386
16 LYS+ HA 16 LYS+ HG2      4.055 # noe_37C.385
16 LYS+ HA 17 LYS+ HB3      3.436 # noe_37C.381
17 LYS+ HN 16 LYS+ HB2      3.620 # noe_37C.123
17 LYS+ HN 16 LYS+ HN      2.968 # noe_37C.294
17 LYS+ HA 17 LYS+ HB2      2.913 # noe_37C.372
17 LYS+ HA 17 LYS+ HG3      3.611 # noe_37C.373
17 LYS+ HN 17 LYS+ HB3      3.193 # noe_37C.122
17 LYS+ HN 17 LYS+ HG3      4.534 # noe_37C.453
18 TRP HD1 14 LEU QD2      4.642 # noe_37C.252
15 LEU HA 18 TRP HB3      3.449 # noe_37C.345
15 LEU HA 18 TRP HB2      3.391 # noe_37C.344
18 TRP HE3 15 LEU HA      4.090 # noe_37C.193
18 TRP HE3 15 LEU HA      4.168 # noe_37C.205
18 TRP HE3 15 LEU QD1      4.279 # noe_37C.197
18 TRP HE3 15 LEU QD1      4.100 # noe_37C.209
18 TRP HN 15 LEU HA      3.728 # noe_37C.1
18 TRP HN 16 LYS+ HB3      4.439 # noe_37C.6
18 TRP HN 16 LYS+ HN      4.211 # noe_37C.464
18 TRP HE3 17 LYS+ HD3      4.233 # noe_37C.192
17 LYS+ HN 18 TRP HE3      5.026 # noe_37C.480
18 TRP HN 17 LYS+ HA      3.629 # noe_37C.2
18 TRP HN 17 LYS+ HB3      3.456 # noe_37C.5
18 TRP HN 17 LYS+ HN      3.114 # noe_37C.434
17 LYS+ HN 18 TRP HN      3.114 # noe_37C.440
18 TRP HA 18 TRP HB3      3.048 # noe_37C.317
18 TRP HA 18 TRP HB2      3.528 # noe_37C.313
18 TRP HD1 18 TRP HA      3.210 # noe_37C.245
18 TRP HD1 18 TRP HB3      3.491 # noe_37C.248
18 TRP HD1 18 TRP HB2      3.728 # noe_37C.247
18 TRP HE1 18 TRP HD1      2.513 # noe_37C.423
18 TRP HD1 18 TRP HE1      2.346 # noe_37C.432
18 TRP HE3 18 TRP HA      3.728 # noe_37C.198
18 TRP HE3 18 TRP HA      3.717 # noe_37C.204
18 TRP HE3 18 TRP HB3      3.728 # noe_37C.520
18 TRP HE3 18 TRP HB3      3.972 # noe_37C.521
18 TRP HE3 18 TRP HB2      3.871 # noe_37C.195
18 TRP HE3 18 TRP HB2      3.972 # noe_37C.207
18 TRP HN 18 TRP HA      3.125 # noe_37C.0
18 TRP HN 18 TRP HB3      3.110 # noe_37C.4
18 TRP HN 18 TRP HB2      3.201 # noe_37C.3
18 TRP HD1 18 TRP HN      3.942 # noe_37C.498
18 TRP HN 18 TRP HD1      4.501 # noe_37C.506
18 TRP HN 18 TRP HE3      5.026 # noe_37C.474
18 TRP HN 18 TRP HE3      4.766 # noe_37C.475
18 TRP HE3 18 TRP HN      4.722 # noe_37C.485
18 TRP HE1 18 TRP HZ2      3.629 # noe_37C.422
18 TRP HZ2 18 TRP HE1      4.642 # noe_37C.430
19 LYS+ HN 15 LEU HA      4.279 # noe_37C.7
19 LYS+ HN 16 LYS+ HA      3.913 # noe_37C.8
19 LYS+ HN 17 LYS+ HN      4.304 # noe_37C.460
17 LYS+ HN 19 LYS+ HN      4.233 # noe_37C.469
18 TRP HE3 19 LYS+ HA      3.972 # noe_37C.194
18 TRP HE3 19 LYS+ HA      4.020 # noe_37C.206
19 LYS+ HN 18 TRP HA      3.772 # noe_37C.444
19 LYS+ HN 18 TRP HB3      3.602 # noe_37C.11
19 LYS+ HN 18 TRP HB2      3.552 # noe_37C.10
18 TRP HD1 19 LYS+ HN      4.501 # noe_37C.499
19 LYS+ HN 18 TRP HE3      4.279 # noe_37C.445
18 TRP HE3 19 LYS+ HN      5.089 # noe_37C.486
19 LYS+ HA 19 LYS+ HD3      3.885 # noe_37C.396
19 LYS+ HA 19 LYS+ HG3      4.004 # noe_37C.395
19 LYS+ HN 19 LYS+ HA      3.160 # noe_37C.9
19 LYS+ HN 19 LYS+ HB3      3.132 # noe_37C.12
17 LYS+ HA 20 MET HB2      3.629 # noe_37C.366
18 TRP HN 20 MET HN      4.055 # noe_37C.465
20 MET HN 18 TRP HN      4.189 # noe_37C.470
20 MET HN 19 LYS+ HA      3.913 # noe_37C.41
20 MET HN 19 LYS+ HB3      3.385 # noe_37C.44
19 LYS+ HN 20 MET HN      3.117 # noe_37C.435
20 MET HN 19 LYS+ HN      3.164 # noe_37C.438
20 MET HA 20 MET HB3      2.727 # noe_37C.523
20 MET HA 20 MET HB2      3.449 # noe_37C.337
20 MET HA 20 MET HG3      3.677 # noe_37C.334
20 MET HA 20 MET HG2      4.148 # noe_37C.333
20 MET HG2 20 MET HG3      2.899 # noe_37C.417
20 MET HN 20 MET HB2      3.276 # noe_37C.43
20 MET HN 20 MET HG3      4.109 # noe_37C.42
21 ARG+ HN 18 TRP HA      3.750 # noe_37C.83
19 LYS+ HN 21 ARG+ HN      4.470 # noe_37C.461
21 ARG+ HA 20 MET QE      4.279 # noe_37C.346
21 ARG+ HN 20 MET HA      3.638 # noe_37C.84
21 ARG+ HN 20 MET HB3      4.072 # noe_37C.89
21 ARG+ HN 20 MET HB2      3.845 # noe_37C.86
21 ARG+ HN 20 MET QE      4.939 # noe_37C.92
20 MET HN 21 ARG+ HN      2.860 # noe_37C.277
21 ARG+ HN 20 MET HN      2.869 # noe_37C.286
21 ARG+ HA 21 ARG+ HB3      3.367 # noe_37C.343
21 ARG+ HA 21 ARG+ HB2      2.990 # noe_37C.349
21 ARG+ HA 21 ARG+ HD3      3.620 # noe_37C.341
21 ARG+ HE 21 ARG+ HD3      3.251 # noe_37C.221
21 ARG+ HE 21 ARG+ HG3      4.211 # noe_37C.222
21 ARG+ HN 21 ARG+ HA      3.042 # noe_37C.85
21 ARG+ HN 21 ARG+ HB3      3.356 # noe_37C.88
21 ARG+ HN 21 ARG+ HB2      3.224 # noe_37C.87
21 ARG+ HN 21 ARG+ HG2      3.648 # noe_37C.90
18 TRP HA 22 ARG+ HB2      3.820 # noe_37C.315
19 LYS+ HA 22 ARG+ HB3      4.020 # noe_37C.391
22 ARG+ HN 19 LYS+ HA      3.796 # noe_37C.73
22 ARG+ HN 20 MET QE      3.865 # noe_37C.65
22 ARG+ HN 21 ARG+ HB3      3.536 # noe_37C.76
22 ARG+ HN 21 ARG+ HB2      3.477 # noe_37C.75
22 ARG+ HA 22 ARG+ HB3      3.356 # noe_37C.378
22 ARG+ HA 22 ARG+ HB2      3.397 # noe_37C.377
22 ARG+ HD2 22 ARG+ HD3      2.683 # noe_37C.416
22 ARG+ HE 22 ARG+ HD3      3.845 # noe_37C.241
22 ARG+ HE 22 ARG+ HD2      3.913 # noe_37C.240
22 ARG+ HA 22 ARG+ HG3      3.808 # noe_37C.379
22 ARG+ HE 22 ARG+ HG3      4.128 # noe_37C.244
22 ARG+ HE 22 ARG+ HN      4.642 # noe_37C.497
22 ARG+ HN 22 ARG+ HG3      4.168 # noe_37C.78
20 MET HA 23 ASN HB3      4.090 # noe_37C.332
20 MET HA 23 ASN HB2      3.728 # noe_37C.330
22 ARG+ HA 23 ASN HB3      4.304 # noe_37C.376
23 ASN HN 22 ARG+ HB2      3.463 # noe_37C.40
22 ARG+ HE 23 ASN HN      4.568 # noe_37C.496
23 ASN HN 23 ASN HB3      3.344 # noe_37C.39
23 ASN HN 23 ASN HB3      3.506 # noe_37C.509
23 ASN HN 23 ASN HB2      3.261 # noe_37C.38
21 ARG+ HA 24 GLN HB3      3.648 # noe_37C.342
24 GLN HN 23 ASN HB3      3.717 # noe_37C.74
24 GLN HN 23 ASN HB2      3.667 # noe_37C.61
24 GLN HN 23 ASN HN      2.371 # noe_37C.473
24 GLN HA 24 GLN HB3      3.296 # noe_37C.361
24 GLN HA 24 GLN HG3      3.687 # noe_37C.360
24 GLN HA 24 GLN HG2      4.355 # noe_37C.359
24 GLN HG2 24 GLN HG3      2.949 # noe_37C.525
24 GLN HN 24 GLN HA      2.812 # noe_37C.72
24 GLN HN 24 GLN HB3      3.228 # noe_37C.64
24 GLN HN 24 GLN HG3      4.020 # noe_37C.63
24 GLN HN 24 GLN HG2      3.739 # noe_37C.62
23 ASN HN 25 PHE HN      3.585 # noe_37C.276
25 PHE HN 24 GLN HA      3.201 # noe_37C.108
25 PHE HN 24 GLN HB3      3.845 # noe_37C.105
25 PHE HA 25 PHE HB3      2.700 # noe_37C.338
25 PHE HD1 25 PHE HA      3.356 # noe_37C.264
25 PHE HD1 25 PHE HA      3.513 # noe_37C.269
25 PHE HD1 25 PHE HB3      2.889 # noe_37C.265
25 PHE HD1 25 PHE HB3      2.926 # noe_37C.270
25 PHE HE1 25 PHE HB3      4.439 # noe_37C.260
25 PHE HN 25 PHE HD1      4.382 # noe_37C.455
25 PHE HD1 25 PHE HN      4.090 # noe_37C.502
26 TRP HD1 21 ARG+ HB3      3.429 # noe_37C.230
26 TRP HD1 21 ARG+ HB3      3.638 # noe_37C.235
26 TRP HD1 22 ARG+ HG3      4.211 # noe_37C.231
24 GLN HN 26 TRP HE3      4.812 # noe_37C.476
25 PHE HD1 26 TRP HA      3.988 # noe_37C.266
25 PHE HD1 26 TRP HA      4.329 # noe_37C.268
26 TRP HD1 25 PHE HN      4.004 # noe_37C.491
26 TRP HN 25 PHE HA      3.717 # noe_37C.116
26 TRP HN 25 PHE HB3      3.103 # noe_37C.119
26 TRP HN 25 PHE HD1      4.279 # noe_37C.454
25 PHE HD1 26 TRP HN      4.055 # noe_37C.503
25 PHE HD1 26 TRP HN      4.168 # noe_37C.505
26 TRP HA 26 TRP HB3      3.233 # noe_37C.306
26 TRP HA 26 TRP HB2      3.168 # noe_37C.307
26 TRP HD1 26 TRP HA      3.367 # noe_37C.227
26 TRP HD1 26 TRP HB3      3.219 # noe_37C.229
26 TRP HD1 26 TRP HB2      3.344 # noe_37C.228
26 TRP HE1 26 TRP HD1      2.536 # noe_37C.425
26 TRP HD1 26 TRP HE1      2.353 # noe_37C.431
26 TRP HE3 26 TRP HA      2.933 # noe_37C.185
26 TRP HE3 26 TRP HA      2.960 # noe_37C.519
26 TRP HE3 26 TRP HB3      3.697 # noe_37C.187
26 TRP HE3 26 TRP HB3      3.677 # noe_37C.196
26 TRP HE3 26 TRP HB2      3.657 # noe_37C.186
26 TRP HE3 26 TRP HB2      3.638 # noe_37C.199
26 TRP HN 26 TRP HA      3.089 # noe_37C.115
26 TRP HN 26 TRP HB3      3.140 # noe_37C.118
26 TRP HN 26 TRP HB2      3.306 # noe_37C.117
26 TRP HN 26 TRP HD1      3.972 # noe_37C.457
26 TRP HD1 26 TRP HN      3.404 # noe_37C.489
26 TRP HN 26 TRP HE3      4.912 # noe_37C.481
26 TRP HE3 26 TRP HN      5.230 # noe_37C.483
26 TRP HE1 26 TRP HZ2      3.306 # noe_37C.424
26 TRP HZ2 26 TRP HE1      3.988 # noe_37C.429
24 GLN HA 27 VAL QG1      4.369 # noe_37C.358
24 GLN HA 27 VAL QG2      3.942 # noe_37C.364
26 TRP HE3 27 VAL HA      4.382 # noe_37C.517
26 TRP HE3 27 VAL HA      4.329 # noe_37C.518
26 TRP HD1 27 VAL QG2      4.702 # noe_37C.232
26 TRP HE3 27 VAL QG2      4.681 # noe_37C.189
26 TRP HE3 27 VAL QG2      4.425 # noe_37C.201
27 VAL HN 26 TRP HB3      3.957 # noe_37C.134
27 VAL HN 26 TRP HB2      3.687 # noe_37C.132
27 VAL HN 26 TRP HE3      4.722 # noe_37C.478
27 VAL HN 26 TRP HE3      4.812 # noe_37C.479
26 TRP HE3 27 VAL HN      6.000 # noe_37C.484
26 TRP HN 27 VAL HN      3.005 # noe_37C.293
27 VAL HN 26 TRP HN      3.029 # noe_37C.297
27 VAL HA 27 VAL HB      3.201 # noe_37C.403
27 VAL HA 27 VAL QG1      3.432 # noe_37C.402
27 VAL HB 27 VAL QG1      3.237 # noe_37C.419
27 VAL HA 27 VAL QG2      3.230 # noe_37C.401
27 VAL HB 27 VAL QG2      3.314 # noe_37C.418
27 VAL QG2 27 VAL QG1      3.144 # noe_37C.535
27 VAL HN 27 VAL HA      3.045 # noe_37C.133
27 VAL HN 27 VAL QG1      3.934 # noe_37C.136
27 VAL HN 27 VAL QG2      3.195 # noe_37C.135
25 PHE HA 28 LYS+ HB3      3.379 # noe_37C.340
28 LYS+ HN 25 PHE HA      3.784 # noe_37C.167
26 TRP HN 28 LYS+ HN      4.279 # noe_37C.458
28 LYS+ HN 27 VAL QG1      4.148 # noe_37C.172
28 LYS+ HN 27 VAL QG2      4.292 # noe_37C.171
28 LYS+ HN 27 VAL HN      2.913 # noe_37C.441
28 LYS+ HA 28 LYS+ HB3      2.894 # noe_37C.365
28 LYS+ HA 28 LYS+ HG3      4.090 # noe_37C.369
28 LYS+ HN 28 LYS+ HG3      4.470 # noe_37C.448
28 LYS+ HN 28 LYS+ HG2      4.233 # noe_37C.170
18 TRP HZ3 29 VAL QG1      4.681 # noe_37C.263
25 PHE HD1 29 VAL QG1      4.702 # noe_37C.267
25 PHE HE1 29 VAL QG1      4.485 # noe_37C.262
25 PHE HE1 29 VAL QG1      4.081 # noe_37C.522
25 PHE HZ 29 VAL QG1      5.269 # noe_37C.258
25 PHE HE1 29 VAL QG2      4.744 # noe_37C.261
29 VAL HN 25 PHE HA      4.501 # noe_37C.158
26 TRP HE3 29 VAL HB      4.055 # noe_37C.188
26 TRP HE3 29 VAL HB      3.885 # noe_37C.200
26 TRP HA 29 VAL QG1      3.672 # noe_37C.308
26 TRP HE3 29 VAL QG1      4.396 # noe_37C.191
26 TRP HE3 29 VAL QG1      4.439 # noe_37C.203
26 TRP HA 29 VAL QG2      4.501 # noe_37C.305
26 TRP HE3 29 VAL QG2      4.355 # noe_37C.190
26 TRP HE3 29 VAL QG2      4.355 # noe_37C.202
26 TRP HZ3 29 VAL QG2      4.623 # noe_37C.259
29 VAL HN 26 TRP HA      3.858 # noe_37C.162
26 TRP HN 29 VAL HN      4.861 # noe_37C.482
27 VAL HN 29 VAL HN      4.128 # noe_37C.452
29 VAL HN 28 LYS+ HA      3.611 # noe_37C.159
29 VAL HN 28 LYS+ HB3      3.379 # noe_37C.160
29 VAL HA 29 VAL QG1      3.131 # noe_37C.393
29 VAL HB 29 VAL QG1      3.426 # noe_37C.421
29 VAL HA 29 VAL QG2      3.204 # noe_37C.392
29 VAL HB 29 VAL QG2      3.168 # noe_37C.420
29 VAL QG2 29 VAL QG1      3.566 # noe_37C.536
29 VAL HN 29 VAL HA      2.999 # noe_37C.163
29 VAL HN 29 VAL HB      3.107 # noe_37C.164
29 VAL HN 29 VAL QG1      3.261 # noe_37C.161
29 VAL HN 29 VAL QG2      3.980 # noe_37C.165
27 VAL HA 30 GLN HB3      4.072 # noe_37C.400
28 LYS+ HA 30 GLN HG3      3.521 # noe_37C.367
30 GLN HN 28 LYS+ HB3      2.849 # noe_37C.169
30 GLN HA 29 VAL QG2      4.744 # noe_37C.353
30 GLN HN 29 VAL HA      3.416 # noe_37C.181
30 GLN HN 29 VAL QG2      4.410 # noe_37C.180
30 GLN HA 30 GLN HB2      3.306 # noe_37C.351
30 GLN HG2 30 GLN HB3      3.197 # noe_37C.532
30 GLN HG2 30 GLN HB2      2.944 # noe_37C.531
30 GLN HN 30 GLN HA      3.099 # noe_37C.177
30 GLN HN 30 GLN HB2      3.602 # noe_37C.178
30 GLN HN 30 GLN HB2      3.687 # noe_37C.182
31 ARG+ HN 27 VAL HA      4.722 # noe_37C.451
31 ARG+ HN 28 LYS+ HA      3.168 # noe_37C.514
29 VAL HA 31 ARG+ HB3      3.602 # noe_37C.394
31 ARG+ HN 30 GLN HA      3.521 # noe_37C.147
31 ARG+ HN 30 GLN HN      3.271 # noe_37C.303
30 GLN HN 31 ARG+ HN      3.032 # noe_37C.443
31 ARG+ HA 31 ARG+ HB3      3.707 # noe_37C.312
31 ARG+ HA 31 ARG+ HD3      3.638 # noe_37C.309
31 ARG+ HE 31 ARG+ HD3      3.620 # noe_37C.226
32 GLY HN 32 GLY HA1      2.985 # noe_37C.152

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    HA   PRO   1           HA       PRO   1 -11.715   9.815   3.328
    2   1HB   PRO   1          1HB       PRO   1 -13.851  11.500   3.183
    3   2HB   PRO   1          2HB       PRO   1 -12.825  11.397   4.651
    4   1HG   PRO   1          1HG       PRO   1 -12.601  13.404   2.389
    5   2HG   PRO   1          2HG       PRO   1 -12.707  13.752   4.146
    6   1HD   PRO   1          1HD       PRO   1 -10.305  13.632   2.864
    7   2HD   PRO   1          2HD       PRO   1 -10.491  12.947   4.507
    8    HA   PRO   2           HA       PRO   2 -11.959   9.629  -1.150
    9   1HB   PRO   2          1HB       PRO   2 -12.817   7.048  -1.309
   10   2HB   PRO   2          2HB       PRO   2 -11.141   7.458  -0.817
   11   1HG   PRO   2          1HG       PRO   2 -13.500   6.881   0.997
   12   2HG   PRO   2          2HG       PRO   2 -11.876   6.120   1.049
   13   1HD   PRO   2          1HD       PRO   2 -12.511   8.227   2.658
   14   2HD   PRO   2          2HD       PRO   2 -10.894   8.121   1.898
   15    H    LEU   3           H        LEU   3 -13.982   8.099  -2.354
   16    HA   LEU   3           HA       LEU   3 -16.346   9.733  -1.644
   17   1HB   LEU   3          1HB       LEU   3 -15.180   8.617  -4.094
   18   2HB   LEU   3          2HB       LEU   3 -16.922   8.284  -3.950
   19    HG   LEU   3           HG       LEU   3 -16.894  10.876  -3.155
   20   1HD1  LEU   3          1HD1      LEU   3 -15.157  11.425  -5.387
   21   2HD1  LEU   3          2HD1      LEU   3 -14.995  11.959  -3.697
   22   3HD1  LEU   3          3HD1      LEU   3 -14.277  10.415  -4.215
   23   1HD2  LEU   3          1HD2      LEU   3 -17.010  11.142  -5.916
   24   2HD2  LEU   3          2HD2      LEU   3 -17.360   9.413  -5.674
   25   3HD2  LEU   3          3HD2      LEU   3 -18.363  10.645  -4.871
   26    H    SER   4           H        SER   4 -15.218   7.117  -0.334
   27    HA   SER   4           HA       SER   4 -16.109   5.248   0.639
   28   1HB   SER   4          1HB       SER   4 -18.926   5.723   0.257
   29   2HB   SER   4          2HB       SER   4 -17.962   5.858   1.747
   30    HG   SER   4           HG       SER   4 -17.352   7.960   1.025
   31    H    GLN   5           H        GLN   5 -15.840   3.374  -0.414
   32    HA   GLN   5           HA       GLN   5 -16.574   1.556  -1.678
   33   1HB   GLN   5          1HB       GLN   5 -18.853   2.955  -1.686
   34   2HB   GLN   5          2HB       GLN   5 -18.381   3.235  -3.379
   35   1HG   GLN   5          1HG       GLN   5 -18.680   1.045  -3.964
   36   2HG   GLN   5          2HG       GLN   5 -18.085   0.441  -2.402
   37   1HE2  GLN   5          1HE2      GLN   5 -19.544   0.569  -0.523
   38   2HE2  GLN   5          2HE2      GLN   5 -21.274   0.481  -0.779
   39    H    GLU   6           H        GLU   6 -16.081   4.757  -3.178
   40    HA   GLU   6           HA       GLU   6 -15.327   3.998  -5.747
   41   1HB   GLU   6          1HB       GLU   6 -15.251   6.318  -4.161
   42   2HB   GLU   6          2HB       GLU   6 -13.567   6.058  -4.677
   43   1HG   GLU   6          1HG       GLU   6 -15.006   5.493  -6.979
   44   2HG   GLU   6          2HG       GLU   6 -15.933   6.827  -6.261
   45    H    THR   7           H        THR   7 -13.274   4.206  -2.793
   46    HA   THR   7           HA       THR   7 -11.079   2.900  -4.275
   47    HB   THR   7           HB       THR   7 -10.605   3.396  -1.444
   48    HG1  THR   7           1HG      THR   7 -11.355   5.614  -3.049
   49   1HG2  THR   7          1HG2      THR   7  -9.469   4.744  -3.927
   50   2HG2  THR   7          2HG2      THR   7  -8.695   4.585  -2.332
   51   3HG2  THR   7          3HG2      THR   7  -8.945   3.145  -3.347
   52    H    PHE   8           H        PHE   8 -11.564   2.408  -0.829
   53    HA   PHE   8           HA       PHE   8 -11.126   0.179   0.033
   54   1HB   PHE   8          1HB       PHE   8 -14.079   0.143  -0.553
   55   2HB   PHE   8          2HB       PHE   8 -13.222  -0.358   0.914
   56    HD1  PHE   8           1HD      PHE   8 -13.290   2.811  -1.114
   57    HD2  PHE   8           2HD      PHE   8 -13.818   0.952   2.722
   58    HE1  PHE   8           1HE      PHE   8 -13.728   5.031  -0.098
   59    HE2  PHE   8           2HE      PHE   8 -14.256   3.171   3.738
   60    HZ   PHE   8           HZ       PHE   8 -14.212   5.211   2.328
   61    H    SER   9           H        SER   9 -13.660  -0.104  -2.529
   62    HA   SER   9           HA       SER   9 -13.643  -2.721  -3.106
   63   1HB   SER   9          1HB       SER   9 -14.787  -0.877  -4.398
   64   2HB   SER   9          2HB       SER   9 -13.257  -0.623  -5.271
   65    HG   SER   9           HG       SER   9 -13.414  -2.988  -5.683
   66    H    ASP  10           H        ASP  10 -11.220  -0.509  -4.623
   67    HA   ASP  10           HA       ASP  10  -9.470  -2.882  -5.001
   68   1HB   ASP  10          1HB       ASP  10  -8.413  -1.641  -6.752
   69   2HB   ASP  10          2HB       ASP  10 -10.165  -1.449  -6.976
   70    H    LEU  11           H        LEU  11  -9.925  -0.001  -3.148
   71    HA   LEU  11           HA       LEU  11  -7.176   0.593  -2.591
   72   1HB   LEU  11          1HB       LEU  11  -9.450   1.928  -2.196
   73   2HB   LEU  11          2HB       LEU  11  -9.354   1.142  -0.602
   74    HG   LEU  11           HG       LEU  11  -7.481   3.132  -1.872
   75   1HD1  LEU  11          1HD1      LEU  11  -7.452   3.629   0.764
   76   2HD1  LEU  11          2HD1      LEU  11  -8.775   4.201  -0.280
   77   3HD1  LEU  11          3HD1      LEU  11  -8.985   2.726   0.694
   78   1HD2  LEU  11          1HD2      LEU  11  -5.964   1.319  -1.442
   79   2HD2  LEU  11          2HD2      LEU  11  -5.804   2.443  -0.072
   80   3HD2  LEU  11          3HD2      LEU  11  -6.748   0.946   0.111
   81    H    TRP  12           H        TRP  12  -9.660  -0.781  -0.358
   82    HA   TRP  12           HA       TRP  12  -7.894  -1.724   1.570
   83   1HB   TRP  12          1HB       TRP  12  -9.816  -2.369   2.484
   84   2HB   TRP  12          2HB       TRP  12 -10.636  -1.891   0.991
   85    HD1  TRP  12           HD       TRP  12 -12.076  -3.694   0.006
   86    HE1  TRP  12           1HE      TRP  12 -12.181  -6.238   0.016
   87    HE3  TRP  12           3HE      TRP  12  -7.878  -4.665   2.769
   88    HZ2  TRP  12           2HZ      TRP  12 -10.637  -8.438   1.089
   89    HZ3  TRP  12           3HZ      TRP  12  -7.229  -6.994   3.263
   90    HH2  TRP  12           HH       TRP  12  -8.594  -8.887   2.434
   91    H    LYS  13           H        LYS  13  -8.861  -3.197  -1.526
   92    HA   LYS  13           HA       LYS  13  -7.558  -5.719  -0.986
   93   1HB   LYS  13          1HB       LYS  13  -9.456  -4.983  -2.720
   94   2HB   LYS  13          2HB       LYS  13  -8.044  -4.739  -3.776
   95   1HG   LYS  13          1HG       LYS  13  -7.973  -7.253  -2.213
   96   2HG   LYS  13          2HG       LYS  13  -9.312  -7.157  -3.382
   97   1HD   LYS  13          1HD       LYS  13  -6.935  -6.116  -4.628
   98   2HD   LYS  13          2HD       LYS  13  -6.548  -7.694  -3.901
   99   1HE   LYS  13          1HE       LYS  13  -8.834  -8.434  -4.977
  100   2HE   LYS  13          2HE       LYS  13  -8.591  -7.013  -6.016
  101   1HZ   LYS  13          1HZ       LYS  13  -6.620  -7.898  -6.811
  102   2HZ   LYS  13          2HZ       LYS  13  -6.532  -9.058  -5.643
  103   3HZ   LYS  13          3HZ       LYS  13  -7.678  -9.163  -6.824
  104    H    LEU  14           H        LEU  14  -6.623  -2.591  -2.339
  105    HA   LEU  14           HA       LEU  14  -4.306  -3.336  -3.743
  106   1HB   LEU  14          1HB       LEU  14  -5.579  -0.948  -2.852
  107   2HB   LEU  14          2HB       LEU  14  -3.881  -0.863  -2.327
  108    HG   LEU  14           HG       LEU  14  -4.540  -0.052  -4.749
  109   1HD1  LEU  14          1HD1      LEU  14  -2.303  -0.132  -5.108
  110   2HD1  LEU  14          2HD1      LEU  14  -2.205  -0.954  -3.533
  111   3HD1  LEU  14          3HD1      LEU  14  -2.273  -1.910  -5.032
  112   1HD2  LEU  14          1HD2      LEU  14  -5.157  -1.625  -6.257
  113   2HD2  LEU  14          2HD2      LEU  14  -3.877  -2.741  -5.724
  114   3HD2  LEU  14          3HD2      LEU  14  -5.435  -2.699  -4.864
  115    H    LEU  15           H        LEU  15  -4.723  -2.467  -0.273
  116    HA   LEU  15           HA       LEU  15  -1.979  -2.811   0.414
  117   1HB   LEU  15          1HB       LEU  15  -4.504  -3.044   2.098
  118   2HB   LEU  15          2HB       LEU  15  -2.849  -2.899   2.737
  119    HG   LEU  15           HG       LEU  15  -4.446  -0.863   1.149
  120   1HD1  LEU  15          1HD1      LEU  15  -3.451   0.553   3.104
  121   2HD1  LEU  15          2HD1      LEU  15  -4.784  -0.569   3.465
  122   3HD1  LEU  15          3HD1      LEU  15  -3.109  -1.021   3.862
  123   1HD2  LEU  15          1HD2      LEU  15  -1.454  -1.161   1.498
  124   2HD2  LEU  15          2HD2      LEU  15  -2.375  -0.746   0.033
  125   3HD2  LEU  15          3HD2      LEU  15  -2.192   0.451   1.337
  126    H    LYS  16           H        LYS  16  -4.379  -5.055  -0.518
  127    HA   LYS  16           HA       LYS  16  -3.481  -7.270   1.124
  128   1HB   LYS  16          1HB       LYS  16  -5.723  -6.721  -0.377
  129   2HB   LYS  16          2HB       LYS  16  -4.853  -7.868  -1.424
  130   1HG   LYS  16          1HG       LYS  16  -4.539  -9.041   1.043
  131   2HG   LYS  16          2HG       LYS  16  -6.150  -8.304   1.208
  132   1HD   LYS  16          1HD       LYS  16  -6.198  -9.399  -1.357
  133   2HD   LYS  16          2HD       LYS  16  -5.298 -10.606  -0.408
  134   1HE   LYS  16          1HE       LYS  16  -7.616  -9.540   1.040
  135   2HE   LYS  16          2HE       LYS  16  -8.075 -10.310  -0.494
  136   1HZ   LYS  16          1HZ       LYS  16  -8.012 -12.085   0.840
  137   2HZ   LYS  16          2HZ       LYS  16  -6.423 -12.091   0.399
  138   3HZ   LYS  16          3HZ       LYS  16  -6.871 -11.469   1.859
  139    H    LYS  17           H        LYS  17  -1.690  -5.591  -0.880
  140    HA   LYS  17           HA       LYS  17   0.009  -7.825  -1.562
  141   1HB   LYS  17          1HB       LYS  17  -0.994  -8.282  -3.545
  142   2HB   LYS  17          2HB       LYS  17  -1.884  -6.741  -3.559
  143   1HG   LYS  17          1HG       LYS  17   1.096  -6.991  -4.136
  144   2HG   LYS  17          2HG       LYS  17  -0.161  -6.949  -5.395
  145   1HD   LYS  17          1HD       LYS  17  -0.780  -4.786  -3.715
  146   2HD   LYS  17          2HD       LYS  17   0.995  -4.751  -3.847
  147   1HE   LYS  17          1HE       LYS  17  -0.009  -3.441  -5.662
  148   2HE   LYS  17          2HE       LYS  17   0.797  -4.883  -6.319
  149   1HZ   LYS  17          1HZ       LYS  17  -1.904  -4.139  -6.461
  150   2HZ   LYS  17          2HZ       LYS  17  -1.104  -5.338  -7.264
  151   3HZ   LYS  17          3HZ       LYS  17  -1.759  -5.634  -5.780
  152    H    TRP  18           H        TRP  18  -0.886  -4.394  -1.927
  153    HA   TRP  18           HA       TRP  18   1.783  -3.553  -2.650
  154   1HB   TRP  18          1HB       TRP  18  -0.656  -2.450  -2.874
  155   2HB   TRP  18          2HB       TRP  18  -0.156  -1.693  -1.355
  156    HD1  TRP  18           HD       TRP  18  -0.048  -1.167  -4.947
  157    HE1  TRP  18           1HE      TRP  18   1.630   0.625  -5.625
  158    HE3  TRP  18           3HE      TRP  18   2.578  -0.822  -0.567
  159    HZ2  TRP  18           2HZ      TRP  18   3.848   2.042  -4.421
  160    HZ3  TRP  18           3HZ      TRP  18   4.464   0.757  -0.372
  161    HH2  TRP  18           HH       TRP  18   5.110   2.193  -2.284
  162    H    LYS  19           H        LYS  19  -0.156  -3.635   0.369
  163    HA   LYS  19           HA       LYS  19   1.339  -2.262   2.155
  164   1HB   LYS  19          1HB       LYS  19  -0.648  -3.636   2.711
  165   2HB   LYS  19          2HB       LYS  19   0.340  -5.109   2.564
  166   1HG   LYS  19          1HG       LYS  19   1.499  -3.016   4.317
  167   2HG   LYS  19          2HG       LYS  19  -0.031  -3.709   4.905
  168   1HD   LYS  19          1HD       LYS  19   1.403  -5.929   3.981
  169   2HD   LYS  19          2HD       LYS  19   2.637  -4.919   4.771
  170   1HE   LYS  19          1HE       LYS  19   1.777  -6.237   6.532
  171   2HE   LYS  19          2HE       LYS  19   0.926  -4.687   6.704
  172   1HZ   LYS  19          1HZ       LYS  19  -0.703  -5.963   5.104
  173   2HZ   LYS  19          2HZ       LYS  19  -0.083  -7.258   5.915
  174   3HZ   LYS  19          3HZ       LYS  19  -0.817  -6.039   6.748
  175    H    MET  20           H        MET  20   2.170  -5.507   0.856
  176    HA   MET  20           HA       MET  20   4.311  -6.281   2.301
  177   1HB   MET  20          1HB       MET  20   4.228  -7.689   0.539
  178   2HB   MET  20          2HB       MET  20   3.540  -6.440  -0.527
  179   1HG   MET  20          1HG       MET  20   6.195  -5.635  -0.017
  180   2HG   MET  20          2HG       MET  20   6.282  -7.381  -0.306
  181   1HE   MET  20          1HE       MET  20   3.937  -4.742  -3.227
  182   2HE   MET  20          2HE       MET  20   3.726  -4.908  -1.467
  183   3HE   MET  20          3HE       MET  20   5.014  -3.864  -2.115
  184    H    ARG  21           H        ARG  21   4.357  -3.645  -0.138
  185    HA   ARG  21           HA       ARG  21   7.131  -2.994   0.629
  186   1HB   ARG  21          1HB       ARG  21   5.235  -2.126  -1.564
  187   2HB   ARG  21          2HB       ARG  21   6.720  -1.210  -1.211
  188   1HG   ARG  21          1HG       ARG  21   8.117  -2.967  -1.846
  189   2HG   ARG  21          2HG       ARG  21   6.878  -4.205  -1.527
  190   1HD   ARG  21          1HD       ARG  21   5.604  -2.850  -3.470
  191   2HD   ARG  21          2HD       ARG  21   7.275  -2.462  -3.932
  192    HE   ARG  21           HE       ARG  21   7.394  -5.159  -3.571
  193   1HH1  ARG  21          2HH2      ARG  21   5.185  -3.043  -5.344
  194   2HH1  ARG  21          1HH2      ARG  21   4.817  -4.231  -6.575
  195   1HH2  ARG  21          2HH1      ARG  21   6.909  -6.728  -5.196
  196   2HH2  ARG  21          1HH1      ARG  21   5.800  -6.332  -6.490
  197    H    ARG  22           H        ARG  22   3.841  -1.548   0.587
  198    HA   ARG  22           HA       ARG  22   4.612   0.935   1.755
  199   1HB   ARG  22          1HB       ARG  22   2.477   0.521   0.547
  200   2HB   ARG  22          2HB       ARG  22   1.944  -0.524   1.885
  201   1HG   ARG  22          1HG       ARG  22   2.858   1.893   3.070
  202   2HG   ARG  22          2HG       ARG  22   1.848   2.365   1.683
  203   1HD   ARG  22          1HD       ARG  22   0.507   2.077   3.757
  204   2HD   ARG  22          2HD       ARG  22   0.027   0.933   2.485
  205    HE   ARG  22           HE       ARG  22   1.837  -0.533   3.867
  206   1HH1  ARG  22          2HH2      ARG  22  -0.886   1.475   4.892
  207   2HH1  ARG  22          1HH2      ARG  22  -1.227   0.524   6.321
  208   1HH2  ARG  22          2HH1      ARG  22   1.388  -1.789   5.755
  209   2HH2  ARG  22          1HH1      ARG  22   0.070  -1.337   6.812
  210    H    ASN  23           H        ASN  23   5.424  -1.813   3.036
  211    HA   ASN  23           HA       ASN  23   4.986  -0.862   5.797
  212   1HB   ASN  23          1HB       ASN  23   3.412  -2.889   4.716
  213   2HB   ASN  23          2HB       ASN  23   4.701  -3.771   5.563
  214   1HD2  ASN  23          1HD2      ASN  23   5.266  -1.984   7.663
  215   2HD2  ASN  23          2HD2      ASN  23   3.877  -1.901   8.725
  216    H    GLN  24           H        GLN  24   7.140  -1.365   3.550
  217    HA   GLN  24           HA       GLN  24   9.255  -2.004   5.383
  218   1HB   GLN  24          1HB       GLN  24   8.238  -4.140   3.502
  219   2HB   GLN  24          2HB       GLN  24   9.957  -4.075   3.961
  220   1HG   GLN  24          1HG       GLN  24   8.808  -3.772   6.404
  221   2HG   GLN  24          2HG       GLN  24   7.559  -4.749   5.602
  222   1HE2  GLN  24          1HE2      GLN  24   8.629  -6.603   4.160
  223   2HE2  GLN  24          2HE2      GLN  24   9.827  -7.561   5.003
  224    H    PHE  25           H        PHE  25   9.543  -3.237   2.133
  225    HA   PHE  25           HA       PHE  25  11.684  -1.842   1.286
  226   1HB   PHE  25          1HB       PHE  25  10.810  -3.414  -0.204
  227   2HB   PHE  25          2HB       PHE  25   9.190  -2.698  -0.167
  228    HD1  PHE  25           1HD      PHE  25   9.180  -0.116  -1.005
  229    HD2  PHE  25           2HD      PHE  25  12.022  -3.127  -2.147
  230    HE1  PHE  25           1HE      PHE  25   9.690   1.151  -3.075
  231    HE2  PHE  25           2HE      PHE  25  12.533  -1.860  -4.217
  232    HZ   PHE  25           HZ       PHE  25  11.366   0.279  -4.681
  233    H    TRP  26           H        TRP  26   8.343  -0.577   1.416
  234    HA   TRP  26           HA       TRP  26   8.657   1.814   0.036
  235   1HB   TRP  26          1HB       TRP  26   6.729   2.514   1.110
  236   2HB   TRP  26          2HB       TRP  26   6.617   0.753   1.239
  237    HD1  TRP  26           HD       TRP  26   6.420  -0.259   3.577
  238    HE1  TRP  26           1HE      TRP  26   6.362   0.631   5.963
  239    HE3  TRP  26           3HE      TRP  26   7.823   4.579   2.668
  240    HZ2  TRP  26           2HZ      TRP  26   6.861   3.137   7.323
  241    HZ3  TRP  26           3HZ      TRP  26   8.021   6.185   4.531
  242    HH2  TRP  26           HH       TRP  26   7.544   5.482   6.858
  243    H    VAL  27           H        VAL  27   9.531   1.048   3.429
  244    HA   VAL  27           HA       VAL  27  10.195   3.481   4.459
  245    HB   VAL  27           HB       VAL  27  11.821   2.350   5.824
  246   1HG1  VAL  27          1HG1      VAL  27   9.239   1.248   5.214
  247   2HG1  VAL  27          2HG1      VAL  27  10.354  -0.100   5.544
  248   3HG1  VAL  27          3HG1      VAL  27  10.130   1.187   6.754
  249   1HG2  VAL  27          1HG2      VAL  27  11.928   0.425   3.481
  250   2HG2  VAL  27          2HG2      VAL  27  13.266   1.310   4.252
  251   3HG2  VAL  27          3HG2      VAL  27  12.490  -0.047   5.103
  252    H    LYS  28           H        LYS  28  12.184   1.561   2.160
  253    HA   LYS  28           HA       LYS  28  14.367   3.383   2.076
  254   1HB   LYS  28          1HB       LYS  28  13.301   1.243   0.220
  255   2HB   LYS  28          2HB       LYS  28  14.715   2.231  -0.219
  256   1HG   LYS  28          1HG       LYS  28  14.515   0.785   2.445
  257   2HG   LYS  28          2HG       LYS  28  15.193   0.009   0.993
  258   1HD   LYS  28          1HD       LYS  28  16.733   2.046   0.791
  259   2HD   LYS  28          2HD       LYS  28  16.195   2.496   2.426
  260   1HE   LYS  28          1HE       LYS  28  17.049   0.455   3.362
  261   2HE   LYS  28          2HE       LYS  28  17.327  -0.242   1.751
  262   1HZ   LYS  28          1HZ       LYS  28  18.695   2.148   2.758
  263   2HZ   LYS  28          2HZ       LYS  28  19.317   0.623   2.849
  264   3HZ   LYS  28          3HZ       LYS  28  19.031   1.311   1.378
  265    H    VAL  29           H        VAL  29  11.294   3.171   0.276
  266    HA   VAL  29           HA       VAL  29  11.731   4.915  -1.813
  267    HB   VAL  29           HB       VAL  29   9.300   4.686   0.003
  268   1HG1  VAL  29          1HG1      VAL  29   8.512   6.449  -1.176
  269   2HG1  VAL  29          2HG1      VAL  29   9.912   6.424  -2.275
  270   3HG1  VAL  29          3HG1      VAL  29   8.509   5.377  -2.597
  271   1HG2  VAL  29          1HG2      VAL  29   9.834   3.457  -2.729
  272   2HG2  VAL  29          2HG2      VAL  29  10.183   2.613  -1.201
  273   3HG2  VAL  29          3HG2      VAL  29   8.511   3.077  -1.599
  274    H    GLN  30           H        GLN  30  11.954   5.587   1.562
  275    HA   GLN  30           HA       GLN  30  11.603   8.494   1.138
  276   1HB   GLN  30          1HB       GLN  30  11.145   8.616   3.368
  277   2HB   GLN  30          2HB       GLN  30  10.811   6.878   3.180
  278   1HG   GLN  30          1HG       GLN  30  13.245   6.442   3.718
  279   2HG   GLN  30          2HG       GLN  30  13.407   8.169   4.104
  280   1HE2  GLN  30          1HE2      GLN  30  13.973   6.283   6.053
  281   2HE2  GLN  30          2HE2      GLN  30  12.729   6.311   7.285
  282    H    ARG  31           H        ARG  31  14.026   6.047   2.123
  283    HA   ARG  31           HA       ARG  31  16.274   6.408   2.696
  284   1HB   ARG  31          1HB       ARG  31  16.292   5.717   0.382
  285   2HB   ARG  31          2HB       ARG  31  15.913   7.367  -0.167
  286   1HG   ARG  31          1HG       ARG  31  18.298   7.002  -0.453
  287   2HG   ARG  31          2HG       ARG  31  18.068   8.139   0.897
  288   1HD   ARG  31          1HD       ARG  31  17.990   5.382   1.832
  289   2HD   ARG  31          2HD       ARG  31  19.495   5.703   0.944
  290    HE   ARG  31           HE       ARG  31  18.717   6.773   3.532
  291   1HH1  ARG  31          2HH2      ARG  31  20.624   7.312   0.604
  292   2HH1  ARG  31          1HH2      ARG  31  21.783   8.363   1.387
  293   1HH2  ARG  31          2HH1      ARG  31  20.247   8.162   4.566
  294   2HH2  ARG  31          1HH1      ARG  31  21.567   8.848   3.646
  295    H    GLY  32           H        GLY  32  16.208   8.005   4.347
  296   1HA   GLY  32          1HA       GLY  32  16.718  10.036   5.288
  297   2HA   GLY  32          2HA       GLY  32  17.686  10.349   3.829
  Start of MODEL    2
    1    HA   PRO   1           HA       PRO   1 -12.956  10.774   1.994
    2   1HB   PRO   1          1HB       PRO   1 -14.531  12.949   1.537
    3   2HB   PRO   1          2HB       PRO   1 -13.442  12.853   2.959
    4   1HG   PRO   1          1HG       PRO   1 -12.875  14.187   0.295
    5   2HG   PRO   1          2HG       PRO   1 -12.710  14.907   1.930
    6   1HD   PRO   1          1HD       PRO   1 -10.575  13.815   0.635
    7   2HD   PRO   1          2HD       PRO   1 -10.789  13.573   2.396
    8    HA   PRO   2           HA       PRO   2 -13.246  10.255  -2.607
    9   1HB   PRO   2          1HB       PRO   2 -13.211   7.531  -2.629
   10   2HB   PRO   2          2HB       PRO   2 -11.709   8.495  -2.440
   11   1HG   PRO   2          1HG       PRO   2 -13.397   7.270  -0.239
   12   2HG   PRO   2          2HG       PRO   2 -11.629   7.090  -0.483
   13   1HD   PRO   2          1HD       PRO   2 -12.645   8.952   1.229
   14   2HD   PRO   2          2HD       PRO   2 -11.239   9.344   0.192
   15    H    LEU   3           H        LEU   3 -15.123  10.009   0.097
   16    HA   LEU   3           HA       LEU   3 -17.444  10.081   0.204
   17   1HB   LEU   3          1HB       LEU   3 -17.070  10.164  -2.530
   18   2HB   LEU   3          2HB       LEU   3 -17.998   8.659  -2.322
   19    HG   LEU   3           HG       LEU   3 -19.535  10.555  -2.594
   20   1HD1  LEU   3          1HD1      LEU   3 -19.596   9.920   0.360
   21   2HD1  LEU   3          2HD1      LEU   3 -20.947  10.037  -0.792
   22   3HD1  LEU   3          3HD1      LEU   3 -19.860   8.628  -0.835
   23   1HD2  LEU   3          1HD2      LEU   3 -17.770  12.186  -1.607
   24   2HD2  LEU   3          2HD2      LEU   3 -19.482  12.488  -1.225
   25   3HD2  LEU   3          3HD2      LEU   3 -18.425  11.712  -0.021
   26    H    SER   4           H        SER   4 -15.312   7.568   0.008
   27    HA   SER   4           HA       SER   4 -15.380   5.496   1.011
   28   1HB   SER   4          1HB       SER   4 -17.481   6.765   2.218
   29   2HB   SER   4          2HB       SER   4 -18.317   5.413   1.415
   30    HG   SER   4           HG       SER   4 -17.453   4.965   3.556
   31    H    GLN   5           H        GLN   5 -15.449   3.497   0.071
   32    HA   GLN   5           HA       GLN   5 -16.288   1.788  -1.282
   33   1HB   GLN   5          1HB       GLN   5 -18.534   3.178  -1.098
   34   2HB   GLN   5          2HB       GLN   5 -18.105   3.683  -2.750
   35   1HG   GLN   5          1HG       GLN   5 -17.618   0.947  -2.783
   36   2HG   GLN   5          2HG       GLN   5 -19.068   1.082  -1.764
   37   1HE2  GLN   5          1HE2      GLN   5 -19.885  -0.180  -3.761
   38   2HE2  GLN   5          2HE2      GLN   5 -20.558   0.786  -5.058
   39    H    GLU   6           H        GLU   6 -15.723   5.071  -2.553
   40    HA   GLU   6           HA       GLU   6 -15.081   4.478  -5.199
   41   1HB   GLU   6          1HB       GLU   6 -14.794   6.657  -3.385
   42   2HB   GLU   6          2HB       GLU   6 -13.210   6.403  -4.157
   43   1HG   GLU   6          1HG       GLU   6 -15.622   6.259  -5.920
   44   2HG   GLU   6          2HG       GLU   6 -15.173   7.863  -5.302
   45    H    THR   7           H        THR   7 -12.937   4.406  -2.304
   46    HA   THR   7           HA       THR   7 -10.830   3.147  -3.946
   47    HB   THR   7           HB       THR   7 -10.263   3.433  -1.100
   48    HG1  THR   7           1HG      THR   7 -11.459   5.177  -0.917
   49   1HG2  THR   7          1HG2      THR   7  -8.666   3.245  -3.069
   50   2HG2  THR   7          2HG2      THR   7  -9.135   4.902  -3.516
   51   3HG2  THR   7          3HG2      THR   7  -8.328   4.595  -1.960
   52    H    PHE   8           H        PHE   8 -11.226   2.428  -0.529
   53    HA   PHE   8           HA       PHE   8 -10.833   0.132   0.163
   54   1HB   PHE   8          1HB       PHE   8 -13.802   0.223  -0.332
   55   2HB   PHE   8          2HB       PHE   8 -12.919  -0.405   1.070
   56    HD1  PHE   8           1HD      PHE   8 -12.940   2.901  -0.729
   57    HD2  PHE   8           2HD      PHE   8 -13.428   0.790   2.980
   58    HE1  PHE   8           1HE      PHE   8 -13.279   5.055   0.452
   59    HE2  PHE   8           2HE      PHE   8 -13.767   2.945   4.161
   60    HZ   PHE   8           HZ       PHE   8 -13.693   5.077   2.897
   61    H    SER   9           H        SER   9 -13.446   0.104  -2.334
   62    HA   SER   9           HA       SER   9 -13.528  -2.466  -3.091
   63   1HB   SER   9          1HB       SER   9 -14.650  -0.501  -4.215
   64   2HB   SER   9          2HB       SER   9 -13.139  -0.233  -5.117
   65    HG   SER   9           HG       SER   9 -14.266  -1.559  -6.400
   66    H    ASP  10           H        ASP  10 -11.083  -0.223  -4.525
   67    HA   ASP  10           HA       ASP  10  -9.422  -2.612  -5.132
   68   1HB   ASP  10          1HB       ASP  10  -9.915   0.018  -6.406
   69   2HB   ASP  10          2HB       ASP  10  -8.216  -0.502  -6.387
   70    H    LEU  11           H        LEU  11  -9.713   0.166  -3.079
   71    HA   LEU  11           HA       LEU  11  -6.938   0.611  -2.546
   72   1HB   LEU  11          1HB       LEU  11  -9.170   1.969  -1.974
   73   2HB   LEU  11          2HB       LEU  11  -9.025   1.071  -0.444
   74    HG   LEU  11           HG       LEU  11  -7.140   3.087  -1.665
   75   1HD1  LEU  11          1HD1      LEU  11  -8.871   2.854   0.634
   76   2HD1  LEU  11          2HD1      LEU  11  -7.190   3.044   1.188
   77   3HD1  LEU  11          3HD1      LEU  11  -7.911   4.255   0.101
   78   1HD2  LEU  11          1HD2      LEU  11  -5.605   1.311  -1.372
   79   2HD2  LEU  11          2HD2      LEU  11  -5.494   2.220   0.154
   80   3HD2  LEU  11          3HD2      LEU  11  -6.438   0.713   0.082
   81    H    TRP  12           H        TRP  12  -9.384  -0.812  -0.307
   82    HA   TRP  12           HA       TRP  12  -7.587  -1.978   1.459
   83   1HB   TRP  12          1HB       TRP  12  -9.496  -2.601   2.413
   84   2HB   TRP  12          2HB       TRP  12 -10.356  -1.980   0.997
   85    HD1  TRP  12           HD       TRP  12 -11.926  -3.640  -0.036
   86    HE1  TRP  12           1HE      TRP  12 -12.151  -6.171  -0.205
   87    HE3  TRP  12           3HE      TRP  12  -7.653  -4.996   2.433
   88    HZ2  TRP  12           2HZ      TRP  12 -10.664  -8.510   0.628
   89    HZ3  TRP  12           3HZ      TRP  12  -7.092  -7.381   2.725
   90    HH2  TRP  12           HH       TRP  12  -8.583  -9.146   1.831
   91    H    LYS  13           H        LYS  13  -8.784  -3.198  -1.672
   92    HA   LYS  13           HA       LYS  13  -7.606  -5.808  -1.389
   93   1HB   LYS  13          1HB       LYS  13  -9.444  -4.696  -3.060
   94   2HB   LYS  13          2HB       LYS  13  -8.003  -4.665  -4.106
   95   1HG   LYS  13          1HG       LYS  13  -8.842  -7.139  -2.551
   96   2HG   LYS  13          2HG       LYS  13  -9.421  -6.802  -4.200
   97   1HD   LYS  13          1HD       LYS  13  -6.710  -6.368  -4.457
   98   2HD   LYS  13          2HD       LYS  13  -6.755  -7.695  -3.271
   99   1HE   LYS  13          1HE       LYS  13  -8.591  -7.926  -5.616
  100   2HE   LYS  13          2HE       LYS  13  -6.855  -8.103  -5.947
  101   1HZ   LYS  13          1HZ       LYS  13  -7.948  -9.546  -3.698
  102   2HZ   LYS  13          2HZ       LYS  13  -8.332 -10.092  -5.206
  103   3HZ   LYS  13          3HZ       LYS  13  -6.751  -9.972  -4.750
  104    H    LEU  14           H        LEU  14  -6.511  -2.652  -2.579
  105    HA   LEU  14           HA       LEU  14  -4.219  -3.517  -3.998
  106   1HB   LEU  14          1HB       LEU  14  -5.366  -1.037  -3.002
  107   2HB   LEU  14          2HB       LEU  14  -3.599  -1.051  -2.783
  108    HG   LEU  14           HG       LEU  14  -4.721  -0.291  -5.096
  109   1HD1  LEU  14          1HD1      LEU  14  -2.463  -2.044  -5.718
  110   2HD1  LEU  14          2HD1      LEU  14  -2.553  -0.267  -5.737
  111   3HD1  LEU  14          3HD1      LEU  14  -2.184  -1.123  -4.221
  112   1HD2  LEU  14          1HD2      LEU  14  -4.101  -2.998  -6.049
  113   2HD2  LEU  14          2HD2      LEU  14  -5.508  -2.970  -4.959
  114   3HD2  LEU  14          3HD2      LEU  14  -5.495  -1.955  -6.422
  115    H    LEU  15           H        LEU  15  -4.674  -2.591  -0.551
  116    HA   LEU  15           HA       LEU  15  -1.944  -2.980   0.184
  117   1HB   LEU  15          1HB       LEU  15  -4.576  -2.850   1.663
  118   2HB   LEU  15          2HB       LEU  15  -3.067  -3.245   2.521
  119    HG   LEU  15           HG       LEU  15  -3.421  -0.799   0.740
  120   1HD1  LEU  15          1HD1      LEU  15  -4.226   0.380   2.511
  121   2HD1  LEU  15          2HD1      LEU  15  -4.662  -1.213   3.176
  122   3HD1  LEU  15          3HD1      LEU  15  -3.137  -0.434   3.660
  123   1HD2  LEU  15          1HD2      LEU  15  -1.107  -1.428   0.939
  124   2HD2  LEU  15          2HD2      LEU  15  -1.368  -0.085   2.078
  125   3HD2  LEU  15          3HD2      LEU  15  -1.282  -1.758   2.679
  126    H    LYS  16           H        LYS  16  -4.374  -5.180  -0.761
  127    HA   LYS  16           HA       LYS  16  -3.578  -7.386   0.941
  128   1HB   LYS  16          1HB       LYS  16  -5.717  -6.785  -0.769
  129   2HB   LYS  16          2HB       LYS  16  -4.860  -8.119  -1.578
  130   1HG   LYS  16          1HG       LYS  16  -4.810  -9.002   1.004
  131   2HG   LYS  16          2HG       LYS  16  -6.338  -8.089   1.008
  132   1HD   LYS  16          1HD       LYS  16  -7.270  -9.412  -0.719
  133   2HD   LYS  16          2HD       LYS  16  -5.681 -10.039  -1.217
  134   1HE   LYS  16          1HE       LYS  16  -5.516 -11.148   1.058
  135   2HE   LYS  16          2HE       LYS  16  -7.208 -10.681   1.335
  136   1HZ   LYS  16          1HZ       LYS  16  -7.921 -12.214  -0.075
  137   2HZ   LYS  16          2HZ       LYS  16  -6.672 -12.031  -1.136
  138   3HZ   LYS  16          3HZ       LYS  16  -6.473 -12.944   0.223
  139    H    LYS  17           H        LYS  17  -1.689  -5.786  -1.040
  140    HA   LYS  17           HA       LYS  17  -0.022  -8.071  -1.627
  141   1HB   LYS  17          1HB       LYS  17  -0.979  -8.546  -3.628
  142   2HB   LYS  17          2HB       LYS  17  -1.830  -6.984  -3.701
  143   1HG   LYS  17          1HG       LYS  17   1.160  -7.316  -4.180
  144   2HG   LYS  17          2HG       LYS  17  -0.055  -7.277  -5.479
  145   1HD   LYS  17          1HD       LYS  17  -0.681  -5.061  -3.875
  146   2HD   LYS  17          2HD       LYS  17   1.098  -5.069  -3.942
  147   1HE   LYS  17          1HE       LYS  17   0.171  -5.702  -6.558
  148   2HE   LYS  17          2HE       LYS  17  -0.795  -4.321  -5.995
  149   1HZ   LYS  17          1HZ       LYS  17   1.562  -4.066  -7.079
  150   2HZ   LYS  17          2HZ       LYS  17   0.990  -3.016  -5.943
  151   3HZ   LYS  17          3HZ       LYS  17   2.039  -4.211  -5.507
  152    H    TRP  18           H        TRP  18  -0.827  -4.629  -2.114
  153    HA   TRP  18           HA       TRP  18   1.879  -3.862  -2.765
  154   1HB   TRP  18          1HB       TRP  18  -0.526  -2.711  -3.083
  155   2HB   TRP  18          2HB       TRP  18  -0.054  -1.933  -1.566
  156    HD1  TRP  18           HD       TRP  18   0.190  -1.509  -5.172
  157    HE1  TRP  18           1HE      TRP  18   1.920   0.238  -5.834
  158    HE3  TRP  18           3HE      TRP  18   2.648  -1.074  -0.704
  159    HZ2  TRP  18           2HZ      TRP  18   4.111   1.659  -4.585
  160    HZ3  TRP  18           3HZ      TRP  18   4.549   0.483  -0.479
  161    HH2  TRP  18           HH       TRP  18   5.291   1.853  -2.405
  162    H    LYS  19           H        LYS  19  -0.142  -3.863   0.198
  163    HA   LYS  19           HA       LYS  19   1.312  -2.477   2.005
  164   1HB   LYS  19          1HB       LYS  19  -0.694  -3.828   2.533
  165   2HB   LYS  19          2HB       LYS  19   0.283  -5.312   2.420
  166   1HG   LYS  19          1HG       LYS  19   1.305  -3.138   4.208
  167   2HG   LYS  19          2HG       LYS  19  -0.131  -4.032   4.759
  168   1HD   LYS  19          1HD       LYS  19   2.177  -5.607   3.655
  169   2HD   LYS  19          2HD       LYS  19   2.342  -4.909   5.284
  170   1HE   LYS  19          1HE       LYS  19   1.019  -6.510   6.143
  171   2HE   LYS  19          2HE       LYS  19  -0.283  -6.074   5.015
  172   1HZ   LYS  19          1HZ       LYS  19   1.756  -8.117   4.770
  173   2HZ   LYS  19          2HZ       LYS  19   0.147  -8.184   4.415
  174   3HZ   LYS  19          3HZ       LYS  19   1.185  -7.411   3.393
  175    H    MET  20           H        MET  20   2.172  -5.728   0.748
  176    HA   MET  20           HA       MET  20   4.252  -6.530   2.249
  177   1HB   MET  20          1HB       MET  20   4.138  -7.884   0.429
  178   2HB   MET  20          2HB       MET  20   3.681  -6.550  -0.657
  179   1HG   MET  20          1HG       MET  20   6.288  -5.927   0.088
  180   2HG   MET  20          2HG       MET  20   6.324  -7.691  -0.074
  181   1HE   MET  20          1HE       MET  20   3.930  -5.287  -2.207
  182   2HE   MET  20          2HE       MET  20   5.343  -4.336  -1.692
  183   3HE   MET  20          3HE       MET  20   5.112  -4.726  -3.413
  184    H    ARG  21           H        ARG  21   4.407  -3.834  -0.118
  185    HA   ARG  21           HA       ARG  21   7.132  -3.192   0.841
  186   1HB   ARG  21          1HB       ARG  21   5.439  -2.410  -1.535
  187   2HB   ARG  21          2HB       ARG  21   6.839  -1.420  -1.058
  188   1HG   ARG  21          1HG       ARG  21   8.368  -3.100  -1.547
  189   2HG   ARG  21          2HG       ARG  21   7.189  -4.402  -1.259
  190   1HD   ARG  21          1HD       ARG  21   5.986  -3.188  -3.350
  191   2HD   ARG  21          2HD       ARG  21   7.673  -2.762  -3.712
  192    HE   ARG  21           HE       ARG  21   7.786  -5.458  -3.162
  193   1HH1  ARG  21          2HH2      ARG  21   5.890  -3.419  -5.341
  194   2HH1  ARG  21          1HH2      ARG  21   5.713  -4.656  -6.565
  195   1HH2  ARG  21          2HH1      ARG  21   7.552  -7.092  -4.779
  196   2HH2  ARG  21          1HH1      ARG  21   6.661  -6.750  -6.245
  197    H    ARG  22           H        ARG  22   3.850  -1.773   0.509
  198    HA   ARG  22           HA       ARG  22   4.519   0.735   1.699
  199   1HB   ARG  22          1HB       ARG  22   2.516   0.400   0.321
  200   2HB   ARG  22          2HB       ARG  22   1.870  -0.754   1.512
  201   1HG   ARG  22          1HG       ARG  22   1.063   1.731   1.614
  202   2HG   ARG  22          2HG       ARG  22   1.522   0.922   3.132
  203   1HD   ARG  22          1HD       ARG  22   2.485   3.267   2.767
  204   2HD   ARG  22          2HD       ARG  22   3.654   1.992   3.176
  205    HE   ARG  22           HE       ARG  22   4.662   2.330   1.133
  206   1HH1  ARG  22          2HH2      ARG  22   1.335   3.522   1.032
  207   2HH1  ARG  22          1HH2      ARG  22   1.476   4.182  -0.582
  208   1HH2  ARG  22          2HH1      ARG  22   4.848   3.202  -0.999
  209   2HH2  ARG  22          1HH1      ARG  22   3.479   3.999  -1.740
  210    H    ASN  23           H        ASN  23   5.245  -1.961   3.091
  211    HA   ASN  23           HA       ASN  23   4.500  -0.998   5.782
  212   1HB   ASN  23          1HB       ASN  23   3.097  -3.068   4.587
  213   2HB   ASN  23          2HB       ASN  23   4.344  -3.923   5.519
  214   1HD2  ASN  23          1HD2      ASN  23   4.419  -3.706   7.809
  215   2HD2  ASN  23          2HD2      ASN  23   3.057  -3.079   8.712
  216    H    GLN  24           H        GLN  24   6.883  -1.475   3.754
  217    HA   GLN  24           HA       GLN  24   8.838  -1.967   5.790
  218   1HB   GLN  24          1HB       GLN  24   8.047  -4.230   3.953
  219   2HB   GLN  24          2HB       GLN  24   9.723  -4.082   4.535
  220   1HG   GLN  24          1HG       GLN  24   8.359  -3.684   6.861
  221   2HG   GLN  24          2HG       GLN  24   7.235  -4.774   6.019
  222   1HE2  GLN  24          1HE2      GLN  24   7.849  -6.233   7.870
  223   2HE2  GLN  24          2HE2      GLN  24   9.274  -7.232   7.681
  224    H    PHE  25           H        PHE  25   9.438  -3.347   2.640
  225    HA   PHE  25           HA       PHE  25  11.614  -1.954   1.904
  226   1HB   PHE  25          1HB       PHE  25  10.868  -3.592   0.413
  227   2HB   PHE  25          2HB       PHE  25   9.248  -2.885   0.289
  228    HD1  PHE  25           1HD      PHE  25   9.303  -0.334  -0.643
  229    HD2  PHE  25           2HD      PHE  25  12.233  -3.374  -1.435
  230    HE1  PHE  25           1HE      PHE  25   9.979   0.856  -2.712
  231    HE2  PHE  25           2HE      PHE  25  12.908  -2.184  -3.503
  232    HZ   PHE  25           HZ       PHE  25  11.782  -0.069  -4.141
  233    H    TRP  26           H        TRP  26   8.258  -0.729   1.693
  234    HA   TRP  26           HA       TRP  26   8.672   1.618   0.267
  235   1HB   TRP  26          1HB       TRP  26   6.649   2.332   1.140
  236   2HB   TRP  26          2HB       TRP  26   6.541   0.574   1.313
  237    HD1  TRP  26           HD       TRP  26   6.141  -0.372   3.653
  238    HE1  TRP  26           1HE      TRP  26   5.855   0.587   5.995
  239    HE3  TRP  26           3HE      TRP  26   7.575   4.454   2.729
  240    HZ2  TRP  26           2HZ      TRP  26   6.204   3.137   7.318
  241    HZ3  TRP  26           3HZ      TRP  26   7.585   6.117   4.553
  242    HH2  TRP  26           HH       TRP  26   6.904   5.477   6.847
  243    H    VAL  27           H        VAL  27   9.237   0.980   3.752
  244    HA   VAL  27           HA       VAL  27   9.781   3.455   4.752
  245    HB   VAL  27           HB       VAL  27  11.284   2.393   6.299
  246   1HG1  VAL  27          1HG1      VAL  27   9.533   1.230   7.110
  247   2HG1  VAL  27          2HG1      VAL  27   8.781   1.239   5.497
  248   3HG1  VAL  27          3HG1      VAL  27   9.875  -0.086   5.962
  249   1HG2  VAL  27          1HG2      VAL  27  11.627   0.387   4.047
  250   2HG2  VAL  27          2HG2      VAL  27  12.879   1.325   4.897
  251   3HG2  VAL  27          3HG2      VAL  27  12.051  -0.013   5.729
  252    H    LYS  28           H        LYS  28  11.996   1.484   2.719
  253    HA   LYS  28           HA       LYS  28  14.157   3.331   2.769
  254   1HB   LYS  28          1HB       LYS  28  13.287   1.117   0.896
  255   2HB   LYS  28          2HB       LYS  28  14.727   2.107   0.558
  256   1HG   LYS  28          1HG       LYS  28  14.249   0.644   3.186
  257   2HG   LYS  28          2HG       LYS  28  15.212  -0.017   1.843
  258   1HD   LYS  28          1HD       LYS  28  16.963   1.051   2.822
  259   2HD   LYS  28          2HD       LYS  28  16.260   2.529   2.123
  260   1HE   LYS  28          1HE       LYS  28  14.749   2.216   4.403
  261   2HE   LYS  28          2HE       LYS  28  16.329   1.602   4.935
  262   1HZ   LYS  28          1HZ       LYS  28  15.572   4.202   4.703
  263   2HZ   LYS  28          2HZ       LYS  28  17.094   3.633   4.984
  264   3HZ   LYS  28          3HZ       LYS  28  16.607   3.959   3.442
  265    H    VAL  29           H        VAL  29  11.263   3.020   0.707
  266    HA   VAL  29           HA       VAL  29  11.872   4.697  -1.395
  267    HB   VAL  29           HB       VAL  29   9.288   4.499   0.201
  268   1HG1  VAL  29          1HG1      VAL  29   8.540   5.120  -2.334
  269   2HG1  VAL  29          2HG1      VAL  29   8.792   6.346  -1.069
  270   3HG1  VAL  29          3HG1      VAL  29  10.079   6.009  -2.250
  271   1HG2  VAL  29          1HG2      VAL  29  10.078   3.188  -2.428
  272   2HG2  VAL  29          2HG2      VAL  29  10.296   2.399  -0.848
  273   3HG2  VAL  29          3HG2      VAL  29   8.663   2.828  -1.410
  274    H    GLN  30           H        GLN  30  11.782   5.486   1.961
  275    HA   GLN  30           HA       GLN  30  11.449   8.374   1.403
  276   1HB   GLN  30          1HB       GLN  30  10.784   8.570   3.575
  277   2HB   GLN  30          2HB       GLN  30  10.477   6.824   3.416
  278   1HG   GLN  30          1HG       GLN  30  12.855   6.429   4.193
  279   2HG   GLN  30          2HG       GLN  30  12.964   8.168   4.541
  280   1HE2  GLN  30          1HE2      GLN  30  12.822   8.487   6.690
  281   2HE2  GLN  30          2HE2      GLN  30  11.672   7.711   7.758
  282    H    ARG  31           H        ARG  31  13.787   5.983   2.683
  283    HA   ARG  31           HA       ARG  31  15.969   6.383   3.452
  284   1HB   ARG  31          1HB       ARG  31  16.263   5.620   1.202
  285   2HB   ARG  31          2HB       ARG  31  15.827   7.211   0.534
  286   1HG   ARG  31          1HG       ARG  31  17.940   7.979   0.768
  287   2HG   ARG  31          2HG       ARG  31  18.029   7.409   2.452
  288   1HD   ARG  31          1HD       ARG  31  18.506   5.118   1.652
  289   2HD   ARG  31          2HD       ARG  31  18.415   5.685  -0.030
  290    HE   ARG  31           HE       ARG  31  20.310   7.301   1.281
  291   1HH1  ARG  31          2HH2      ARG  31  19.832   3.905   0.421
  292   2HH1  ARG  31          1HH2      ARG  31  21.541   3.559   0.278
  293   1HH2  ARG  31          2HH1      ARG  31  22.567   6.843   1.092
  294   2HH2  ARG  31          1HH1      ARG  31  23.100   5.234   0.661
  295    H    GLY  32           H        GLY  32  16.308   8.999   1.137
  296   1HA   GLY  32          1HA       GLY  32  16.110  11.030   3.279
  297   2HA   GLY  32          2HA       GLY  32  17.674  10.823   2.457
  Start of MODEL    3
    1    HA   PRO   1           HA       PRO   1 -10.222   9.179   4.283
    2   1HB   PRO   1          1HB       PRO   1 -11.355  11.657   4.295
    3   2HB   PRO   1          2HB       PRO   1 -10.267  11.108   5.612
    4   1HG   PRO   1          1HG       PRO   1  -9.523  12.763   3.183
    5   2HG   PRO   1          2HG       PRO   1  -9.178  13.138   4.903
    6   1HD   PRO   1          1HD       PRO   1  -7.330  11.914   3.317
    7   2HD   PRO   1          2HD       PRO   1  -7.541  11.407   5.021
    8    HA   PRO   2           HA       PRO   2 -10.858   9.359  -0.257
    9   1HB   PRO   2          1HB       PRO   2 -11.865   6.841  -0.510
   10   2HB   PRO   2          2HB       PRO   2 -10.110   7.139  -0.294
   11   1HG   PRO   2          1HG       PRO   2 -12.135   6.452   1.854
   12   2HG   PRO   2          2HG       PRO   2 -10.570   5.636   1.533
   13   1HD   PRO   2          1HD       PRO   2 -10.797   7.579   3.431
   14   2HD   PRO   2          2HD       PRO   2  -9.349   7.500   2.381
   15    H    LEU   3           H        LEU   3 -13.142   8.032  -1.214
   16    HA   LEU   3           HA       LEU   3 -15.251   9.667   0.065
   17   1HB   LEU   3          1HB       LEU   3 -14.869   8.374  -2.640
   18   2HB   LEU   3          2HB       LEU   3 -16.486   8.877  -2.092
   19    HG   LEU   3           HG       LEU   3 -15.018  11.093  -1.444
   20   1HD1  LEU   3          1HD1      LEU   3 -13.576   9.577  -3.573
   21   2HD1  LEU   3          2HD1      LEU   3 -13.802  11.318  -3.862
   22   3HD1  LEU   3          3HD1      LEU   3 -12.957  10.762  -2.398
   23   1HD2  LEU   3          1HD2      LEU   3 -16.295  12.123  -3.070
   24   2HD2  LEU   3          2HD2      LEU   3 -15.947  10.872  -4.287
   25   3HD2  LEU   3          3HD2      LEU   3 -17.139  10.558  -3.004
   26    H    SER   4           H        SER   4 -14.037   6.878   0.875
   27    HA   SER   4           HA       SER   4 -14.860   5.011   1.912
   28   1HB   SER   4          1HB       SER   4 -17.674   6.062   1.661
   29   2HB   SER   4          2HB       SER   4 -16.916   5.169   3.001
   30    HG   SER   4           HG       SER   4 -17.151   7.380   3.490
   31    H    GLN   5           H        GLN   5 -14.939   3.091   0.918
   32    HA   GLN   5           HA       GLN   5 -15.733   1.394  -0.427
   33   1HB   GLN   5          1HB       GLN   5 -17.979   1.572  -0.508
   34   2HB   GLN   5          2HB       GLN   5 -17.912   3.351  -0.509
   35   1HG   GLN   5          1HG       GLN   5 -17.530   3.410  -2.891
   36   2HG   GLN   5          2HG       GLN   5 -17.299   1.649  -2.953
   37   1HE2  GLN   5          1HE2      GLN   5 -19.343   3.746  -4.100
   38   2HE2  GLN   5          2HE2      GLN   5 -20.890   2.981  -3.803
   39    H    GLU   6           H        GLU   6 -15.805   4.633  -2.008
   40    HA   GLU   6           HA       GLU   6 -15.305   4.038  -4.610
   41   1HB   GLU   6          1HB       GLU   6 -15.119   6.286  -3.056
   42   2HB   GLU   6          2HB       GLU   6 -13.417   6.044  -3.519
   43   1HG   GLU   6          1HG       GLU   6 -13.817   6.496  -5.718
   44   2HG   GLU   6          2HG       GLU   6 -15.384   5.658  -5.708
   45    H    THR   7           H        THR   7 -12.843   4.027  -1.985
   46    HA   THR   7           HA       THR   7 -10.904   2.829  -3.870
   47    HB   THR   7           HB       THR   7 -10.040   3.192  -1.094
   48    HG1  THR   7           1HG      THR   7 -11.133   5.365  -2.556
   49   1HG2  THR   7          1HG2      THR   7  -8.205   4.325  -2.189
   50   2HG2  THR   7          2HG2      THR   7  -8.636   2.918  -3.190
   51   3HG2  THR   7          3HG2      THR   7  -9.160   4.549  -3.675
   52    H    PHE   8           H        PHE   8 -10.803   2.134  -0.436
   53    HA   PHE   8           HA       PHE   8 -10.259  -0.155   0.191
   54   1HB   PHE   8          1HB       PHE   8 -13.269  -0.122   0.183
   55   2HB   PHE   8          2HB       PHE   8 -12.157  -0.703   1.433
   56    HD1  PHE   8           1HD      PHE   8 -12.582   2.562  -0.391
   57    HD2  PHE   8           2HD      PHE   8 -12.346   0.522   3.382
   58    HE1  PHE   8           1HE      PHE   8 -12.779   4.732   0.794
   59    HE2  PHE   8           2HE      PHE   8 -12.543   2.692   4.567
   60    HZ   PHE   8           HZ       PHE   8 -12.760   4.797   3.273
   61    H    SER   9           H        SER   9 -13.243  -0.240  -1.846
   62    HA   SER   9           HA       SER   9 -13.390  -2.823  -2.567
   63   1HB   SER   9          1HB       SER   9 -14.716  -0.849  -3.480
   64   2HB   SER   9          2HB       SER   9 -13.408  -0.629  -4.667
   65    HG   SER   9           HG       SER   9 -14.070  -2.330  -5.702
   66    H    ASP  10           H        ASP  10 -11.290  -0.522  -4.401
   67    HA   ASP  10           HA       ASP  10  -9.766  -2.844  -5.414
   68   1HB   ASP  10          1HB       ASP  10 -10.640  -0.436  -6.546
   69   2HB   ASP  10          2HB       ASP  10  -8.897  -0.201  -6.297
   70    H    LEU  11           H        LEU  11  -9.568  -0.111  -3.205
   71    HA   LEU  11           HA       LEU  11  -6.720  -0.022  -2.975
   72   1HB   LEU  11          1HB       LEU  11  -8.765   1.535  -2.110
   73   2HB   LEU  11          2HB       LEU  11  -8.403   0.647  -0.610
   74    HG   LEU  11           HG       LEU  11  -5.958   1.235  -0.970
   75   1HD1  LEU  11          1HD1      LEU  11  -6.487   3.569  -2.603
   76   2HD1  LEU  11          2HD1      LEU  11  -5.319   2.254  -2.876
   77   3HD1  LEU  11          3HD1      LEU  11  -6.988   2.099  -3.475
   78   1HD2  LEU  11          1HD2      LEU  11  -8.170   2.889  -0.085
   79   2HD2  LEU  11          2HD2      LEU  11  -6.517   2.786   0.567
   80   3HD2  LEU  11          3HD2      LEU  11  -6.881   3.912  -0.763
   81    H    TRP  12           H        TRP  12  -9.111  -1.244  -0.558
   82    HA   TRP  12           HA       TRP  12  -7.318  -2.616   1.054
   83   1HB   TRP  12          1HB       TRP  12  -9.213  -3.089   2.116
   84   2HB   TRP  12          2HB       TRP  12 -10.104  -2.372   0.766
   85    HD1  TRP  12           HD       TRP  12 -11.875  -3.878  -0.173
   86    HE1  TRP  12           1HE      TRP  12 -12.315  -6.379  -0.369
   87    HE3  TRP  12           3HE      TRP  12  -7.565  -5.626   1.963
   88    HZ2  TRP  12           2HZ      TRP  12 -10.968  -8.847   0.316
   89    HZ3  TRP  12           3HZ      TRP  12  -7.180  -8.054   2.173
   90    HH2  TRP  12           HH       TRP  12  -8.867  -9.674   1.357
   91    H    LYS  13           H        LYS  13  -8.847  -3.662  -2.000
   92    HA   LYS  13           HA       LYS  13  -7.822  -6.354  -1.847
   93   1HB   LYS  13          1HB       LYS  13  -9.810  -5.293  -3.235
   94   2HB   LYS  13          2HB       LYS  13  -8.531  -5.000  -4.438
   95   1HG   LYS  13          1HG       LYS  13  -7.898  -7.420  -4.288
   96   2HG   LYS  13          2HG       LYS  13  -9.272  -7.679  -3.188
   97   1HD   LYS  13          1HD       LYS  13 -10.814  -6.827  -4.954
   98   2HD   LYS  13          2HD       LYS  13  -9.426  -6.655  -6.055
   99   1HE   LYS  13          1HE       LYS  13  -9.173  -8.935  -6.320
  100   2HE   LYS  13          2HE       LYS  13  -9.815  -9.302  -4.704
  101   1HZ   LYS  13          1HZ       LYS  13 -11.802  -8.121  -6.243
  102   2HZ   LYS  13          2HZ       LYS  13 -11.146  -9.363  -7.108
  103   3HZ   LYS  13          3HZ       LYS  13 -11.758  -9.640  -5.601
  104    H    LEU  14           H        LEU  14  -6.653  -3.248  -3.072
  105    HA   LEU  14           HA       LEU  14  -4.503  -4.380  -4.637
  106   1HB   LEU  14          1HB       LEU  14  -5.405  -1.668  -3.748
  107   2HB   LEU  14          2HB       LEU  14  -3.701  -1.853  -4.226
  108    HG   LEU  14           HG       LEU  14  -5.880  -1.496  -5.953
  109   1HD1  LEU  14          1HD1      LEU  14  -3.236  -1.261  -6.124
  110   2HD1  LEU  14          2HD1      LEU  14  -3.366  -2.861  -6.892
  111   3HD1  LEU  14          3HD1      LEU  14  -4.226  -1.467  -7.589
  112   1HD2  LEU  14          1HD2      LEU  14  -6.146  -4.080  -5.312
  113   2HD2  LEU  14          2HD2      LEU  14  -6.404  -3.507  -6.978
  114   3HD2  LEU  14          3HD2      LEU  14  -4.857  -4.262  -6.526
  115    H    LEU  15           H        LEU  15  -4.889  -3.109  -1.319
  116    HA   LEU  15           HA       LEU  15  -2.108  -3.168  -0.657
  117   1HB   LEU  15          1HB       LEU  15  -4.652  -2.619   0.630
  118   2HB   LEU  15          2HB       LEU  15  -3.619  -3.611   1.688
  119    HG   LEU  15           HG       LEU  15  -1.725  -1.978   1.147
  120   1HD1  LEU  15          1HD1      LEU  15  -2.446   0.265   0.356
  121   2HD1  LEU  15          2HD1      LEU  15  -2.743  -0.990  -0.871
  122   3HD1  LEU  15          3HD1      LEU  15  -4.093  -0.363   0.106
  123   1HD2  LEU  15          1HD2      LEU  15  -2.289  -0.681   2.986
  124   2HD2  LEU  15          2HD2      LEU  15  -3.970  -0.459   2.447
  125   3HD2  LEU  15          3HD2      LEU  15  -3.466  -2.003   3.174
  126    H    LYS  16           H        LYS  16  -4.335  -5.655  -1.322
  127    HA   LYS  16           HA       LYS  16  -3.397  -7.616   0.568
  128   1HB   LYS  16          1HB       LYS  16  -5.523  -7.409  -1.154
  129   2HB   LYS  16          2HB       LYS  16  -4.476  -8.556  -2.023
  130   1HG   LYS  16          1HG       LYS  16  -4.339  -9.987  -0.037
  131   2HG   LYS  16          2HG       LYS  16  -5.289  -8.813   0.904
  132   1HD   LYS  16          1HD       LYS  16  -7.239  -9.173  -0.482
  133   2HD   LYS  16          2HD       LYS  16  -6.304 -10.156  -1.633
  134   1HE   LYS  16          1HE       LYS  16  -5.785 -11.682   0.397
  135   2HE   LYS  16          2HE       LYS  16  -7.117 -10.829   1.209
  136   1HZ   LYS  16          1HZ       LYS  16  -7.202 -12.580  -1.109
  137   2HZ   LYS  16          2HZ       LYS  16  -8.152 -12.576   0.239
  138   3HZ   LYS  16          3HZ       LYS  16  -8.364 -11.425  -0.922
  139    H    LYS  17           H        LYS  17  -1.531  -6.013  -1.418
  140    HA   LYS  17           HA       LYS  17   0.373  -8.163  -1.707
  141   1HB   LYS  17          1HB       LYS  17  -0.338  -8.890  -3.725
  142   2HB   LYS  17          2HB       LYS  17  -1.407  -7.485  -3.951
  143   1HG   LYS  17          1HG       LYS  17   1.619  -7.457  -4.319
  144   2HG   LYS  17          2HG       LYS  17   0.431  -7.559  -5.640
  145   1HD   LYS  17          1HD       LYS  17  -0.390  -5.389  -4.004
  146   2HD   LYS  17          2HD       LYS  17   1.370  -5.219  -4.207
  147   1HE   LYS  17          1HE       LYS  17  -0.252  -5.935  -6.624
  148   2HE   LYS  17          2HE       LYS  17  -0.370  -4.269  -6.018
  149   1HZ   LYS  17          1HZ       LYS  17   1.365  -4.444  -7.600
  150   2HZ   LYS  17          2HZ       LYS  17   2.036  -4.168  -6.119
  151   3HZ   LYS  17          3HZ       LYS  17   2.088  -5.679  -6.779
  152    H    TRP  18           H        TRP  18  -0.718  -4.860  -2.048
  153    HA   TRP  18           HA       TRP  18   1.990  -3.904  -2.708
  154   1HB   TRP  18          1HB       TRP  18  -0.509  -3.040  -3.379
  155   2HB   TRP  18          2HB       TRP  18  -0.161  -1.999  -1.992
  156    HD1  TRP  18           HD       TRP  18   0.188  -2.078  -5.589
  157    HE1  TRP  18           1HE      TRP  18   1.882  -0.385  -6.456
  158    HE3  TRP  18           3HE      TRP  18   2.536  -0.954  -1.182
  159    HZ2  TRP  18           2HZ      TRP  18   4.004   1.261  -5.378
  160    HZ3  TRP  18           3HZ      TRP  18   4.386   0.678  -1.142
  161    HH2  TRP  18           HH       TRP  18   5.131   1.792  -3.226
  162    H    LYS  19           H        LYS  19  -0.418  -3.791  -0.050
  163    HA   LYS  19           HA       LYS  19   0.758  -2.084   1.734
  164   1HB   LYS  19          1HB       LYS  19  -1.332  -3.593   1.965
  165   2HB   LYS  19          2HB       LYS  19  -0.209  -4.816   2.609
  166   1HG   LYS  19          1HG       LYS  19   0.617  -2.748   4.091
  167   2HG   LYS  19          2HG       LYS  19  -1.036  -2.170   3.771
  168   1HD   LYS  19          1HD       LYS  19  -1.760  -3.536   5.415
  169   2HD   LYS  19          2HD       LYS  19  -1.289  -4.920   4.400
  170   1HE   LYS  19          1HE       LYS  19   0.955  -4.915   5.349
  171   2HE   LYS  19          2HE       LYS  19   0.602  -3.434   6.266
  172   1HZ   LYS  19          1HZ       LYS  19  -1.090  -4.671   7.441
  173   2HZ   LYS  19          2HZ       LYS  19  -0.688  -6.046   6.624
  174   3HZ   LYS  19          3HZ       LYS  19   0.402  -5.343   7.643
  175    H    MET  20           H        MET  20   1.593  -5.576   1.361
  176    HA   MET  20           HA       MET  20   3.487  -6.005   3.206
  177   1HB   MET  20          1HB       MET  20   4.844  -7.122   1.251
  178   2HB   MET  20          2HB       MET  20   3.220  -7.729   1.656
  179   1HG   MET  20          1HG       MET  20   2.603  -7.326  -0.457
  180   2HG   MET  20          2HG       MET  20   2.791  -5.596  -0.126
  181   1HE   MET  20          1HE       MET  20   3.512  -5.176  -3.049
  182   2HE   MET  20          2HE       MET  20   3.631  -4.290  -1.509
  183   3HE   MET  20          3HE       MET  20   5.055  -4.429  -2.570
  184    H    ARG  21           H        ARG  21   3.960  -3.969   0.295
  185    HA   ARG  21           HA       ARG  21   6.657  -3.237   1.243
  186   1HB   ARG  21          1HB       ARG  21   5.089  -2.968  -1.305
  187   2HB   ARG  21          2HB       ARG  21   6.399  -1.806  -0.984
  188   1HG   ARG  21          1HG       ARG  21   7.937  -3.743  -0.545
  189   2HG   ARG  21          2HG       ARG  21   6.626  -4.844  -1.030
  190   1HD   ARG  21          1HD       ARG  21   6.713  -2.959  -3.090
  191   2HD   ARG  21          2HD       ARG  21   8.424  -3.224  -2.689
  192    HE   ARG  21           HE       ARG  21   7.498  -5.769  -2.823
  193   1HH1  ARG  21          2HH2      ARG  21   7.117  -2.969  -4.949
  194   2HH1  ARG  21          1HH2      ARG  21   6.988  -3.923  -6.409
  195   1HH2  ARG  21          2HH1      ARG  21   7.326  -7.029  -4.752
  196   2HH2  ARG  21          1HH1      ARG  21   7.107  -6.238  -6.297
  197    H    ARG  22           H        ARG  22   3.494  -1.720   0.436
  198    HA   ARG  22           HA       ARG  22   4.269   0.912   1.229
  199   1HB   ARG  22          1HB       ARG  22   2.355   0.486  -0.236
  200   2HB   ARG  22          2HB       ARG  22   1.538  -0.422   1.059
  201   1HG   ARG  22          1HG       ARG  22   0.911   2.094   0.698
  202   2HG   ARG  22          2HG       ARG  22   1.178   1.509   2.358
  203   1HD   ARG  22          1HD       ARG  22   2.343   3.699   1.757
  204   2HD   ARG  22          2HD       ARG  22   3.388   2.427   2.426
  205    HE   ARG  22           HE       ARG  22   4.555   2.407   0.442
  206   1HH1  ARG  22          2HH2      ARG  22   1.340   3.782  -0.080
  207   2HH1  ARG  22          1HH2      ARG  22   1.640   4.200  -1.752
  208   1HH2  ARG  22          2HH1      ARG  22   4.952   2.959  -1.767
  209   2HH2  ARG  22          1HH1      ARG  22   3.699   3.731  -2.714
  210    H    ASN  23           H        ASN  23   4.747  -1.482   3.127
  211    HA   ASN  23           HA       ASN  23   3.885  -0.024   5.537
  212   1HB   ASN  23          1HB       ASN  23   2.426  -2.227   4.585
  213   2HB   ASN  23          2HB       ASN  23   3.458  -2.887   5.872
  214   1HD2  ASN  23          1HD2      ASN  23   2.499  -2.896   7.819
  215   2HD2  ASN  23          2HD2      ASN  23   1.377  -1.689   8.410
  216    H    GLN  24           H        GLN  24   6.354  -0.971   3.854
  217    HA   GLN  24           HA       GLN  24   8.057  -1.385   6.143
  218   1HB   GLN  24          1HB       GLN  24   7.374  -3.710   4.326
  219   2HB   GLN  24          2HB       GLN  24   8.928  -3.626   5.190
  220   1HG   GLN  24          1HG       GLN  24   7.305  -3.045   7.247
  221   2HG   GLN  24          2HG       GLN  24   6.150  -3.971   6.266
  222   1HE2  GLN  24          1HE2      GLN  24   6.256  -6.176   6.257
  223   2HE2  GLN  24          2HE2      GLN  24   7.524  -7.109   7.022
  224    H    PHE  25           H        PHE  25   8.966  -3.032   3.224
  225    HA   PHE  25           HA       PHE  25  11.264  -1.734   2.663
  226   1HB   PHE  25          1HB       PHE  25  10.652  -3.558   1.303
  227   2HB   PHE  25          2HB       PHE  25   9.129  -2.797   0.811
  228    HD1  PHE  25           1HD      PHE  25   9.512  -0.395  -0.391
  229    HD2  PHE  25           2HD      PHE  25  12.331  -3.634  -0.280
  230    HE1  PHE  25           1HE      PHE  25  10.611   0.492  -2.429
  231    HE2  PHE  25           2HE      PHE  25  13.430  -2.747  -2.318
  232    HZ   PHE  25           HZ       PHE  25  12.571  -0.684  -3.393
  233    H    TRP  26           H        TRP  26   7.998  -0.597   1.684
  234    HA   TRP  26           HA       TRP  26   8.606   1.571   0.121
  235   1HB   TRP  26          1HB       TRP  26   6.509   2.390   0.651
  236   2HB   TRP  26          2HB       TRP  26   6.354   0.675   1.058
  237    HD1  TRP  26           HD       TRP  26   5.671   0.075   3.444
  238    HE1  TRP  26           1HE      TRP  26   5.149   1.358   5.582
  239    HE3  TRP  26           3HE      TRP  26   7.304   4.713   2.023
  240    HZ2  TRP  26           2HZ      TRP  26   5.403   4.067   6.566
  241    HZ3  TRP  26           3HZ      TRP  26   7.148   6.617   3.585
  242    HH2  TRP  26           HH       TRP  26   6.202   6.312   5.854
  243    H    VAL  27           H        VAL  27   8.769   1.389   3.700
  244    HA   VAL  27           HA       VAL  27   9.249   3.982   4.411
  245    HB   VAL  27           HB       VAL  27  10.552   3.121   6.256
  246   1HG1  VAL  27          1HG1      VAL  27   8.613   2.236   6.990
  247   2HG1  VAL  27          2HG1      VAL  27   8.099   1.896   5.320
  248   3HG1  VAL  27          3HG1      VAL  27   9.065   0.698   6.216
  249   1HG2  VAL  27          1HG2      VAL  27  11.146   0.561   6.067
  250   2HG2  VAL  27          2HG2      VAL  27  11.070   0.865   4.315
  251   3HG2  VAL  27          3HG2      VAL  27  12.224   1.768   5.326
  252    H    LYS  28           H        LYS  28  11.605   1.719   2.919
  253    HA   LYS  28           HA       LYS  28  13.816   3.514   3.000
  254   1HB   LYS  28          1HB       LYS  28  13.106   1.100   1.311
  255   2HB   LYS  28          2HB       LYS  28  14.629   1.994   1.089
  256   1HG   LYS  28          1HG       LYS  28  13.699   0.905   3.775
  257   2HG   LYS  28          2HG       LYS  28  14.776   0.012   2.675
  258   1HD   LYS  28          1HD       LYS  28  16.551   1.198   3.396
  259   2HD   LYS  28          2HD       LYS  28  15.738   2.723   2.967
  260   1HE   LYS  28          1HE       LYS  28  14.424   2.476   5.148
  261   2HE   LYS  28          2HE       LYS  28  15.557   1.176   5.576
  262   1HZ   LYS  28          1HZ       LYS  28  16.854   2.755   6.313
  263   2HZ   LYS  28          2HZ       LYS  28  17.098   3.255   4.760
  264   3HZ   LYS  28          3HZ       LYS  28  15.922   3.958   5.679
  265    H    VAL  29           H        VAL  29  11.167   2.988   0.673
  266    HA   VAL  29           HA       VAL  29  12.077   4.345  -1.550
  267    HB   VAL  29           HB       VAL  29   9.321   4.423  -0.261
  268   1HG1  VAL  29          1HG1      VAL  29   9.038   4.663  -3.015
  269   2HG1  VAL  29          2HG1      VAL  29   8.898   5.994  -1.842
  270   3HG1  VAL  29          3HG1      VAL  29  10.445   5.696  -2.669
  271   1HG2  VAL  29          1HG2      VAL  29  10.371   2.178  -0.893
  272   2HG2  VAL  29          2HG2      VAL  29   8.825   2.557  -1.689
  273   3HG2  VAL  29          3HG2      VAL  29  10.354   2.747  -2.580
  274    H    GLN  30           H        GLN  30  11.642   5.588   1.635
  275    HA   GLN  30           HA       GLN  30  11.479   8.378   0.660
  276   1HB   GLN  30          1HB       GLN  30  10.574   8.885   2.691
  277   2HB   GLN  30          2HB       GLN  30  10.224   7.140   2.732
  278   1HG   GLN  30          1HG       GLN  30  12.476   6.804   3.836
  279   2HG   GLN  30          2HG       GLN  30  12.615   8.572   3.953
  280   1HE2  GLN  30          1HE2      GLN  30  12.590   8.647   6.221
  281   2HE2  GLN  30          2HE2      GLN  30  11.161   8.268   7.157
  282    H    ARG  31           H        ARG  31  13.559   6.142   2.531
  283    HA   ARG  31           HA       ARG  31  15.649   6.603   3.496
  284   1HB   ARG  31          1HB       ARG  31  16.133   5.514   1.401
  285   2HB   ARG  31          2HB       ARG  31  15.916   7.033   0.499
  286   1HG   ARG  31          1HG       ARG  31  17.826   7.528   2.572
  287   2HG   ARG  31          2HG       ARG  31  18.300   6.019   1.756
  288   1HD   ARG  31          1HD       ARG  31  18.021   7.206  -0.449
  289   2HD   ARG  31          2HD       ARG  31  17.743   8.712   0.451
  290    HE   ARG  31           HE       ARG  31  20.167   7.560   1.369
  291   1HH1  ARG  31          2HH2      ARG  31  18.766   9.041  -1.520
  292   2HH1  ARG  31          1HH2      ARG  31  20.291   9.671  -2.103
  293   1HH2  ARG  31          2HH1      ARG  31  22.181   8.392   0.599
  294   2HH2  ARG  31          1HH1      ARG  31  22.237   9.301  -0.895
  295    H    GLY  32           H        GLY  32  15.029   8.537   4.720
  296   1HA   GLY  32          1HA       GLY  32  16.770  10.640   4.570
  297   2HA   GLY  32          2HA       GLY  32  15.439  11.148   3.505
  Start of MODEL    4
    1    HA   PRO   1           HA       PRO   1 -15.668  12.293  -0.639
    2   1HB   PRO   1          1HB       PRO   1 -16.594  13.800   1.433
    3   2HB   PRO   1          2HB       PRO   1 -15.646  14.519   0.091
    4   1HG   PRO   1          1HG       PRO   1 -18.664  14.426   0.367
    5   2HG   PRO   1          2HG       PRO   1 -17.645  15.867   0.045
    6   1HD   PRO   1          1HD       PRO   1 -18.848  14.496  -1.981
    7   2HD   PRO   1          2HD       PRO   1 -17.184  15.127  -2.175
    8    HA   PRO   2           HA       PRO   2 -19.320   9.610   0.430
    9   1HB   PRO   2          1HB       PRO   2 -18.232   7.234  -0.341
   10   2HB   PRO   2          2HB       PRO   2 -18.942   8.378  -1.527
   11   1HG   PRO   2          1HG       PRO   2 -16.023   8.106  -0.757
   12   2HG   PRO   2          2HG       PRO   2 -16.718   8.089  -2.410
   13   1HD   PRO   2          1HD       PRO   2 -15.697  10.369  -1.322
   14   2HD   PRO   2          2HD       PRO   2 -17.190  10.424  -2.308
   15    H    LEU   3           H        LEU   3 -18.692   7.127   1.525
   16    HA   LEU   3           HA       LEU   3 -17.163   7.969   3.917
   17   1HB   LEU   3          1HB       LEU   3 -19.590   6.567   3.502
   18   2HB   LEU   3          2HB       LEU   3 -18.425   5.371   4.118
   19    HG   LEU   3           HG       LEU   3 -19.670   6.601   5.934
   20   1HD1  LEU   3          1HD1      LEU   3 -16.662   7.065   5.751
   21   2HD1  LEU   3          2HD1      LEU   3 -17.622   7.149   7.247
   22   3HD1  LEU   3          3HD1      LEU   3 -17.466   5.605   6.375
   23   1HD2  LEU   3          1HD2      LEU   3 -19.214   8.940   6.325
   24   2HD2  LEU   3          2HD2      LEU   3 -17.996   8.977   5.027
   25   3HD2  LEU   3          3HD2      LEU   3 -19.719   8.780   4.625
   26    H    SER   4           H        SER   4 -17.384   5.381   1.447
   27    HA   SER   4           HA       SER   4 -14.649   4.938   1.223
   28   1HB   SER   4          1HB       SER   4 -14.464   2.768   2.557
   29   2HB   SER   4          2HB       SER   4 -14.489   4.270   3.512
   30    HG   SER   4           HG       SER   4 -16.509   3.856   4.145
   31    H    GLN   5           H        GLN   5 -14.591   4.050  -0.748
   32    HA   GLN   5           HA       GLN   5 -15.617   1.556  -1.440
   33   1HB   GLN   5          1HB       GLN   5 -17.566   2.302  -2.907
   34   2HB   GLN   5          2HB       GLN   5 -17.862   2.329  -1.153
   35   1HG   GLN   5          1HG       GLN   5 -16.937   4.819  -1.393
   36   2HG   GLN   5          2HG       GLN   5 -17.485   4.613  -3.071
   37   1HE2  GLN   5          1HE2      GLN   5 -18.963   6.437  -2.344
   38   2HE2  GLN   5          2HE2      GLN   5 -20.486   5.985  -1.610
   39    H    GLU   6           H        GLU   6 -15.483   4.902  -2.791
   40    HA   GLU   6           HA       GLU   6 -14.852   4.480  -5.387
   41   1HB   GLU   6          1HB       GLU   6 -14.818   6.650  -3.931
   42   2HB   GLU   6          2HB       GLU   6 -13.079   6.309  -3.763
   43   1HG   GLU   6          1HG       GLU   6 -13.084   7.617  -5.686
   44   2HG   GLU   6          2HG       GLU   6 -13.201   5.988  -6.386
   45    H    THR   7           H        THR   7 -12.219   4.715  -2.923
   46    HA   THR   7           HA       THR   7 -10.451   3.220  -4.723
   47    HB   THR   7           HB       THR   7  -9.473   3.794  -2.015
   48    HG1  THR   7           1HG      THR   7 -10.154   5.757  -1.870
   49   1HG2  THR   7          1HG2      THR   7  -7.664   4.826  -3.297
   50   2HG2  THR   7          2HG2      THR   7  -8.103   3.274  -4.050
   51   3HG2  THR   7          3HG2      THR   7  -8.658   4.804  -4.773
   52    H    PHE   8           H        PHE   8 -10.337   2.823  -1.220
   53    HA   PHE   8           HA       PHE   8  -9.779   0.591  -0.407
   54   1HB   PHE   8          1HB       PHE   8 -12.789   0.630  -0.421
   55   2HB   PHE   8          2HB       PHE   8 -11.680   0.146   0.873
   56    HD1  PHE   8           1HD      PHE   8 -12.080   3.258  -1.207
   57    HD2  PHE   8           2HD      PHE   8 -11.875   1.522   2.717
   58    HE1  PHE   8           1HE      PHE   8 -12.269   5.516  -0.199
   59    HE2  PHE   8           2HE      PHE   8 -12.064   3.780   3.725
   60    HZ   PHE   8           HZ       PHE   8 -12.261   5.777   2.267
   61    H    SER   9           H        SER   9 -12.750   0.352  -2.453
   62    HA   SER   9           HA       SER   9 -12.922  -2.279  -2.952
   63   1HB   SER   9          1HB       SER   9 -14.231  -0.415  -4.051
   64   2HB   SER   9          2HB       SER   9 -12.889  -0.240  -5.207
   65    HG   SER   9           HG       SER   9 -14.278  -1.657  -6.127
   66    H    ASP  10           H        ASP  10 -10.781  -0.181  -4.974
   67    HA   ASP  10           HA       ASP  10  -9.268  -2.600  -5.744
   68   1HB   ASP  10          1HB       ASP  10  -9.888   0.007  -6.924
   69   2HB   ASP  10          2HB       ASP  10  -8.156  -0.380  -7.015
   70    H    LEU  11           H        LEU  11  -9.068   0.313  -3.782
   71    HA   LEU  11           HA       LEU  11  -6.222   0.403  -3.530
   72   1HB   LEU  11          1HB       LEU  11  -8.269   2.036  -2.818
   73   2HB   LEU  11          2HB       LEU  11  -7.918   1.280  -1.246
   74    HG   LEU  11           HG       LEU  11  -5.477   1.834  -1.618
   75   1HD1  LEU  11          1HD1      LEU  11  -6.449   2.431  -4.220
   76   2HD1  LEU  11          2HD1      LEU  11  -5.962   3.984  -3.500
   77   3HD1  LEU  11          3HD1      LEU  11  -4.792   2.646  -3.606
   78   1HD2  LEU  11          1HD2      LEU  11  -6.471   4.522  -1.746
   79   2HD2  LEU  11          2HD2      LEU  11  -7.672   3.534  -0.881
   80   3HD2  LEU  11          3HD2      LEU  11  -5.988   3.592  -0.307
   81    H    TRP  12           H        TRP  12  -8.638  -0.587  -1.034
   82    HA   TRP  12           HA       TRP  12  -6.868  -1.832   0.700
   83   1HB   TRP  12          1HB       TRP  12  -8.774  -2.198   1.785
   84   2HB   TRP  12          2HB       TRP  12  -9.650  -1.590   0.373
   85    HD1  TRP  12           HD       TRP  12 -11.427  -3.155  -0.451
   86    HE1  TRP  12           1HE      TRP  12 -11.890  -5.660  -0.436
   87    HE3  TRP  12           3HE      TRP  12  -7.150  -4.753   1.863
   88    HZ2  TRP  12           2HZ      TRP  12 -10.571  -8.072   0.468
   89    HZ3  TRP  12           3HZ      TRP  12  -6.789  -7.157   2.283
   90    HH2  TRP  12           HH       TRP  12  -8.486  -8.826   1.594
   91    H    LYS  13           H        LYS  13  -8.380  -3.119  -2.268
   92    HA   LYS  13           HA       LYS  13  -7.394  -5.800  -1.880
   93   1HB   LYS  13          1HB       LYS  13  -9.347  -4.850  -3.376
   94   2HB   LYS  13          2HB       LYS  13  -8.051  -4.633  -4.578
   95   1HG   LYS  13          1HG       LYS  13  -7.491  -7.157  -3.703
   96   2HG   LYS  13          2HG       LYS  13  -9.259  -7.135  -3.502
   97   1HD   LYS  13          1HD       LYS  13  -9.056  -5.971  -5.951
   98   2HD   LYS  13          2HD       LYS  13  -7.615  -7.015  -5.990
   99   1HE   LYS  13          1HE       LYS  13 -10.055  -8.299  -4.898
  100   2HE   LYS  13          2HE       LYS  13 -10.159  -7.845  -6.613
  101   1HZ   LYS  13          1HZ       LYS  13  -7.716  -8.963  -6.328
  102   2HZ   LYS  13          2HZ       LYS  13  -8.688  -9.916  -5.397
  103   3HZ   LYS  13          3HZ       LYS  13  -9.048  -9.676  -6.988
  104    H    LEU  14           H        LEU  14  -6.171  -2.829  -3.374
  105    HA   LEU  14           HA       LEU  14  -4.027  -4.087  -4.817
  106   1HB   LEU  14          1HB       LEU  14  -4.913  -1.334  -4.117
  107   2HB   LEU  14          2HB       LEU  14  -3.173  -1.537  -4.434
  108    HG   LEU  14           HG       LEU  14  -5.124  -1.208  -6.375
  109   1HD1  LEU  14          1HD1      LEU  14  -2.988  -2.726  -7.517
  110   2HD1  LEU  14          2HD1      LEU  14  -3.176  -0.956  -7.479
  111   3HD1  LEU  14          3HD1      LEU  14  -2.306  -1.788  -6.167
  112   1HD2  LEU  14          1HD2      LEU  14  -4.309  -4.059  -6.761
  113   2HD2  LEU  14          2HD2      LEU  14  -5.599  -3.752  -5.574
  114   3HD2  LEU  14          3HD2      LEU  14  -5.797  -3.221  -7.261
  115    H    LEU  15           H        LEU  15  -4.367  -2.594  -1.580
  116    HA   LEU  15           HA       LEU  15  -1.594  -2.766  -0.902
  117   1HB   LEU  15          1HB       LEU  15  -4.073  -1.920   0.302
  118   2HB   LEU  15          2HB       LEU  15  -3.195  -2.965   1.444
  119    HG   LEU  15           HG       LEU  15  -1.104  -1.553   0.773
  120   1HD1  LEU  15          1HD1      LEU  15  -1.486   0.602  -0.138
  121   2HD1  LEU  15          2HD1      LEU  15  -2.498  -0.472  -1.132
  122   3HD1  LEU  15          3HD1      LEU  15  -3.240   0.510   0.154
  123   1HD2  LEU  15          1HD2      LEU  15  -2.831   0.306   2.236
  124   2HD2  LEU  15          2HD2      LEU  15  -3.023  -1.368   2.809
  125   3HD2  LEU  15          3HD2      LEU  15  -1.414  -0.608   2.804
  126    H    LYS  16           H        LYS  16  -3.959  -5.160  -1.404
  127    HA   LYS  16           HA       LYS  16  -3.183  -7.032   0.631
  128   1HB   LYS  16          1HB       LYS  16  -5.226  -6.839  -1.188
  129   2HB   LYS  16          2HB       LYS  16  -4.208  -8.092  -1.937
  130   1HG   LYS  16          1HG       LYS  16  -4.183  -8.818   0.738
  131   2HG   LYS  16          2HG       LYS  16  -5.840  -8.205   0.520
  132   1HD   LYS  16          1HD       LYS  16  -6.429  -9.939  -0.832
  133   2HD   LYS  16          2HD       LYS  16  -4.873  -9.914  -1.696
  134   1HE   LYS  16          1HE       LYS  16  -4.034 -11.567  -0.409
  135   2HE   LYS  16          2HE       LYS  16  -4.550 -10.755   1.085
  136   1HZ   LYS  16          1HZ       LYS  16  -5.989 -12.387   1.226
  137   2HZ   LYS  16          2HZ       LYS  16  -6.836 -11.658   0.012
  138   3HZ   LYS  16          3HZ       LYS  16  -5.778 -12.875  -0.335
  139    H    LYS  17           H        LYS  17  -1.172  -5.669  -1.410
  140    HA   LYS  17           HA       LYS  17   0.632  -7.926  -1.456
  141   1HB   LYS  17          1HB       LYS  17  -0.076  -8.759  -3.440
  142   2HB   LYS  17          2HB       LYS  17  -1.007  -7.292  -3.829
  143   1HG   LYS  17          1HG       LYS  17   2.026  -7.538  -4.027
  144   2HG   LYS  17          2HG       LYS  17   0.902  -7.660  -5.402
  145   1HD   LYS  17          1HD       LYS  17   0.179  -5.301  -3.999
  146   2HD   LYS  17          2HD       LYS  17   1.955  -5.286  -4.109
  147   1HE   LYS  17          1HE       LYS  17   1.080  -6.189  -6.626
  148   2HE   LYS  17          2HE       LYS  17  -0.039  -4.875  -6.202
  149   1HZ   LYS  17          1HZ       LYS  17   1.917  -3.527  -5.722
  150   2HZ   LYS  17          2HZ       LYS  17   2.890  -4.735  -6.282
  151   3HZ   LYS  17          3HZ       LYS  17   1.830  -3.991  -7.303
  152    H    TRP  18           H        TRP  18  -0.268  -4.606  -2.040
  153    HA   TRP  18           HA       TRP  18   2.503  -3.831  -2.676
  154   1HB   TRP  18          1HB       TRP  18   0.059  -2.882  -3.454
  155   2HB   TRP  18          2HB       TRP  18   0.454  -1.769  -2.138
  156    HD1  TRP  18           HD       TRP  18   0.791  -2.058  -5.705
  157    HE1  TRP  18           1HE      TRP  18   2.611  -0.558  -6.666
  158    HE3  TRP  18           3HE      TRP  18   3.267  -0.921  -1.373
  159    HZ2  TRP  18           2HZ      TRP  18   4.872   0.957  -5.682
  160    HZ3  TRP  18           3HZ      TRP  18   5.247   0.551  -1.425
  161    HH2  TRP  18           HH       TRP  18   6.061   1.496  -3.565
  162    H    LYS  19           H        LYS  19   0.023  -3.376  -0.115
  163    HA   LYS  19           HA       LYS  19   1.238  -1.645   1.601
  164   1HB   LYS  19          1HB       LYS  19  -0.925  -3.035   1.868
  165   2HB   LYS  19          2HB       LYS  19   0.119  -4.272   2.608
  166   1HG   LYS  19          1HG       LYS  19   0.653  -1.569   3.637
  167   2HG   LYS  19          2HG       LYS  19  -1.021  -2.100   3.931
  168   1HD   LYS  19          1HD       LYS  19   0.965  -4.219   4.424
  169   2HD   LYS  19          2HD       LYS  19   1.191  -2.795   5.467
  170   1HE   LYS  19          1HE       LYS  19  -1.558  -3.123   5.484
  171   2HE   LYS  19          2HE       LYS  19  -0.974  -4.800   5.445
  172   1HZ   LYS  19          1HZ       LYS  19   0.476  -3.190   7.256
  173   2HZ   LYS  19          2HZ       LYS  19  -1.133  -3.215   7.616
  174   3HZ   LYS  19          3HZ       LYS  19  -0.292  -4.629   7.505
  175    H    MET  20           H        MET  20   1.917  -5.189   1.472
  176    HA   MET  20           HA       MET  20   3.747  -5.575   3.393
  177   1HB   MET  20          1HB       MET  20   5.086  -6.896   1.559
  178   2HB   MET  20          2HB       MET  20   3.424  -7.390   1.961
  179   1HG   MET  20          1HG       MET  20   2.873  -7.105  -0.189
  180   2HG   MET  20          2HG       MET  20   3.153  -5.368   0.022
  181   1HE   MET  20          1HE       MET  20   5.527  -4.511  -2.443
  182   2HE   MET  20          2HE       MET  20   3.961  -5.216  -2.911
  183   3HE   MET  20          3HE       MET  20   4.085  -4.222  -1.439
  184    H    ARG  21           H        ARG  21   4.385  -3.788   0.352
  185    HA   ARG  21           HA       ARG  21   7.092  -3.113   1.317
  186   1HB   ARG  21          1HB       ARG  21   5.600  -2.963  -1.287
  187   2HB   ARG  21          2HB       ARG  21   6.960  -1.846  -1.017
  188   1HG   ARG  21          1HG       ARG  21   8.382  -3.823  -0.388
  189   2HG   ARG  21          2HG       ARG  21   7.028  -4.888  -0.836
  190   1HD   ARG  21          1HD       ARG  21   7.191  -3.279  -3.050
  191   2HD   ARG  21          2HD       ARG  21   8.897  -3.352  -2.558
  192    HE   ARG  21           HE       ARG  21   7.743  -5.974  -2.514
  193   1HH1  ARG  21          2HH2      ARG  21   8.861  -3.432  -4.701
  194   2HH1  ARG  21          1HH2      ARG  21   9.277  -4.536  -5.992
  195   1HH2  ARG  21          2HH1      ARG  21   8.292  -7.433  -4.220
  196   2HH2  ARG  21          1HH1      ARG  21   8.953  -6.817  -5.718
  197    H    ARG  22           H        ARG  22   4.023  -1.519   0.322
  198    HA   ARG  22           HA       ARG  22   4.901   1.129   0.919
  199   1HB   ARG  22          1HB       ARG  22   2.958   0.555  -0.528
  200   2HB   ARG  22          2HB       ARG  22   2.085  -0.027   0.910
  201   1HG   ARG  22          1HG       ARG  22   3.082   2.543   1.582
  202   2HG   ARG  22          2HG       ARG  22   2.404   2.690  -0.057
  203   1HD   ARG  22          1HD       ARG  22   0.689   3.100   1.692
  204   2HD   ARG  22          2HD       ARG  22   0.298   1.680   0.698
  205    HE   ARG  22           HE       ARG  22   1.624   0.532   2.758
  206   1HH1  ARG  22          2HH2      ARG  22  -0.938   2.966   2.642
  207   2HH1  ARG  22          1HH2      ARG  22  -1.642   2.495   4.172
  208   1HH2  ARG  22          2HH1      ARG  22   0.693  -0.090   4.779
  209   2HH2  ARG  22          1HH1      ARG  22  -0.712   0.753   5.391
  210    H    ASN  23           H        ASN  23   5.195  -1.167   3.006
  211    HA   ASN  23           HA       ASN  23   4.412   0.534   5.283
  212   1HB   ASN  23          1HB       ASN  23   2.828  -1.639   4.484
  213   2HB   ASN  23          2HB       ASN  23   3.809  -2.267   5.825
  214   1HD2  ASN  23          1HD2      ASN  23   2.135  -2.370   7.342
  215   2HD2  ASN  23          2HD2      ASN  23   1.360  -0.942   7.994
  216    H    GLN  24           H        GLN  24   6.838  -0.682   3.717
  217    HA   GLN  24           HA       GLN  24   8.475  -1.043   6.070
  218   1HB   GLN  24          1HB       GLN  24   7.742  -3.423   4.340
  219   2HB   GLN  24          2HB       GLN  24   9.245  -3.368   5.292
  220   1HG   GLN  24          1HG       GLN  24   7.583  -2.628   7.236
  221   2HG   GLN  24          2HG       GLN  24   6.387  -3.467   6.224
  222   1HE2  GLN  24          1HE2      GLN  24   6.016  -5.415   7.144
  223   2HE2  GLN  24          2HE2      GLN  24   7.256  -6.543   7.649
  224    H    PHE  25           H        PHE  25   9.370  -2.889   3.273
  225    HA   PHE  25           HA       PHE  25  11.738  -1.728   2.700
  226   1HB   PHE  25          1HB       PHE  25  11.072  -3.607   1.438
  227   2HB   PHE  25          2HB       PHE  25   9.604  -2.804   0.852
  228    HD1  PHE  25           1HD      PHE  25  10.144  -0.501  -0.478
  229    HD2  PHE  25           2HD      PHE  25  12.789  -3.863  -0.083
  230    HE1  PHE  25           1HE      PHE  25  11.346   0.204  -2.530
  231    HE2  PHE  25           2HE      PHE  25  13.991  -3.158  -2.135
  232    HZ   PHE  25           HZ       PHE  25  13.270  -1.125  -3.358
  233    H    TRP  26           H        TRP  26   8.551  -0.518   1.559
  234    HA   TRP  26           HA       TRP  26   9.280   1.520  -0.115
  235   1HB   TRP  26          1HB       TRP  26   7.219   2.470   0.331
  236   2HB   TRP  26          2HB       TRP  26   6.976   0.794   0.841
  237    HD1  TRP  26           HD       TRP  26   6.232   0.380   3.248
  238    HE1  TRP  26           1HE      TRP  26   5.748   1.817   5.295
  239    HE3  TRP  26           3HE      TRP  26   8.115   4.833   1.570
  240    HZ2  TRP  26           2HZ      TRP  26   6.127   4.567   6.114
  241    HZ3  TRP  26           3HZ      TRP  26   8.036   6.836   3.009
  242    HH2  TRP  26           HH       TRP  26   7.048   6.720   5.278
  243    H    VAL  27           H        VAL  27   9.406   1.551   3.468
  244    HA   VAL  27           HA       VAL  27  10.000   4.164   4.018
  245    HB   VAL  27           HB       VAL  27  11.235   3.362   5.935
  246   1HG1  VAL  27          1HG1      VAL  27   9.626   1.025   6.043
  247   2HG1  VAL  27          2HG1      VAL  27   9.236   2.638   6.688
  248   3HG1  VAL  27          3HG1      VAL  27   8.735   2.193   5.039
  249   1HG2  VAL  27          1HG2      VAL  27  12.843   1.869   5.083
  250   2HG2  VAL  27          2HG2      VAL  27  11.721   0.787   5.944
  251   3HG2  VAL  27          3HG2      VAL  27  11.632   0.935   4.173
  252    H    LYS  28           H        LYS  28  12.283   1.686   2.762
  253    HA   LYS  28           HA       LYS  28  14.574   3.362   2.751
  254   1HB   LYS  28          1HB       LYS  28  13.753   0.899   1.187
  255   2HB   LYS  28          2HB       LYS  28  15.327   1.693   0.942
  256   1HG   LYS  28          1HG       LYS  28  15.824   1.450   3.357
  257   2HG   LYS  28          2HG       LYS  28  14.252   0.649   3.598
  258   1HD   LYS  28          1HD       LYS  28  15.615  -1.210   3.325
  259   2HD   LYS  28          2HD       LYS  28  15.145  -0.920   1.633
  260   1HE   LYS  28          1HE       LYS  28  17.429   0.726   2.338
  261   2HE   LYS  28          2HE       LYS  28  17.766  -0.979   2.710
  262   1HZ   LYS  28          1HZ       LYS  28  16.978   0.178   0.140
  263   2HZ   LYS  28          2HZ       LYS  28  18.365  -0.633   0.511
  264   3HZ   LYS  28          3HZ       LYS  28  16.931  -1.444   0.436
  265    H    VAL  29           H        VAL  29  11.897   2.904   0.456
  266    HA   VAL  29           HA       VAL  29  12.946   4.090  -1.830
  267    HB   VAL  29           HB       VAL  29  10.151   4.332  -0.649
  268   1HG1  VAL  29          1HG1      VAL  29   9.759   5.724  -2.383
  269   2HG1  VAL  29          2HG1      VAL  29  11.397   5.467  -3.030
  270   3HG1  VAL  29          3HG1      VAL  29  10.082   4.350  -3.467
  271   1HG2  VAL  29          1HG2      VAL  29  11.122   2.009  -1.061
  272   2HG2  VAL  29          2HG2      VAL  29   9.638   2.385  -1.969
  273   3HG2  VAL  29          3HG2      VAL  29  11.219   2.445  -2.784
  274    H    GLN  30           H        GLN  30  12.526   5.478   1.277
  275    HA   GLN  30           HA       GLN  30  12.541   8.226   0.141
  276   1HB   GLN  30          1HB       GLN  30  11.557   8.949   2.107
  277   2HB   GLN  30          2HB       GLN  30  10.893   7.300   2.010
  278   1HG   GLN  30          1HG       GLN  30  11.738   7.055   4.103
  279   2HG   GLN  30          2HG       GLN  30  13.299   6.863   3.276
  280   1HE2  GLN  30          1HE2      GLN  30  11.405   8.798   5.428
  281   2HE2  GLN  30          2HE2      GLN  30  12.554  10.100   5.649
  282    H    ARG  31           H        ARG  31  14.431   5.800   1.797
  283    HA   ARG  31           HA       ARG  31  16.292   6.850   3.319
  284   1HB   ARG  31          1HB       ARG  31  16.391   4.641   2.027
  285   2HB   ARG  31          2HB       ARG  31  17.195   5.555   0.728
  286   1HG   ARG  31          1HG       ARG  31  19.139   5.268   1.838
  287   2HG   ARG  31          2HG       ARG  31  18.498   6.338   3.107
  288   1HD   ARG  31          1HD       ARG  31  17.308   4.224   4.016
  289   2HD   ARG  31          2HD       ARG  31  18.409   3.311   2.961
  290    HE   ARG  31           HE       ARG  31  19.907   5.175   4.525
  291   1HH1  ARG  31          2HH2      ARG  31  18.066   2.166   4.779
  292   2HH1  ARG  31          1HH2      ARG  31  18.976   1.566   6.147
  293   1HH2  ARG  31          2HH1      ARG  31  21.108   4.381   6.332
  294   2HH2  ARG  31          1HH1      ARG  31  20.711   2.828   7.032
  295    H    GLY  32           H        GLY  32  16.529   7.373  -0.252
  296   1HA   GLY  32          1HA       GLY  32  16.964   9.468  -1.268
  297   2HA   GLY  32          2HA       GLY  32  17.530  10.103   0.294
  Start of MODEL    5
    1    HA   PRO   1           HA       PRO   1 -19.123   1.212   1.888
    2   1HB   PRO   1          1HB       PRO   1 -20.784   2.748   3.406
    3   2HB   PRO   1          2HB       PRO   1 -21.368   1.281   2.556
    4   1HG   PRO   1          1HG       PRO   1 -20.471   1.496   5.444
    5   2HG   PRO   1          2HG       PRO   1 -22.008   0.805   4.830
    6   1HD   PRO   1          1HD       PRO   1 -19.861  -0.778   5.390
    7   2HD   PRO   1          2HD       PRO   1 -20.877  -1.102   3.952
    8    HA   PRO   2           HA       PRO   2 -15.769   3.017   4.422
    9   1HB   PRO   2          1HB       PRO   2 -14.149   3.673   2.331
   10   2HB   PRO   2          2HB       PRO   2 -14.307   1.983   2.912
   11   1HG   PRO   2          1HG       PRO   2 -15.802   3.285   0.618
   12   2HG   PRO   2          2HG       PRO   2 -14.880   1.747   0.582
   13   1HD   PRO   2          1HD       PRO   2 -17.579   1.778   0.964
   14   2HD   PRO   2          2HD       PRO   2 -16.546   0.642   1.883
   15    H    LEU   3           H        LEU   3 -18.281   4.121   2.607
   16    HA   LEU   3           HA       LEU   3 -19.239   6.224   2.578
   17   1HB   LEU   3          1HB       LEU   3 -17.136   6.554   4.430
   18   2HB   LEU   3          2HB       LEU   3 -16.957   7.885   3.262
   19    HG   LEU   3           HG       LEU   3 -18.467   8.668   4.962
   20   1HD1  LEU   3          1HD1      LEU   3 -20.731   8.089   3.325
   21   2HD1  LEU   3          2HD1      LEU   3 -19.722   9.555   3.314
   22   3HD1  LEU   3          3HD1      LEU   3 -19.321   8.191   2.243
   23   1HD2  LEU   3          1HD2      LEU   3 -18.973   6.177   5.631
   24   2HD2  LEU   3          2HD2      LEU   3 -20.223   7.418   5.891
   25   3HD2  LEU   3          3HD2      LEU   3 -20.325   6.332   4.484
   26    H    SER   4           H        SER   4 -16.845   4.945   0.769
   27    HA   SER   4           HA       SER   4 -17.122   7.078  -1.261
   28   1HB   SER   4          1HB       SER   4 -14.435   5.808  -0.660
   29   2HB   SER   4          2HB       SER   4 -14.788   7.225  -1.678
   30    HG   SER   4           HG       SER   4 -15.075   7.014   1.139
   31    H    GLN   5           H        GLN   5 -14.979   5.612  -2.823
   32    HA   GLN   5           HA       GLN   5 -15.521   2.923  -3.222
   33   1HB   GLN   5          1HB       GLN   5 -17.788   4.529  -3.926
   34   2HB   GLN   5          2HB       GLN   5 -17.083   3.877  -5.424
   35   1HG   GLN   5          1HG       GLN   5 -17.172   1.614  -4.549
   36   2HG   GLN   5          2HG       GLN   5 -17.680   2.205  -2.953
   37   1HE2  GLN   5          1HE2      GLN   5 -19.571   0.831  -3.109
   38   2HE2  GLN   5          2HE2      GLN   5 -20.940   1.322  -4.083
   39    H    GLU   6           H        GLU   6 -15.228   6.068  -4.926
   40    HA   GLU   6           HA       GLU   6 -14.108   5.517  -7.292
   41   1HB   GLU   6          1HB       GLU   6 -13.746   7.586  -5.279
   42   2HB   GLU   6          2HB       GLU   6 -12.242   7.314  -6.190
   43   1HG   GLU   6          1HG       GLU   6 -14.984   7.746  -7.443
   44   2HG   GLU   6          2HG       GLU   6 -13.743   9.005  -7.265
   45    H    THR   7           H        THR   7 -11.815   5.921  -4.546
   46    HA   THR   7           HA       THR   7  -9.953   4.099  -5.889
   47    HB   THR   7           HB       THR   7  -9.239   5.011  -3.197
   48    HG1  THR   7           1HG      THR   7  -9.385   7.144  -3.567
   49   1HG2  THR   7          1HG2      THR   7  -7.686   4.175  -4.969
   50   2HG2  THR   7          2HG2      THR   7  -8.100   5.591  -5.964
   51   3HG2  THR   7          3HG2      THR   7  -7.263   5.810  -4.409
   52    H    PHE   8           H        PHE   8 -10.290   4.225  -2.374
   53    HA   PHE   8           HA       PHE   8  -9.935   2.092  -1.214
   54   1HB   PHE   8          1HB       PHE   8 -12.920   2.306  -1.526
   55   2HB   PHE   8          2HB       PHE   8 -11.965   1.959  -0.075
   56    HD1  PHE   8           1HD      PHE   8 -11.967   4.742  -2.610
   57    HD2  PHE   8           2HD      PHE   8 -12.222   3.606   1.525
   58    HE1  PHE   8           1HE      PHE   8 -12.085   7.132  -1.961
   59    HE2  PHE   8           2HE      PHE   8 -12.340   5.996   2.174
   60    HZ   PHE   8           HZ       PHE   8 -12.272   7.760   0.432
   61    H    SER   9           H        SER   9 -12.706   1.755  -3.512
   62    HA   SER   9           HA       SER   9 -13.051  -0.901  -3.658
   63   1HB   SER   9          1HB       SER   9 -14.069   0.873  -5.150
   64   2HB   SER   9          2HB       SER   9 -12.607   0.768  -6.160
   65    HG   SER   9           HG       SER   9 -14.531  -1.232  -5.611
   66    H    ASP  10           H        ASP  10 -10.525   0.726  -5.669
   67    HA   ASP  10           HA       ASP  10  -9.154  -1.887  -5.905
   68   1HB   ASP  10          1HB       ASP  10  -8.112  -1.011  -7.807
   69   2HB   ASP  10          2HB       ASP  10  -9.724  -0.266  -7.866
   70    H    LEU  11           H        LEU  11  -8.925   1.281  -4.400
   71    HA   LEU  11           HA       LEU  11  -6.118   1.251  -3.865
   72   1HB   LEU  11          1HB       LEU  11  -8.069   3.101  -3.640
   73   2HB   LEU  11          2HB       LEU  11  -7.999   2.557  -1.947
   74    HG   LEU  11           HG       LEU  11  -5.466   2.855  -2.084
   75   1HD1  LEU  11          1HD1      LEU  11  -6.089   3.232  -4.816
   76   2HD1  LEU  11          2HD1      LEU  11  -5.626   4.840  -4.208
   77   3HD1  LEU  11          3HD1      LEU  11  -4.507   3.467  -4.034
   78   1HD2  LEU  11          1HD2      LEU  11  -7.118   5.365  -2.586
   79   2HD2  LEU  11          2HD2      LEU  11  -7.076   4.493  -1.035
   80   3HD2  LEU  11          3HD2      LEU  11  -5.595   5.246  -1.674
   81    H    TRP  12           H        TRP  12  -8.847   0.748  -1.549
   82    HA   TRP  12           HA       TRP  12  -7.349  -0.288   0.545
   83   1HB   TRP  12          1HB       TRP  12  -9.380  -0.409   1.443
   84   2HB   TRP  12          2HB       TRP  12 -10.060   0.015  -0.134
   85    HD1  TRP  12           HD       TRP  12 -11.819  -1.584  -0.932
   86    HE1  TRP  12           1HE      TRP  12 -12.426  -4.036  -0.608
   87    HE3  TRP  12           3HE      TRP  12  -7.930  -2.985   2.087
   88    HZ2  TRP  12           2HZ      TRP  12 -11.361  -6.335   0.791
   89    HZ3  TRP  12           3HZ      TRP  12  -7.761  -5.310   2.894
   90    HH2  TRP  12           HH       TRP  12  -9.463  -6.994   2.257
   91    H    LYS  13           H        LYS  13  -8.569  -1.929  -2.378
   92    HA   LYS  13           HA       LYS  13  -7.792  -4.564  -1.487
   93   1HB   LYS  13          1HB       LYS  13  -9.006  -3.296  -3.851
   94   2HB   LYS  13          2HB       LYS  13  -7.926  -4.653  -4.251
   95   1HG   LYS  13          1HG       LYS  13  -9.176  -6.188  -2.969
   96   2HG   LYS  13          2HG       LYS  13  -9.960  -4.901  -2.021
   97   1HD   LYS  13          1HD       LYS  13 -11.394  -4.298  -3.800
   98   2HD   LYS  13          2HD       LYS  13 -10.376  -5.108  -5.015
   99   1HE   LYS  13          1HE       LYS  13 -10.964  -7.216  -3.394
  100   2HE   LYS  13          2HE       LYS  13 -12.434  -6.239  -3.182
  101   1HZ   LYS  13          1HZ       LYS  13 -12.730  -7.677  -4.997
  102   2HZ   LYS  13          2HZ       LYS  13 -12.567  -6.155  -5.610
  103   3HZ   LYS  13          3HZ       LYS  13 -11.313  -7.222  -5.707
  104    H    LEU  14           H        LEU  14  -6.254  -1.889  -3.220
  105    HA   LEU  14           HA       LEU  14  -4.075  -3.364  -4.318
  106   1HB   LEU  14          1HB       LEU  14  -4.906  -0.581  -3.994
  107   2HB   LEU  14          2HB       LEU  14  -3.151  -0.778  -3.774
  108    HG   LEU  14           HG       LEU  14  -4.120  -0.432  -6.198
  109   1HD1  LEU  14          1HD1      LEU  14  -2.196  -2.705  -5.542
  110   2HD1  LEU  14          2HD1      LEU  14  -2.308  -1.850  -7.099
  111   3HD1  LEU  14          3HD1      LEU  14  -1.765  -0.981  -5.643
  112   1HD2  LEU  14          1HD2      LEU  14  -4.231  -3.239  -6.723
  113   2HD2  LEU  14          2HD2      LEU  14  -5.350  -2.909  -5.379
  114   3HD2  LEU  14          3HD2      LEU  14  -5.528  -2.036  -6.920
  115    H    LEU  15           H        LEU  15  -4.510  -1.582  -1.228
  116    HA   LEU  15           HA       LEU  15  -1.868  -1.984  -0.268
  117   1HB   LEU  15          1HB       LEU  15  -4.530  -1.242   0.873
  118   2HB   LEU  15          2HB       LEU  15  -3.284  -1.807   2.012
  119    HG   LEU  15           HG       LEU  15  -2.775   0.343  -0.081
  120   1HD1  LEU  15          1HD1      LEU  15  -4.476   1.233   1.374
  121   2HD1  LEU  15          2HD1      LEU  15  -3.683   0.555   2.816
  122   3HD1  LEU  15          3HD1      LEU  15  -2.922   1.900   1.933
  123   1HD2  LEU  15          1HD2      LEU  15  -0.819   0.817   1.320
  124   2HD2  LEU  15          2HD2      LEU  15  -1.325  -0.426   2.488
  125   3HD2  LEU  15          3HD2      LEU  15  -0.816  -0.899   0.850
  126    H    LYS  16           H        LYS  16  -4.446  -4.185  -0.801
  127    HA   LYS  16           HA       LYS  16  -3.859  -6.023   1.342
  128   1HB   LYS  16          1HB       LYS  16  -5.946  -5.704  -0.340
  129   2HB   LYS  16          2HB       LYS  16  -5.071  -6.988  -1.209
  130   1HG   LYS  16          1HG       LYS  16  -6.606  -8.048   0.341
  131   2HG   LYS  16          2HG       LYS  16  -4.955  -8.270   0.968
  132   1HD   LYS  16          1HD       LYS  16  -5.774  -5.809   2.036
  133   2HD   LYS  16          2HD       LYS  16  -7.220  -6.840   2.152
  134   1HE   LYS  16          1HE       LYS  16  -4.434  -7.608   3.115
  135   2HE   LYS  16          2HE       LYS  16  -5.752  -7.030   4.158
  136   1HZ   LYS  16          1HZ       LYS  16  -6.967  -8.922   3.737
  137   2HZ   LYS  16          2HZ       LYS  16  -6.069  -9.360   2.425
  138   3HZ   LYS  16          3HZ       LYS  16  -5.432  -9.489   3.941
  139    H    LYS  17           H        LYS  17  -1.753  -4.981  -0.782
  140    HA   LYS  17           HA       LYS  17  -0.214  -7.429  -0.764
  141   1HB   LYS  17          1HB       LYS  17  -1.078  -8.243  -2.698
  142   2HB   LYS  17          2HB       LYS  17  -1.796  -6.678  -3.151
  143   1HG   LYS  17          1HG       LYS  17   1.172  -7.349  -3.337
  144   2HG   LYS  17          2HG       LYS  17   0.035  -7.389  -4.706
  145   1HD   LYS  17          1HD       LYS  17  -0.357  -4.885  -3.427
  146   2HD   LYS  17          2HD       LYS  17   1.405  -5.115  -3.535
  147   1HE   LYS  17          1HE       LYS  17   1.186  -5.635  -5.944
  148   2HE   LYS  17          2HE       LYS  17  -0.572  -5.401  -5.835
  149   1HZ   LYS  17          1HZ       LYS  17  -0.163  -3.140  -5.188
  150   2HZ   LYS  17          2HZ       LYS  17   1.468  -3.360  -5.301
  151   3HZ   LYS  17          3HZ       LYS  17   0.527  -3.458  -6.652
  152    H    TRP  18           H        TRP  18  -0.745  -4.052  -1.458
  153    HA   TRP  18           HA       TRP  18   2.076  -3.614  -2.176
  154   1HB   TRP  18          1HB       TRP  18  -0.253  -2.419  -2.939
  155   2HB   TRP  18          2HB       TRP  18   0.270  -1.328  -1.649
  156    HD1  TRP  18           HD       TRP  18   0.540  -1.729  -5.215
  157    HE1  TRP  18           1HE      TRP  18   2.491  -0.439  -6.222
  158    HE3  TRP  18           3HE      TRP  18   3.155  -0.744  -0.926
  159    HZ2  TRP  18           2HZ      TRP  18   4.900   0.866  -5.289
  160    HZ3  TRP  18           3HZ      TRP  18   5.270   0.523  -1.026
  161    HH2  TRP  18           HH       TRP  18   6.154   1.333  -3.193
  162    H    LYS  19           H        LYS  19  -0.263  -2.802   0.428
  163    HA   LYS  19           HA       LYS  19   1.187  -1.176   2.061
  164   1HB   LYS  19          1HB       LYS  19  -1.111  -2.318   2.420
  165   2HB   LYS  19          2HB       LYS  19  -0.184  -3.630   3.186
  166   1HG   LYS  19          1HG       LYS  19   0.584  -2.248   4.922
  167   2HG   LYS  19          2HG       LYS  19   0.303  -0.757   3.992
  168   1HD   LYS  19          1HD       LYS  19  -1.419  -0.940   5.705
  169   2HD   LYS  19          2HD       LYS  19  -2.169  -1.220   4.115
  170   1HE   LYS  19          1HE       LYS  19  -1.419  -3.761   4.763
  171   2HE   LYS  19          2HE       LYS  19  -1.733  -3.099   6.382
  172   1HZ   LYS  19          1HZ       LYS  19  -3.791  -2.260   4.814
  173   2HZ   LYS  19          2HZ       LYS  19  -3.556  -3.835   4.384
  174   3HZ   LYS  19          3HZ       LYS  19  -3.835  -3.443   5.962
  175    H    MET  20           H        MET  20   1.452  -4.778   2.039
  176    HA   MET  20           HA       MET  20   3.284  -5.313   3.920
  177   1HB   MET  20          1HB       MET  20   4.410  -6.834   2.101
  178   2HB   MET  20          2HB       MET  20   2.712  -7.119   2.554
  179   1HG   MET  20          1HG       MET  20   2.149  -6.838   0.407
  180   2HG   MET  20          2HG       MET  20   2.626  -5.139   0.558
  181   1HE   MET  20          1HE       MET  20   3.364  -5.173  -2.396
  182   2HE   MET  20          2HE       MET  20   3.641  -4.151  -0.966
  183   3HE   MET  20          3HE       MET  20   5.012  -4.632  -1.994
  184    H    ARG  21           H        ARG  21   4.030  -3.696   0.809
  185    HA   ARG  21           HA       ARG  21   6.823  -3.308   1.680
  186   1HB   ARG  21          1HB       ARG  21   5.281  -3.073  -0.887
  187   2HB   ARG  21          2HB       ARG  21   6.758  -2.098  -0.690
  188   1HG   ARG  21          1HG       ARG  21   7.984  -4.194  -0.034
  189   2HG   ARG  21          2HG       ARG  21   6.513  -5.123  -0.411
  190   1HD   ARG  21          1HD       ARG  21   6.835  -3.540  -2.666
  191   2HD   ARG  21          2HD       ARG  21   8.511  -3.928  -2.221
  192    HE   ARG  21           HE       ARG  21   6.698  -6.221  -2.218
  193   1HH1  ARG  21          2HH2      ARG  21   8.905  -4.189  -4.089
  194   2HH1  ARG  21          1HH2      ARG  21   9.239  -5.419  -5.287
  195   1HH2  ARG  21          2HH1      ARG  21   7.140  -7.845  -3.801
  196   2HH2  ARG  21          1HH1      ARG  21   8.233  -7.503  -5.123
  197    H    ARG  22           H        ARG  22   3.922  -1.408   0.724
  198    HA   ARG  22           HA       ARG  22   5.118   1.139   1.221
  199   1HB   ARG  22          1HB       ARG  22   3.132   0.859  -0.188
  200   2HB   ARG  22          2HB       ARG  22   2.207   0.251   1.206
  201   1HG   ARG  22          1HG       ARG  22   1.996   2.782   0.549
  202   2HG   ARG  22          2HG       ARG  22   2.178   2.350   2.266
  203   1HD   ARG  22          1HD       ARG  22   3.684   4.234   1.453
  204   2HD   ARG  22          2HD       ARG  22   4.518   2.877   2.241
  205    HE   ARG  22           HE       ARG  22   5.627   2.471   0.265
  206   1HH1  ARG  22          2HH2      ARG  22   2.678   4.311  -0.379
  207   2HH1  ARG  22          1HH2      ARG  22   3.012   4.512  -2.084
  208   1HH2  ARG  22          2HH1      ARG  22   6.069   2.737  -1.988
  209   2HH2  ARG  22          1HH1      ARG  22   4.945   3.615  -3.001
  210    H    ASN  23           H        ASN  23   5.247  -1.081   3.367
  211    HA   ASN  23           HA       ASN  23   4.668   0.743   5.605
  212   1HB   ASN  23          1HB       ASN  23   2.862  -1.285   4.899
  213   2HB   ASN  23          2HB       ASN  23   3.802  -1.966   6.245
  214   1HD2  ASN  23          1HD2      ASN  23   3.238  -1.411   8.284
  215   2HD2  ASN  23          2HD2      ASN  23   2.202  -0.066   8.711
  216    H    GLN  24           H        GLN  24   6.928  -0.755   4.033
  217    HA   GLN  24           HA       GLN  24   8.583  -1.190   6.354
  218   1HB   GLN  24          1HB       GLN  24   7.517  -3.555   4.792
  219   2HB   GLN  24          2HB       GLN  24   9.077  -3.626   5.646
  220   1HG   GLN  24          1HG       GLN  24   7.598  -2.587   7.628
  221   2HG   GLN  24          2HG       GLN  24   6.294  -3.412   6.745
  222   1HE2  GLN  24          1HE2      GLN  24   6.643  -5.750   6.215
  223   2HE2  GLN  24          2HE2      GLN  24   7.527  -6.731   7.365
  224    H    PHE  25           H        PHE  25   9.176  -3.255   3.626
  225    HA   PHE  25           HA       PHE  25  11.639  -2.402   2.931
  226   1HB   PHE  25          1HB       PHE  25  10.721  -4.237   1.769
  227   2HB   PHE  25          2HB       PHE  25   9.332  -3.297   1.199
  228    HD1  PHE  25           1HD      PHE  25  10.073  -1.124  -0.247
  229    HD2  PHE  25           2HD      PHE  25  12.341  -4.744   0.205
  230    HE1  PHE  25           1HE      PHE  25  11.268  -0.640  -2.366
  231    HE2  PHE  25           2HE      PHE  25  13.536  -4.260  -1.914
  232    HZ   PHE  25           HZ       PHE  25  13.000  -2.208  -3.199
  233    H    TRP  26           H        TRP  26   8.577  -0.873   1.827
  234    HA   TRP  26           HA       TRP  26   9.496   1.000   0.051
  235   1HB   TRP  26          1HB       TRP  26   7.563   2.191   0.490
  236   2HB   TRP  26          2HB       TRP  26   7.145   0.573   1.069
  237    HD1  TRP  26           HD       TRP  26   6.410   0.334   3.504
  238    HE1  TRP  26           1HE      TRP  26   6.126   1.893   5.497
  239    HE3  TRP  26           3HE      TRP  26   8.733   4.487   1.618
  240    HZ2  TRP  26           2HZ      TRP  26   6.819   4.615   6.199
  241    HZ3  TRP  26           3HZ      TRP  26   8.901   6.540   2.976
  242    HH2  TRP  26           HH       TRP  26   7.951   6.621   5.262
  243    H    VAL  27           H        VAL  27   9.678   1.168   3.630
  244    HA   VAL  27           HA       VAL  27  10.572   3.711   4.066
  245    HB   VAL  27           HB       VAL  27  11.747   2.851   5.995
  246   1HG1  VAL  27          1HG1      VAL  27   9.119   1.940   5.186
  247   2HG1  VAL  27          2HG1      VAL  27   9.895   0.704   6.205
  248   3HG1  VAL  27          3HG1      VAL  27   9.703   2.366   6.813
  249   1HG2  VAL  27          1HG2      VAL  27  11.879   0.354   4.301
  250   2HG2  VAL  27          2HG2      VAL  27  13.171   1.160   5.223
  251   3HG2  VAL  27          3HG2      VAL  27  11.923   0.221   6.076
  252    H    LYS  28           H        LYS  28  12.522   0.959   2.830
  253    HA   LYS  28           HA       LYS  28  14.989   2.379   2.728
  254   1HB   LYS  28          1HB       LYS  28  13.885  -0.052   1.290
  255   2HB   LYS  28          2HB       LYS  28  15.531   0.558   0.996
  256   1HG   LYS  28          1HG       LYS  28  14.536   0.048   3.812
  257   2HG   LYS  28          2HG       LYS  28  15.207  -1.271   2.824
  258   1HD   LYS  28          1HD       LYS  28  17.259  -0.588   3.476
  259   2HD   LYS  28          2HD       LYS  28  17.005   0.871   2.490
  260   1HE   LYS  28          1HE       LYS  28  16.235   2.129   4.333
  261   2HE   LYS  28          2HE       LYS  28  15.897   0.677   5.299
  262   1HZ   LYS  28          1HZ       LYS  28  18.533   1.742   4.579
  263   2HZ   LYS  28          2HZ       LYS  28  17.855   1.690   6.081
  264   3HZ   LYS  28          3HZ       LYS  28  18.294   0.291   5.326
  265    H    VAL  29           H        VAL  29  12.258   2.043   0.462
  266    HA   VAL  29           HA       VAL  29  13.341   2.999  -1.888
  267    HB   VAL  29           HB       VAL  29  10.651   3.647  -0.621
  268   1HG1  VAL  29          1HG1      VAL  29  10.085   3.846  -3.178
  269   2HG1  VAL  29          2HG1      VAL  29  10.843   5.228  -2.349
  270   3HG1  VAL  29          3HG1      VAL  29  11.830   4.146  -3.361
  271   1HG2  VAL  29          1HG2      VAL  29  11.322   1.211  -1.017
  272   2HG2  VAL  29          2HG2      VAL  29   9.844   1.749  -1.852
  273   3HG2  VAL  29          3HG2      VAL  29  11.372   1.601  -2.754
  274    H    GLN  30           H        GLN  30  13.155   4.619   1.147
  275    HA   GLN  30           HA       GLN  30  13.426   7.283  -0.117
  276   1HB   GLN  30          1HB       GLN  30  12.640   8.138   1.846
  277   2HB   GLN  30          2HB       GLN  30  12.012   6.487   2.066
  278   1HG   GLN  30          1HG       GLN  30  14.195   5.908   3.211
  279   2HG   GLN  30          2HG       GLN  30  14.616   7.633   3.147
  280   1HE2  GLN  30          1HE2      GLN  30  14.447   6.296   5.595
  281   2HE2  GLN  30          2HE2      GLN  30  13.055   6.882   6.480
  282    H    ARG  31           H        ARG  31  15.144   4.946   1.984
  283    HA   ARG  31           HA       ARG  31  17.293   5.159   2.906
  284   1HB   ARG  31          1HB       ARG  31  17.574   3.808   0.930
  285   2HB   ARG  31          2HB       ARG  31  17.589   5.246  -0.119
  286   1HG   ARG  31          1HG       ARG  31  19.578   5.608   1.921
  287   2HG   ARG  31          2HG       ARG  31  19.803   3.992   1.210
  288   1HD   ARG  31          1HD       ARG  31  19.910   4.918  -1.025
  289   2HD   ARG  31          2HD       ARG  31  19.453   6.529  -0.432
  290    HE   ARG  31           HE       ARG  31  21.744   5.926   0.982
  291   1HH1  ARG  31          2HH2      ARG  31  20.839   6.033  -2.434
  292   2HH1  ARG  31          1HH2      ARG  31  22.440   6.470  -2.986
  293   1HH2  ARG  31          2HH1      ARG  31  23.860   6.503   0.253
  294   2HH2  ARG  31          1HH1      ARG  31  24.162   6.738  -1.454
  295    H    GLY  32           H        GLY  32  17.108   7.233   3.971
  296   1HA   GLY  32          1HA       GLY  32  19.141   9.034   3.443
  297   2HA   GLY  32          2HA       GLY  32  17.734   9.674   2.565
  Start of MODEL    6
    1    HA   PRO   1           HA       PRO   1 -16.592  12.178   1.426
    2   1HB   PRO   1          1HB       PRO   1 -19.272  12.150   1.916
    3   2HB   PRO   1          2HB       PRO   1 -18.237  13.532   2.401
    4   1HG   PRO   1          1HG       PRO   1 -19.900  13.276  -0.121
    5   2HG   PRO   1          2HG       PRO   1 -19.908  14.631   1.055
    6   1HD   PRO   1          1HD       PRO   1 -18.404  14.729  -1.216
    7   2HD   PRO   1          2HD       PRO   1 -17.757  15.361   0.329
    8    HA   PRO   2           HA       PRO   2 -17.726   9.324  -2.048
    9   1HB   PRO   2          1HB       PRO   2 -15.474   7.793  -1.955
   10   2HB   PRO   2          2HB       PRO   2 -15.491   9.401  -2.749
   11   1HG   PRO   2          1HG       PRO   2 -14.613   8.758   0.080
   12   2HG   PRO   2          2HG       PRO   2 -13.695   9.667  -1.164
   13   1HD   PRO   2          1HD       PRO   2 -15.186  10.951   0.722
   14   2HD   PRO   2          2HD       PRO   2 -15.155  11.542  -0.967
   15    H    LEU   3           H        LEU   3 -17.598   9.374   1.247
   16    HA   LEU   3           HA       LEU   3 -18.002   7.847   2.931
   17   1HB   LEU   3          1HB       LEU   3 -20.045   7.798   0.905
   18   2HB   LEU   3          2HB       LEU   3 -19.876   6.165   1.593
   19    HG   LEU   3           HG       LEU   3 -21.490   7.537   2.890
   20   1HD1  LEU   3          1HD1      LEU   3 -20.308   5.838   4.125
   21   2HD1  LEU   3          2HD1      LEU   3 -18.846   6.847   4.230
   22   3HD1  LEU   3          3HD1      LEU   3 -20.309   7.304   5.135
   23   1HD2  LEU   3          1HD2      LEU   3 -19.066   9.351   3.119
   24   2HD2  LEU   3          2HD2      LEU   3 -20.710   9.764   2.576
   25   3HD2  LEU   3          3HD2      LEU   3 -20.402   9.413   4.293
   26    H    SER   4           H        SER   4 -15.780   7.147   1.100
   27    HA   SER   4           HA       SER   4 -14.305   5.387   0.987
   28   1HB   SER   4          1HB       SER   4 -16.408   3.688   2.373
   29   2HB   SER   4          2HB       SER   4 -14.651   3.410   2.299
   30    HG   SER   4           HG       SER   4 -14.408   5.391   3.458
   31    H    GLN   5           H        GLN   5 -14.051   4.793  -1.083
   32    HA   GLN   5           HA       GLN   5 -15.257   2.564  -2.230
   33   1HB   GLN   5          1HB       GLN   5 -17.017   4.853  -2.226
   34   2HB   GLN   5          2HB       GLN   5 -16.558   4.461  -3.901
   35   1HG   GLN   5          1HG       GLN   5 -17.349   2.224  -3.706
   36   2HG   GLN   5          2HG       GLN   5 -17.435   2.325  -1.934
   37   1HE2  GLN   5          1HE2      GLN   5 -19.593   1.946  -1.574
   38   2HE2  GLN   5          2HE2      GLN   5 -20.882   2.949  -2.206
   39    H    GLU   6           H        GLU   6 -14.469   5.961  -3.174
   40    HA   GLU   6           HA       GLU   6 -13.419   5.682  -5.643
   41   1HB   GLU   6          1HB       GLU   6 -12.976   7.425  -3.384
   42   2HB   GLU   6          2HB       GLU   6 -11.433   7.134  -4.223
   43   1HG   GLU   6          1HG       GLU   6 -13.036   7.487  -6.370
   44   2HG   GLU   6          2HG       GLU   6 -13.918   8.483  -5.193
   45    H    THR   7           H        THR   7 -11.244   5.345  -2.780
   46    HA   THR   7           HA       THR   7  -9.406   3.746  -4.409
   47    HB   THR   7           HB       THR   7  -8.809   3.933  -1.554
   48    HG1  THR   7           1HG      THR   7  -9.359   6.292  -3.035
   49   1HG2  THR   7          1HG2      THR   7  -6.721   4.804  -2.409
   50   2HG2  THR   7          2HG2      THR   7  -7.243   3.500  -3.503
   51   3HG2  THR   7          3HG2      THR   7  -7.468   5.201  -3.976
   52    H    PHE   8           H        PHE   8  -9.923   3.059  -0.993
   53    HA   PHE   8           HA       PHE   8  -9.821   0.721  -0.324
   54   1HB   PHE   8          1HB       PHE   8 -12.751   1.207  -0.835
   55   2HB   PHE   8          2HB       PHE   8 -11.971   0.441   0.559
   56    HD1  PHE   8           1HD      PHE   8 -11.541   3.753  -1.176
   57    HD2  PHE   8           2HD      PHE   8 -12.323   1.658   2.491
   58    HE1  PHE   8           1HE      PHE   8 -11.598   5.911   0.044
   59    HE2  PHE   8           2HE      PHE   8 -12.381   3.816   3.712
   60    HZ   PHE   8           HZ       PHE   8 -12.018   5.942   2.488
   61    H    SER   9           H        SER   9 -12.381   1.066  -2.853
   62    HA   SER   9           HA       SER   9 -12.804  -1.463  -3.634
   63   1HB   SER   9          1HB       SER   9 -13.637   0.631  -4.761
   64   2HB   SER   9          2HB       SER   9 -12.082   0.722  -5.622
   65    HG   SER   9           HG       SER   9 -14.209  -1.022  -5.947
   66    H    ASP  10           H        ASP  10 -10.051   0.430  -5.014
   67    HA   ASP  10           HA       ASP  10  -8.724  -2.161  -5.610
   68   1HB   ASP  10          1HB       ASP  10  -8.886   0.480  -6.909
   69   2HB   ASP  10          2HB       ASP  10  -7.235  -0.171  -6.812
   70    H    LEU  11           H        LEU  11  -8.670   0.612  -3.538
   71    HA   LEU  11           HA       LEU  11  -5.868   0.685  -2.968
   72   1HB   LEU  11          1HB       LEU  11  -7.918   2.314  -2.406
   73   2HB   LEU  11          2HB       LEU  11  -7.896   1.398  -0.881
   74    HG   LEU  11           HG       LEU  11  -5.755   3.154  -2.087
   75   1HD1  LEU  11          1HD1      LEU  11  -7.530   3.160   0.193
   76   2HD1  LEU  11          2HD1      LEU  11  -5.844   3.145   0.763
   77   3HD1  LEU  11          3HD1      LEU  11  -6.398   4.426  -0.342
   78   1HD2  LEU  11          1HD2      LEU  11  -5.375   0.786  -0.216
   79   2HD2  LEU  11          2HD2      LEU  11  -4.549   1.101  -1.760
   80   3HD2  LEU  11          3HD2      LEU  11  -4.202   2.119  -0.341
   81    H    TRP  12           H        TRP  12  -8.493  -0.396  -0.743
   82    HA   TRP  12           HA       TRP  12  -6.870  -1.825   1.004
   83   1HB   TRP  12          1HB       TRP  12  -8.842  -2.150   1.977
   84   2HB   TRP  12          2HB       TRP  12  -9.614  -1.408   0.569
   85    HD1  TRP  12           HD       TRP  12 -11.429  -2.816  -0.437
   86    HE1  TRP  12           1HE      TRP  12 -12.028  -5.286  -0.603
   87    HE3  TRP  12           3HE      TRP  12  -7.369  -4.794   1.971
   88    HZ2  TRP  12           2HZ      TRP  12 -10.891  -7.820   0.208
   89    HZ3  TRP  12           3HZ      TRP  12  -7.162  -7.236   2.255
   90    HH2  TRP  12           HH       TRP  12  -8.910  -8.760   1.382
   91    H    LYS  13           H        LYS  13  -8.294  -2.846  -2.107
   92    HA   LYS  13           HA       LYS  13  -7.514  -5.600  -1.850
   93   1HB   LYS  13          1HB       LYS  13  -9.201  -4.258  -3.476
   94   2HB   LYS  13          2HB       LYS  13  -7.782  -4.349  -4.546
   95   1HG   LYS  13          1HG       LYS  13  -8.320  -6.874  -3.130
   96   2HG   LYS  13          2HG       LYS  13  -9.665  -6.364  -4.178
   97   1HD   LYS  13          1HD       LYS  13  -8.494  -6.838  -6.054
   98   2HD   LYS  13          2HD       LYS  13  -7.065  -5.957  -5.464
   99   1HE   LYS  13          1HE       LYS  13  -6.347  -7.874  -4.162
  100   2HE   LYS  13          2HE       LYS  13  -7.852  -8.744  -4.530
  101   1HZ   LYS  13          1HZ       LYS  13  -5.792  -7.958  -6.467
  102   2HZ   LYS  13          2HZ       LYS  13  -6.078  -9.484  -5.912
  103   3HZ   LYS  13          3HZ       LYS  13  -7.207  -8.718  -6.839
  104    H    LEU  14           H        LEU  14  -5.947  -2.638  -2.986
  105    HA   LEU  14           HA       LEU  14  -3.776  -3.989  -4.330
  106   1HB   LEU  14          1HB       LEU  14  -4.467  -1.186  -3.513
  107   2HB   LEU  14          2HB       LEU  14  -2.767  -1.558  -3.887
  108    HG   LEU  14           HG       LEU  14  -4.845  -1.030  -5.733
  109   1HD1  LEU  14          1HD1      LEU  14  -3.085  -1.400  -7.378
  110   2HD1  LEU  14          2HD1      LEU  14  -2.370  -0.635  -5.939
  111   3HD1  LEU  14          3HD1      LEU  14  -2.156  -2.380  -6.217
  112   1HD2  LEU  14          1HD2      LEU  14  -5.327  -3.018  -6.856
  113   2HD2  LEU  14          2HD2      LEU  14  -3.888  -3.848  -6.216
  114   3HD2  LEU  14          3HD2      LEU  14  -5.301  -3.578  -5.166
  115    H    LEU  15           H        LEU  15  -4.340  -2.632  -1.071
  116    HA   LEU  15           HA       LEU  15  -1.655  -2.956  -0.149
  117   1HB   LEU  15          1HB       LEU  15  -4.297  -2.261   0.941
  118   2HB   LEU  15          2HB       LEU  15  -3.283  -3.170   2.087
  119    HG   LEU  15           HG       LEU  15  -1.636  -1.528   2.143
  120   1HD1  LEU  15          1HD1      LEU  15  -1.780   0.304   0.175
  121   2HD1  LEU  15          2HD1      LEU  15  -0.878  -1.219  -0.014
  122   3HD1  LEU  15          3HD1      LEU  15  -2.520  -1.069  -0.684
  123   1HD2  LEU  15          1HD2      LEU  15  -2.973   0.770   1.771
  124   2HD2  LEU  15          2HD2      LEU  15  -4.360  -0.343   1.717
  125   3HD2  LEU  15          3HD2      LEU  15  -3.312  -0.297   3.155
  126    H    LYS  16           H        LYS  16  -4.045  -5.223  -1.007
  127    HA   LYS  16           HA       LYS  16  -3.422  -7.237   0.977
  128   1HB   LYS  16          1HB       LYS  16  -5.409  -6.815  -0.938
  129   2HB   LYS  16          2HB       LYS  16  -4.496  -8.206  -1.569
  130   1HG   LYS  16          1HG       LYS  16  -4.674  -8.770   1.144
  131   2HG   LYS  16          2HG       LYS  16  -6.249  -8.018   0.794
  132   1HD   LYS  16          1HD       LYS  16  -5.248 -10.008  -1.198
  133   2HD   LYS  16          2HD       LYS  16  -5.753 -10.651   0.383
  134   1HE   LYS  16          1HE       LYS  16  -7.686  -8.699  -0.416
  135   2HE   LYS  16          2HE       LYS  16  -7.397  -9.766  -1.808
  136   1HZ   LYS  16          1HZ       LYS  16  -9.051 -10.750  -0.544
  137   2HZ   LYS  16          2HZ       LYS  16  -7.692 -11.618  -0.198
  138   3HZ   LYS  16          3HZ       LYS  16  -8.263 -10.513   0.885
  139    H    LYS  17           H        LYS  17  -1.330  -5.875  -0.960
  140    HA   LYS  17           HA       LYS  17   0.351  -8.205  -1.148
  141   1HB   LYS  17          1HB       LYS  17   0.336  -8.657  -3.411
  142   2HB   LYS  17          2HB       LYS  17  -1.370  -8.197  -3.190
  143   1HG   LYS  17          1HG       LYS  17  -0.485  -6.997  -5.117
  144   2HG   LYS  17          2HG       LYS  17  -0.744  -5.834  -3.795
  145   1HD   LYS  17          1HD       LYS  17   1.440  -5.278  -3.815
  146   2HD   LYS  17          2HD       LYS  17   1.899  -6.978  -3.555
  147   1HE   LYS  17          1HE       LYS  17   1.033  -6.029  -6.290
  148   2HE   LYS  17          2HE       LYS  17   2.698  -5.754  -5.733
  149   1HZ   LYS  17          1HZ       LYS  17   2.164  -7.868  -6.982
  150   2HZ   LYS  17          2HZ       LYS  17   3.082  -7.988  -5.617
  151   3HZ   LYS  17          3HZ       LYS  17   1.485  -8.400  -5.576
  152    H    TRP  18           H        TRP  18  -0.386  -4.856  -2.139
  153    HA   TRP  18           HA       TRP  18   2.359  -4.159  -2.663
  154   1HB   TRP  18          1HB       TRP  18  -0.015  -3.057  -3.272
  155   2HB   TRP  18          2HB       TRP  18   0.362  -2.109  -1.826
  156    HD1  TRP  18           HD       TRP  18   0.771  -2.014  -5.413
  157    HE1  TRP  18           1HE      TRP  18   2.577  -0.383  -6.163
  158    HE3  TRP  18           3HE      TRP  18   3.109  -1.278  -0.920
  159    HZ2  TRP  18           2HZ      TRP  18   4.776   1.071  -4.967
  160    HZ3  TRP  18           3HZ      TRP  18   5.053   0.235  -0.765
  161    HH2  TRP  18           HH       TRP  18   5.897   1.413  -2.774
  162    H    LYS  19           H        LYS  19   0.128  -3.762   0.125
  163    HA   LYS  19           HA       LYS  19   1.509  -2.199   1.847
  164   1HB   LYS  19          1HB       LYS  19  -0.595  -3.409   2.372
  165   2HB   LYS  19          2HB       LYS  19   0.333  -4.917   2.552
  166   1HG   LYS  19          1HG       LYS  19   1.522  -4.079   4.446
  167   2HG   LYS  19          2HG       LYS  19   0.996  -2.408   4.131
  168   1HD   LYS  19          1HD       LYS  19  -0.706  -2.788   5.568
  169   2HD   LYS  19          2HD       LYS  19  -1.394  -3.870   4.334
  170   1HE   LYS  19          1HE       LYS  19   0.280  -5.631   5.341
  171   2HE   LYS  19          2HE       LYS  19   0.285  -4.550   6.751
  172   1HZ   LYS  19          1HZ       LYS  19  -1.501  -6.463   6.303
  173   2HZ   LYS  19          2HZ       LYS  19  -1.751  -5.157   7.279
  174   3HZ   LYS  19          3HZ       LYS  19  -2.307  -5.145   5.726
  175    H    MET  20           H        MET  20   2.324  -5.595   1.038
  176    HA   MET  20           HA       MET  20   4.230  -6.313   2.785
  177   1HB   MET  20          1HB       MET  20   4.211  -7.829   1.092
  178   2HB   MET  20          2HB       MET  20   3.932  -6.586  -0.151
  179   1HG   MET  20          1HG       MET  20   6.480  -6.002   0.789
  180   2HG   MET  20          2HG       MET  20   6.445  -7.773   0.804
  181   1HE   MET  20          1HE       MET  20   4.376  -5.537  -1.817
  182   2HE   MET  20          2HE       MET  20   5.745  -4.576  -1.208
  183   3HE   MET  20          3HE       MET  20   5.717  -5.110  -2.906
  184    H    ARG  21           H        ARG  21   4.705  -3.860   0.207
  185    HA   ARG  21           HA       ARG  21   7.347  -3.207   1.377
  186   1HB   ARG  21          1HB       ARG  21   5.959  -2.631  -1.247
  187   2HB   ARG  21          2HB       ARG  21   7.366  -1.673  -0.726
  188   1HG   ARG  21          1HG       ARG  21   8.817  -3.493  -0.837
  189   2HG   ARG  21          2HG       ARG  21   7.514  -4.680  -0.591
  190   1HD   ARG  21          1HD       ARG  21   6.668  -3.620  -2.915
  191   2HD   ARG  21          2HD       ARG  21   8.406  -3.301  -3.095
  192    HE   ARG  21           HE       ARG  21   8.338  -5.929  -2.320
  193   1HH1  ARG  21          2HH2      ARG  21   6.720  -4.051  -4.840
  194   2HH1  ARG  21          1HH2      ARG  21   6.600  -5.394  -5.955
  195   1HH2  ARG  21          2HH1      ARG  21   8.180  -7.703  -3.792
  196   2HH2  ARG  21          1HH1      ARG  21   7.432  -7.476  -5.357
  197    H    ARG  22           H        ARG  22   4.194  -1.728   0.492
  198    HA   ARG  22           HA       ARG  22   4.812   0.881   1.435
  199   1HB   ARG  22          1HB       ARG  22   2.907   0.285  -0.064
  200   2HB   ARG  22          2HB       ARG  22   2.114  -0.523   1.310
  201   1HG   ARG  22          1HG       ARG  22   2.886   2.033   2.258
  202   2HG   ARG  22          2HG       ARG  22   2.190   2.304   0.642
  203   1HD   ARG  22          1HD       ARG  22   0.428   2.379   2.354
  204   2HD   ARG  22          2HD       ARG  22   0.198   0.976   1.289
  205    HE   ARG  22           HE       ARG  22   1.680  -0.058   3.345
  206   1HH1  ARG  22          2HH2      ARG  22  -1.284   1.861   3.165
  207   2HH1  ARG  22          1HH2      ARG  22  -1.973   1.186   4.625
  208   1HH2  ARG  22          2HH1      ARG  22   0.771  -0.950   5.274
  209   2HH2  ARG  22          1HH1      ARG  22  -0.801  -0.417   5.827
  210    H    ASN  23           H        ASN  23   5.317  -1.648   3.215
  211    HA   ASN  23           HA       ASN  23   4.338  -0.337   5.685
  212   1HB   ASN  23          1HB       ASN  23   3.070  -2.553   4.657
  213   2HB   ASN  23          2HB       ASN  23   4.271  -3.288   5.741
  214   1HD2  ASN  23          1HD2      ASN  23   2.833  -3.968   7.339
  215   2HD2  ASN  23          2HD2      ASN  23   1.937  -2.853   8.348
  216    H    GLN  24           H        GLN  24   6.921  -0.953   3.981
  217    HA   GLN  24           HA       GLN  24   8.696  -1.069   6.198
  218   1HB   GLN  24          1HB       GLN  24   9.652  -3.405   5.251
  219   2HB   GLN  24          2HB       GLN  24   8.471  -3.320   6.581
  220   1HG   GLN  24          1HG       GLN  24   6.735  -4.059   5.270
  221   2HG   GLN  24          2HG       GLN  24   7.374  -3.287   3.803
  222   1HE2  GLN  24          1HE2      GLN  24   7.482  -6.137   5.892
  223   2HE2  GLN  24          2HE2      GLN  24   8.365  -7.166   4.786
  224    H    PHE  25           H        PHE  25   9.556  -3.017   3.428
  225    HA   PHE  25           HA       PHE  25  11.780  -1.775   2.606
  226   1HB   PHE  25          1HB       PHE  25  11.111  -3.652   1.379
  227   2HB   PHE  25          2HB       PHE  25   9.521  -2.966   1.007
  228    HD1  PHE  25           1HD      PHE  25   9.709  -0.615  -0.349
  229    HD2  PHE  25           2HD      PHE  25  12.608  -3.784  -0.372
  230    HE1  PHE  25           1HE      PHE  25  10.564   0.183  -2.536
  231    HE2  PHE  25           2HE      PHE  25  13.463  -2.986  -2.559
  232    HZ   PHE  25           HZ       PHE  25  12.441  -1.002  -3.641
  233    H    TRP  26           H        TRP  26   8.467  -0.593   1.962
  234    HA   TRP  26           HA       TRP  26   9.026   1.468   0.175
  235   1HB   TRP  26          1HB       TRP  26   6.944   2.306   0.731
  236   2HB   TRP  26          2HB       TRP  26   6.805   0.612   1.220
  237    HD1  TRP  26           HD       TRP  26   6.223   0.117   3.661
  238    HE1  TRP  26           1HE      TRP  26   5.757   1.497   5.750
  239    HE3  TRP  26           3HE      TRP  26   7.743   4.697   1.957
  240    HZ2  TRP  26           2HZ      TRP  26   6.008   4.255   6.590
  241    HZ3  TRP  26           3HZ      TRP  26   7.614   6.674   3.428
  242    HH2  TRP  26           HH       TRP  26   6.751   6.471   5.741
  243    H    VAL  27           H        VAL  27   9.282   1.449   3.754
  244    HA   VAL  27           HA       VAL  27   9.781   4.060   4.348
  245    HB   VAL  27           HB       VAL  27  11.110   3.287   6.190
  246   1HG1  VAL  27          1HG1      VAL  27   9.310   2.226   7.034
  247   2HG1  VAL  27          2HG1      VAL  27   8.682   2.015   5.383
  248   3HG1  VAL  27          3HG1      VAL  27   9.717   0.762   6.108
  249   1HG2  VAL  27          1HG2      VAL  27  12.819   2.019   5.088
  250   2HG2  VAL  27          2HG2      VAL  27  11.963   0.869   6.143
  251   3HG2  VAL  27          3HG2      VAL  27  11.631   0.889   4.394
  252    H    LYS  28           H        LYS  28  12.148   1.752   2.927
  253    HA   LYS  28           HA       LYS  28  14.324   3.569   2.833
  254   1HB   LYS  28          1HB       LYS  28  13.575   1.085   1.268
  255   2HB   LYS  28          2HB       LYS  28  15.076   1.985   0.942
  256   1HG   LYS  28          1HG       LYS  28  16.062   1.270   2.867
  257   2HG   LYS  28          2HG       LYS  28  14.566   1.462   3.813
  258   1HD   LYS  28          1HD       LYS  28  14.212  -0.760   3.704
  259   2HD   LYS  28          2HD       LYS  28  14.161  -0.665   1.927
  260   1HE   LYS  28          1HE       LYS  28  16.433  -1.168   1.702
  261   2HE   LYS  28          2HE       LYS  28  16.820  -0.630   3.351
  262   1HZ   LYS  28          1HZ       LYS  28  16.254  -2.590   4.186
  263   2HZ   LYS  28          2HZ       LYS  28  15.010  -2.847   3.133
  264   3HZ   LYS  28          3HZ       LYS  28  16.563  -3.146   2.664
  265    H    VAL  29           H        VAL  29  11.617   2.920   0.600
  266    HA   VAL  29           HA       VAL  29  12.445   4.220  -1.688
  267    HB   VAL  29           HB       VAL  29   9.718   4.300  -0.338
  268   1HG1  VAL  29          1HG1      VAL  29  10.767   5.485  -2.821
  269   2HG1  VAL  29          2HG1      VAL  29   9.380   4.405  -3.098
  270   3HG1  VAL  29          3HG1      VAL  29   9.226   5.783  -1.981
  271   1HG2  VAL  29          1HG2      VAL  29  10.776   2.043  -0.879
  272   2HG2  VAL  29          2HG2      VAL  29   9.222   2.366  -1.685
  273   3HG2  VAL  29          3HG2      VAL  29  10.746   2.531  -2.590
  274    H    GLN  30           H        GLN  30  12.063   5.559   1.464
  275    HA   GLN  30           HA       GLN  30  11.807   8.311   0.408
  276   1HB   GLN  30          1HB       GLN  30  10.962   8.861   2.453
  277   2HB   GLN  30          2HB       GLN  30  10.658   7.111   2.563
  278   1HG   GLN  30          1HG       GLN  30  12.954   6.865   3.596
  279   2HG   GLN  30          2HG       GLN  30  13.057   8.638   3.646
  280   1HE2  GLN  30          1HE2      GLN  30  13.232   8.491   5.981
  281   2HE2  GLN  30          2HE2      GLN  30  11.800   8.232   6.955
  282    H    ARG  31           H        ARG  31  14.005   6.188   2.276
  283    HA   ARG  31           HA       ARG  31  16.119   6.721   3.144
  284   1HB   ARG  31          1HB       ARG  31  16.556   5.593   1.060
  285   2HB   ARG  31          2HB       ARG  31  16.262   7.082   0.129
  286   1HG   ARG  31          1HG       ARG  31  18.298   8.010   0.706
  287   2HG   ARG  31          2HG       ARG  31  18.350   7.180   2.280
  288   1HD   ARG  31          1HD       ARG  31  19.880   5.846   1.241
  289   2HD   ARG  31          2HD       ARG  31  18.437   5.042   0.587
  290    HE   ARG  31           HE       ARG  31  19.314   7.296  -1.026
  291   1HH1  ARG  31          2HH2      ARG  31  19.776   3.865  -0.306
  292   2HH1  ARG  31          1HH2      ARG  31  20.431   3.482  -1.883
  293   1HH2  ARG  31          2HH1      ARG  31  20.180   6.790  -3.108
  294   2HH2  ARG  31          1HH1      ARG  31  20.661   5.150  -3.480
  295    H    GLY  32           H        GLY  32  15.590   8.645   4.372
  296   1HA   GLY  32          1HA       GLY  32  17.189  10.896   3.632
  297   2HA   GLY  32          2HA       GLY  32  15.469  11.253   3.358
  Start of MODEL    7
    1    HA   PRO   1           HA       PRO   1 -10.817   9.736   0.312
    2   1HB   PRO   1          1HB       PRO   1 -12.170   7.416   0.771
    3   2HB   PRO   1          2HB       PRO   1 -10.479   7.649   1.322
    4   1HG   PRO   1          1HG       PRO   1 -13.011   8.055   2.939
    5   2HG   PRO   1          2HG       PRO   1 -11.581   7.068   3.386
    6   1HD   PRO   1          1HD       PRO   1 -11.871   9.631   4.268
    7   2HD   PRO   1          2HD       PRO   1 -10.267   9.022   3.759
    8    HA   PRO   2           HA       PRO   2 -14.822  10.828  -1.157
    9   1HB   PRO   2          1HB       PRO   2 -15.393   9.007  -3.101
   10   2HB   PRO   2          2HB       PRO   2 -14.007  10.137  -3.242
   11   1HG   PRO   2          1HG       PRO   2 -13.952   7.276  -2.239
   12   2HG   PRO   2          2HG       PRO   2 -12.918   8.003  -3.511
   13   1HD   PRO   2          1HD       PRO   2 -12.068   7.806  -0.929
   14   2HD   PRO   2          2HD       PRO   2 -11.705   9.269  -1.895
   15    H    LEU   3           H        LEU   3 -14.305   7.981   0.613
   16    HA   LEU   3           HA       LEU   3 -15.740   6.345   1.450
   17   1HB   LEU   3          1HB       LEU   3 -16.204   8.994   2.434
   18   2HB   LEU   3          2HB       LEU   3 -17.770   8.150   2.368
   19    HG   LEU   3           HG       LEU   3 -15.515   6.511   3.386
   20   1HD1  LEU   3          1HD1      LEU   3 -15.894   7.673   5.699
   21   2HD1  LEU   3          2HD1      LEU   3 -14.778   8.430   4.537
   22   3HD1  LEU   3          3HD1      LEU   3 -16.430   9.065   4.728
   23   1HD2  LEU   3          1HD2      LEU   3 -17.633   6.597   5.216
   24   2HD2  LEU   3          2HD2      LEU   3 -18.421   6.812   3.635
   25   3HD2  LEU   3          3HD2      LEU   3 -17.400   5.385   3.934
   26    H    SER   4           H        SER   4 -16.184   6.228  -1.196
   27    HA   SER   4           HA       SER   4 -19.105   5.814  -1.304
   28   1HB   SER   4          1HB       SER   4 -18.105   8.108  -2.368
   29   2HB   SER   4          2HB       SER   4 -17.902   7.005  -3.751
   30    HG   SER   4           HG       SER   4 -20.300   6.740  -2.446
   31    H    GLN   5           H        GLN   5 -16.296   4.388  -1.287
   32    HA   GLN   5           HA       GLN   5 -15.811   2.226  -2.008
   33   1HB   GLN   5          1HB       GLN   5 -17.336   1.039  -3.203
   34   2HB   GLN   5          2HB       GLN   5 -18.385   2.448  -2.916
   35   1HG   GLN   5          1HG       GLN   5 -17.172   3.398  -5.069
   36   2HG   GLN   5          2HG       GLN   5 -16.841   1.681  -5.388
   37   1HE2  GLN   5          1HE2      GLN   5 -18.729   3.871  -6.570
   38   2HE2  GLN   5          2HE2      GLN   5 -20.271   3.049  -6.683
   39    H    GLU   6           H        GLU   6 -15.861   5.148  -3.845
   40    HA   GLU   6           HA       GLU   6 -14.680   4.698  -6.232
   41   1HB   GLU   6          1HB       GLU   6 -14.813   6.836  -4.410
   42   2HB   GLU   6          2HB       GLU   6 -13.083   6.657  -4.786
   43   1HG   GLU   6          1HG       GLU   6 -13.678   7.960  -6.583
   44   2HG   GLU   6          2HG       GLU   6 -14.075   6.371  -7.273
   45    H    THR   7           H        THR   7 -12.835   4.791  -3.127
   46    HA   THR   7           HA       THR   7 -10.586   3.463  -4.522
   47    HB   THR   7           HB       THR   7 -10.119   4.067  -1.728
   48    HG1  THR   7           1HG      THR   7 -10.759   6.087  -1.630
   49   1HG2  THR   7          1HG2      THR   7  -8.186   4.074  -2.965
   50   2HG2  THR   7          2HG2      THR   7  -9.008   4.644  -4.438
   51   3HG2  THR   7          3HG2      THR   7  -8.583   5.799  -3.152
   52    H    PHE   8           H        PHE   8 -11.208   3.152  -1.066
   53    HA   PHE   8           HA       PHE   8 -10.720   0.900  -0.166
   54   1HB   PHE   8          1HB       PHE   8 -13.700   0.968  -0.528
   55   2HB   PHE   8          2HB       PHE   8 -12.748   0.562   0.909
   56    HD1  PHE   8           1HD      PHE   8 -12.950   3.551  -1.372
   57    HD2  PHE   8           2HD      PHE   8 -13.113   2.040   2.645
   58    HE1  PHE   8           1HE      PHE   8 -13.256   5.858  -0.517
   59    HE2  PHE   8           2HE      PHE   8 -13.419   4.347   3.501
   60    HZ   PHE   8           HZ       PHE   8 -13.490   6.257   1.920
   61    H    SER   9           H        SER   9 -13.426   0.708  -2.556
   62    HA   SER   9           HA       SER   9 -13.612  -1.926  -3.035
   63   1HB   SER   9          1HB       SER   9 -14.663   0.040  -4.313
   64   2HB   SER   9          2HB       SER   9 -13.221  -0.013  -5.355
   65    HG   SER   9           HG       SER   9 -15.205  -1.978  -4.949
   66    H    ASP  10           H        ASP  10 -11.132   0.104  -4.706
   67    HA   ASP  10           HA       ASP  10  -9.580  -2.390  -5.172
   68   1HB   ASP  10          1HB       ASP  10  -9.996   0.161  -6.642
   69   2HB   ASP  10          2HB       ASP  10  -8.340  -0.483  -6.661
   70    H    LEU  11           H        LEU  11  -9.697   0.601  -3.402
   71    HA   LEU  11           HA       LEU  11  -6.888   0.949  -2.979
   72   1HB   LEU  11          1HB       LEU  11  -8.859   2.588  -2.583
   73   2HB   LEU  11          2HB       LEU  11  -9.058   1.747  -1.027
   74    HG   LEU  11           HG       LEU  11  -6.614   3.245  -2.042
   75   1HD1  LEU  11          1HD1      LEU  11  -7.049   4.150   0.444
   76   2HD1  LEU  11          2HD1      LEU  11  -7.919   4.819  -0.958
   77   3HD1  LEU  11          3HD1      LEU  11  -8.705   3.607   0.082
   78   1HD2  LEU  11          1HD2      LEU  11  -5.629   2.504   0.204
   79   2HD2  LEU  11          2HD2      LEU  11  -6.931   1.292   0.267
   80   3HD2  LEU  11          3HD2      LEU  11  -5.736   1.246  -1.051
   81    H    TRP  12           H        TRP  12  -9.390  -0.164  -0.622
   82    HA   TRP  12           HA       TRP  12  -7.631  -1.183   1.278
   83   1HB   TRP  12          1HB       TRP  12  -9.562  -1.656   2.277
   84   2HB   TRP  12          2HB       TRP  12 -10.396  -1.146   0.802
   85    HD1  TRP  12           HD       TRP  12 -12.004  -2.848  -0.097
   86    HE1  TRP  12           1HE      TRP  12 -12.315  -5.375  -0.017
   87    HE3  TRP  12           3HE      TRP  12  -7.814  -4.093   2.566
   88    HZ2  TRP  12           2HZ      TRP  12 -10.921  -7.667   1.069
   89    HZ3  TRP  12           3HZ      TRP  12  -7.340  -6.454   3.103
   90    HH2  TRP  12           HH       TRP  12  -8.880  -8.249   2.364
   91    H    LYS  13           H        LYS  13  -8.803  -2.648  -1.748
   92    HA   LYS  13           HA       LYS  13  -7.678  -5.251  -1.170
   93   1HB   LYS  13          1HB       LYS  13  -9.496  -4.199  -2.993
   94   2HB   LYS  13          2HB       LYS  13  -8.075  -4.573  -3.999
   95   1HG   LYS  13          1HG       LYS  13  -8.114  -6.819  -2.523
   96   2HG   LYS  13          2HG       LYS  13  -9.843  -6.410  -2.418
   97   1HD   LYS  13          1HD       LYS  13 -10.083  -6.422  -4.808
   98   2HD   LYS  13          2HD       LYS  13  -8.320  -6.480  -5.050
   99   1HE   LYS  13          1HE       LYS  13  -8.540  -8.692  -3.583
  100   2HE   LYS  13          2HE       LYS  13 -10.211  -8.653  -4.186
  101   1HZ   LYS  13          1HZ       LYS  13  -9.134  -9.820  -5.778
  102   2HZ   LYS  13          2HZ       LYS  13  -9.044  -8.303  -6.419
  103   3HZ   LYS  13          3HZ       LYS  13  -7.731  -8.960  -5.667
  104    H    LEU  14           H        LEU  14  -6.565  -2.236  -2.627
  105    HA   LEU  14           HA       LEU  14  -4.349  -3.241  -4.075
  106   1HB   LEU  14          1HB       LEU  14  -5.445  -0.701  -3.292
  107   2HB   LEU  14          2HB       LEU  14  -3.698  -0.699  -2.950
  108    HG   LEU  14           HG       LEU  14  -4.018   0.037  -5.242
  109   1HD1  LEU  14          1HD1      LEU  14  -2.540  -2.274  -4.484
  110   2HD1  LEU  14          2HD1      LEU  14  -3.249  -2.626  -6.078
  111   3HD1  LEU  14          3HD1      LEU  14  -2.227  -1.185  -5.857
  112   1HD2  LEU  14          1HD2      LEU  14  -6.223  -0.804  -5.716
  113   2HD2  LEU  14          2HD2      LEU  14  -5.120  -1.581  -6.877
  114   3HD2  LEU  14          3HD2      LEU  14  -5.703  -2.487  -5.460
  115    H    LEU  15           H        LEU  15  -4.682  -2.154  -0.667
  116    HA   LEU  15           HA       LEU  15  -1.913  -2.604  -0.034
  117   1HB   LEU  15          1HB       LEU  15  -4.426  -1.893   1.389
  118   2HB   LEU  15          2HB       LEU  15  -3.184  -2.710   2.368
  119    HG   LEU  15           HG       LEU  15  -1.943  -0.723   0.659
  120   1HD1  LEU  15          1HD1      LEU  15  -3.822   0.527   2.659
  121   2HD1  LEU  15          2HD1      LEU  15  -3.041   1.254   1.235
  122   3HD1  LEU  15          3HD1      LEU  15  -4.418   0.146   1.025
  123   1HD2  LEU  15          1HD2      LEU  15  -1.737   0.131   3.287
  124   2HD2  LEU  15          2HD2      LEU  15  -2.033  -1.614   3.472
  125   3HD2  LEU  15          3HD2      LEU  15  -0.654  -1.043   2.502
  126    H    LYS  16           H        LYS  16  -4.431  -4.721  -0.777
  127    HA   LYS  16           HA       LYS  16  -3.834  -6.801   1.148
  128   1HB   LYS  16          1HB       LYS  16  -5.903  -6.251  -0.594
  129   2HB   LYS  16          2HB       LYS  16  -5.066  -7.590  -1.415
  130   1HG   LYS  16          1HG       LYS  16  -5.386  -7.927   1.518
  131   2HG   LYS  16          2HG       LYS  16  -6.908  -7.919   0.595
  132   1HD   LYS  16          1HD       LYS  16  -4.740  -9.501  -0.655
  133   2HD   LYS  16          2HD       LYS  16  -5.277 -10.121   0.924
  134   1HE   LYS  16          1HE       LYS  16  -7.020 -11.059  -0.152
  135   2HE   LYS  16          2HE       LYS  16  -7.650  -9.415  -0.389
  136   1HZ   LYS  16          1HZ       LYS  16  -7.512 -10.479  -2.460
  137   2HZ   LYS  16          2HZ       LYS  16  -6.316  -9.344  -2.424
  138   3HZ   LYS  16          3HZ       LYS  16  -5.946 -10.939  -2.224
  139    H    LYS  17           H        LYS  17  -1.773  -5.503  -0.885
  140    HA   LYS  17           HA       LYS  17  -0.230  -7.928  -1.185
  141   1HB   LYS  17          1HB       LYS  17  -1.118  -8.518  -3.186
  142   2HB   LYS  17          2HB       LYS  17  -1.873  -6.924  -3.428
  143   1HG   LYS  17          1HG       LYS  17   1.110  -7.460  -3.737
  144   2HG   LYS  17          2HG       LYS  17  -0.046  -7.459  -5.090
  145   1HD   LYS  17          1HD       LYS  17  -0.603  -5.086  -3.697
  146   2HD   LYS  17          2HD       LYS  17   1.173  -5.200  -3.684
  147   1HE   LYS  17          1HE       LYS  17  -0.405  -5.711  -6.216
  148   2HE   LYS  17          2HE       LYS  17   0.015  -4.056  -5.721
  149   1HZ   LYS  17          1HZ       LYS  17   1.714  -4.774  -7.086
  150   2HZ   LYS  17          2HZ       LYS  17   2.334  -4.920  -5.565
  151   3HZ   LYS  17          3HZ       LYS  17   1.821  -6.260  -6.378
  152    H    TRP  18           H        TRP  18  -0.788  -4.497  -1.982
  153    HA   TRP  18           HA       TRP  18   1.986  -3.955  -2.571
  154   1HB   TRP  18          1HB       TRP  18  -0.311  -2.689  -3.106
  155   2HB   TRP  18          2HB       TRP  18   0.116  -1.830  -1.620
  156    HD1  TRP  18           HD       TRP  18   0.587  -1.671  -5.221
  157    HE1  TRP  18           1HE      TRP  18   2.456  -0.076  -5.893
  158    HE3  TRP  18           3HE      TRP  18   2.819  -1.072  -0.654
  159    HZ2  TRP  18           2HZ      TRP  18   4.657   1.298  -4.613
  160    HZ3  TRP  18           3HZ      TRP  18   4.797   0.385  -0.420
  161    HH2  TRP  18           HH       TRP  18   5.726   1.575  -2.385
  162    H    LYS  19           H        LYS  19  -0.152  -3.552   0.285
  163    HA   LYS  19           HA       LYS  19   1.337  -2.128   2.033
  164   1HB   LYS  19          1HB       LYS  19  -0.799  -3.271   2.567
  165   2HB   LYS  19          2HB       LYS  19   0.066  -4.824   2.653
  166   1HG   LYS  19          1HG       LYS  19   1.425  -2.814   4.258
  167   2HG   LYS  19          2HG       LYS  19  -0.284  -2.942   4.739
  168   1HD   LYS  19          1HD       LYS  19   0.276  -5.569   4.503
  169   2HD   LYS  19          2HD       LYS  19   1.908  -4.977   4.893
  170   1HE   LYS  19          1HE       LYS  19   0.745  -3.652   6.799
  171   2HE   LYS  19          2HE       LYS  19  -0.636  -4.735   6.520
  172   1HZ   LYS  19          1HZ       LYS  19   0.562  -6.527   7.190
  173   2HZ   LYS  19          2HZ       LYS  19   2.030  -5.836   6.899
  174   3HZ   LYS  19          3HZ       LYS  19   1.142  -5.366   8.207
  175    H    MET  20           H        MET  20   2.000  -5.505   1.039
  176    HA   MET  20           HA       MET  20   3.924  -6.365   2.716
  177   1HB   MET  20          1HB       MET  20   3.807  -7.833   0.990
  178   2HB   MET  20          2HB       MET  20   3.490  -6.552  -0.204
  179   1HG   MET  20          1HG       MET  20   6.102  -6.056   0.624
  180   2HG   MET  20          2HG       MET  20   6.019  -7.825   0.570
  181   1HE   MET  20          1HE       MET  20   5.344  -4.518  -1.301
  182   2HE   MET  20          2HE       MET  20   5.139  -5.012  -2.999
  183   3HE   MET  20          3HE       MET  20   3.886  -5.410  -1.798
  184    H    ARG  21           H        ARG  21   4.411  -3.854   0.197
  185    HA   ARG  21           HA       ARG  21   7.130  -3.364   1.255
  186   1HB   ARG  21          1HB       ARG  21   5.616  -2.580  -1.242
  187   2HB   ARG  21          2HB       ARG  21   7.094  -1.713  -0.757
  188   1HG   ARG  21          1HG       ARG  21   8.454  -3.567  -1.083
  189   2HG   ARG  21          2HG       ARG  21   7.135  -4.722  -0.774
  190   1HD   ARG  21          1HD       ARG  21   6.134  -3.557  -2.978
  191   2HD   ARG  21          2HD       ARG  21   7.858  -3.262  -3.291
  192    HE   ARG  21           HE       ARG  21   7.862  -5.899  -2.653
  193   1HH1  ARG  21          2HH2      ARG  21   5.849  -3.960  -4.818
  194   2HH1  ARG  21          1HH2      ARG  21   5.551  -5.271  -5.937
  195   1HH2  ARG  21          2HH1      ARG  21   7.468  -7.631  -4.132
  196   2HH2  ARG  21          1HH1      ARG  21   6.475  -7.364  -5.546
  197    H    ARG  22           H        ARG  22   3.997  -1.711   0.659
  198    HA   ARG  22           HA       ARG  22   4.779   0.818   1.685
  199   1HB   ARG  22          1HB       ARG  22   2.750   0.390   0.313
  200   2HB   ARG  22          2HB       ARG  22   2.033  -0.498   1.680
  201   1HG   ARG  22          1HG       ARG  22   2.971   1.990   2.710
  202   2HG   ARG  22          2HG       ARG  22   2.093   2.353   1.205
  203   1HD   ARG  22          1HD       ARG  22   0.600   2.317   3.208
  204   2HD   ARG  22          2HD       ARG  22   0.146   1.107   1.989
  205    HE   ARG  22           HE       ARG  22   1.739  -0.367   3.584
  206   1HH1  ARG  22          2HH2      ARG  22  -0.835   1.939   4.331
  207   2HH1  ARG  22          1HH2      ARG  22  -1.308   1.139   5.814
  208   1HH2  ARG  22          2HH1      ARG  22   1.114  -1.423   5.542
  209   2HH2  ARG  22          1HH1      ARG  22  -0.197  -0.778   6.503
  210    H    ASN  23           H        ASN  23   5.318  -1.817   3.296
  211    HA   ASN  23           HA       ASN  23   4.585  -0.598   5.895
  212   1HB   ASN  23          1HB       ASN  23   3.149  -2.710   4.862
  213   2HB   ASN  23          2HB       ASN  23   4.395  -3.543   5.817
  214   1HD2  ASN  23          1HD2      ASN  23   3.519  -4.116   7.731
  215   2HD2  ASN  23          2HD2      ASN  23   2.568  -3.068   8.762
  216    H    GLN  24           H        GLN  24   7.003  -1.219   3.971
  217    HA   GLN  24           HA       GLN  24   8.932  -1.529   6.038
  218   1HB   GLN  24          1HB       GLN  24   9.720  -3.837   4.895
  219   2HB   GLN  24          2HB       GLN  24   8.637  -3.789   6.307
  220   1HG   GLN  24          1HG       GLN  24   6.811  -4.440   5.095
  221   2HG   GLN  24          2HG       GLN  24   7.313  -3.526   3.656
  222   1HE2  GLN  24          1HE2      GLN  24   6.697  -6.572   4.700
  223   2HE2  GLN  24          2HE2      GLN  24   7.804  -7.485   3.697
  224    H    PHE  25           H        PHE  25   9.515  -3.341   3.111
  225    HA   PHE  25           HA       PHE  25  11.717  -2.123   2.195
  226   1HB   PHE  25          1HB       PHE  25  10.902  -3.910   0.925
  227   2HB   PHE  25          2HB       PHE  25   9.311  -3.161   0.707
  228    HD1  PHE  25           1HD      PHE  25   9.474  -0.747  -0.536
  229    HD2  PHE  25           2HD      PHE  25  12.264  -3.989  -0.936
  230    HE1  PHE  25           1HE      PHE  25  10.193   0.144  -2.736
  231    HE2  PHE  25           2HE      PHE  25  12.983  -3.098  -3.136
  232    HZ   PHE  25           HZ       PHE  25  11.948  -1.032  -4.036
  233    H    TRP  26           H        TRP  26   8.409  -0.808   1.865
  234    HA   TRP  26           HA       TRP  26   8.902   1.326   0.146
  235   1HB   TRP  26          1HB       TRP  26   6.899   2.195   0.901
  236   2HB   TRP  26          2HB       TRP  26   6.739   0.484   1.321
  237    HD1  TRP  26           HD       TRP  26   6.328  -0.111   3.774
  238    HE1  TRP  26           1HE      TRP  26   6.072   1.180   5.955
  239    HE3  TRP  26           3HE      TRP  26   7.873   4.497   2.170
  240    HZ2  TRP  26           2HZ      TRP  26   6.483   3.884   6.899
  241    HZ3  TRP  26           3HZ      TRP  26   7.926   6.403   3.737
  242    HH2  TRP  26           HH       TRP  26   7.237   6.115   6.098
  243    H    VAL  27           H        VAL  27   9.427   1.111   3.690
  244    HA   VAL  27           HA       VAL  27  10.063   3.671   4.372
  245    HB   VAL  27           HB       VAL  27  11.496   2.761   6.066
  246   1HG1  VAL  27          1HG1      VAL  27   9.727   1.715   6.992
  247   2HG1  VAL  27          2HG1      VAL  27   8.972   1.608   5.384
  248   3HG1  VAL  27          3HG1      VAL  27  10.014   0.288   5.967
  249   1HG2  VAL  27          1HG2      VAL  27  13.070   1.501   4.765
  250   2HG2  VAL  27          2HG2      VAL  27  12.266   0.330   5.839
  251   3HG2  VAL  27          3HG2      VAL  27  11.792   0.438   4.126
  252    H    LYS  28           H        LYS  28  12.236   1.364   2.667
  253    HA   LYS  28           HA       LYS  28  14.462   3.112   2.495
  254   1HB   LYS  28          1HB       LYS  28  13.507   0.743   0.864
  255   2HB   LYS  28          2HB       LYS  28  15.015   1.607   0.478
  256   1HG   LYS  28          1HG       LYS  28  14.385   0.515   3.247
  257   2HG   LYS  28          2HG       LYS  28  15.281  -0.408   2.017
  258   1HD   LYS  28          1HD       LYS  28  17.175   0.704   2.522
  259   2HD   LYS  28          2HD       LYS  28  16.377   2.259   2.188
  260   1HE   LYS  28          1HE       LYS  28  15.775   2.585   4.409
  261   2HE   LYS  28          2HE       LYS  28  15.770   0.846   4.773
  262   1HZ   LYS  28          1HZ       LYS  28  18.304   1.272   4.159
  263   2HZ   LYS  28          2HZ       LYS  28  17.924   2.723   4.846
  264   3HZ   LYS  28          3HZ       LYS  28  17.703   1.325   5.694
  265    H    VAL  29           H        VAL  29  11.575   2.669   0.443
  266    HA   VAL  29           HA       VAL  29  12.277   4.063  -1.831
  267    HB   VAL  29           HB       VAL  29   9.661   4.159  -0.277
  268   1HG1  VAL  29          1HG1      VAL  29   9.800   5.993  -1.909
  269   2HG1  VAL  29          2HG1      VAL  29  10.320   4.852  -3.172
  270   3HG1  VAL  29          3HG1      VAL  29   8.678   4.740  -2.494
  271   1HG2  VAL  29          1HG2      VAL  29  10.592   1.899  -1.002
  272   2HG2  VAL  29          2HG2      VAL  29   8.999   2.314  -1.678
  273   3HG2  VAL  29          3HG2      VAL  29  10.460   2.473  -2.682
  274    H    GLN  30           H        GLN  30  12.173   5.243   1.405
  275    HA   GLN  30           HA       GLN  30  11.937   8.054   0.514
  276   1HB   GLN  30          1HB       GLN  30  11.267   8.519   2.643
  277   2HB   GLN  30          2HB       GLN  30  10.913   6.775   2.687
  278   1HG   GLN  30          1HG       GLN  30  13.269   6.405   3.527
  279   2HG   GLN  30          2HG       GLN  30  13.439   8.169   3.656
  280   1HE2  GLN  30          1HE2      GLN  30  12.259   9.322   5.248
  281   2HE2  GLN  30          2HE2      GLN  30  11.484   8.508   6.590
  282    H    ARG  31           H        ARG  31  14.194   5.767   2.096
  283    HA   ARG  31           HA       ARG  31  16.385   6.188   2.825
  284   1HB   ARG  31          1HB       ARG  31  16.626   5.158   0.661
  285   2HB   ARG  31          2HB       ARG  31  16.313   6.701  -0.170
  286   1HG   ARG  31          1HG       ARG  31  18.459   7.091   1.709
  287   2HG   ARG  31          2HG       ARG  31  18.823   5.655   0.723
  288   1HD   ARG  31          1HD       ARG  31  18.664   6.874  -1.309
  289   2HD   ARG  31          2HD       ARG  31  17.837   8.236  -0.524
  290    HE   ARG  31           HE       ARG  31  20.537   7.701   0.475
  291   1HH1  ARG  31          2HH2      ARG  31  18.514   9.424  -1.857
  292   2HH1  ARG  31          1HH2      ARG  31  19.685  10.692  -2.143
  293   1HH2  ARG  31          2HH1      ARG  31  22.084   9.375   0.097
  294   2HH2  ARG  31          1HH1      ARG  31  21.721  10.663  -1.029
  295    H    GLY  32           H        GLY  32  16.159   8.023   4.205
  296   1HA   GLY  32          1HA       GLY  32  16.759  10.633   2.896
  297   2HA   GLY  32          2HA       GLY  32  15.955  10.428   4.469
  Start of MODEL    8
    1    HA   PRO   1           HA       PRO   1 -12.879  11.395   2.226
    2   1HB   PRO   1          1HB       PRO   1 -15.022   9.723   2.403
    3   2HB   PRO   1          2HB       PRO   1 -14.483  10.718   3.794
    4   1HG   PRO   1          1HG       PRO   1 -16.668  11.379   1.799
    5   2HG   PRO   1          2HG       PRO   1 -16.790  11.388   3.589
    6   1HD   PRO   1          1HD       PRO   1 -16.284  13.670   2.186
    7   2HD   PRO   1          2HD       PRO   1 -15.445  13.353   3.735
    8    HA   PRO   2           HA       PRO   2 -13.214  10.076  -1.962
    9   1HB   PRO   2          1HB       PRO   2 -12.975   7.363  -1.873
   10   2HB   PRO   2          2HB       PRO   2 -11.648   8.447  -1.342
   11   1HG   PRO   2          1HG       PRO   2 -13.752   7.129   0.398
   12   2HG   PRO   2          2HG       PRO   2 -11.973   7.086   0.621
   13   1HD   PRO   2          1HD       PRO   2 -13.529   8.890   1.946
   14   2HD   PRO   2          2HD       PRO   2 -11.936   9.375   1.289
   15    H    LEU   3           H        LEU   3 -15.701   9.716   0.184
   16    HA   LEU   3           HA       LEU   3 -17.971   9.635  -0.348
   17   1HB   LEU   3          1HB       LEU   3 -16.950   9.681  -2.865
   18   2HB   LEU   3          2HB       LEU   3 -17.620   8.031  -2.831
   19    HG   LEU   3           HG       LEU   3 -19.326   9.615  -3.621
   20   1HD1  LEU   3          1HD1      LEU   3 -19.874   8.734  -0.755
   21   2HD1  LEU   3          2HD1      LEU   3 -21.091   9.072  -2.009
   22   3HD1  LEU   3          3HD1      LEU   3 -19.995   7.680  -2.184
   23   1HD2  LEU   3          1HD2      LEU   3 -18.548  11.049  -1.072
   24   2HD2  LEU   3          2HD2      LEU   3 -18.720  11.704  -2.718
   25   3HD2  LEU   3          3HD2      LEU   3 -20.167  11.270  -1.778
   26    H    SER   4           H        SER   4 -15.650   7.177  -0.093
   27    HA   SER   4           HA       SER   4 -15.789   5.143   0.975
   28   1HB   SER   4          1HB       SER   4 -17.636   4.623   2.266
   29   2HB   SER   4          2HB       SER   4 -17.890   6.371   2.048
   30    HG   SER   4           HG       SER   4 -19.382   4.287   1.177
   31    H    GLN   5           H        GLN   5 -15.545   3.226  -0.032
   32    HA   GLN   5           HA       GLN   5 -16.140   1.423  -1.388
   33   1HB   GLN   5          1HB       GLN   5 -18.542   2.569  -1.258
   34   2HB   GLN   5          2HB       GLN   5 -18.145   3.042  -2.928
   35   1HG   GLN   5          1HG       GLN   5 -17.873   0.774  -3.613
   36   2HG   GLN   5          2HG       GLN   5 -17.825   0.192  -1.935
   37   1HE2  GLN   5          1HE2      GLN   5 -19.535  -1.312  -2.782
   38   2HE2  GLN   5          2HE2      GLN   5 -21.195  -0.758  -2.759
   39    H    GLU   6           H        GLU   6 -15.960   4.743  -2.673
   40    HA   GLU   6           HA       GLU   6 -15.221   4.235  -5.307
   41   1HB   GLU   6          1HB       GLU   6 -14.497   6.375  -3.305
   42   2HB   GLU   6          2HB       GLU   6 -13.767   6.379  -4.928
   43   1HG   GLU   6          1HG       GLU   6 -16.709   5.934  -4.830
   44   2HG   GLU   6          2HG       GLU   6 -16.159   7.551  -4.340
   45    H    THR   7           H        THR   7 -13.099   4.402  -2.399
   46    HA   THR   7           HA       THR   7 -10.860   3.370  -4.024
   47    HB   THR   7           HB       THR   7 -10.387   3.742  -1.158
   48    HG1  THR   7           1HG      THR   7 -11.197   5.660  -0.934
   49   1HG2  THR   7          1HG2      THR   7  -8.685   3.614  -3.006
   50   2HG2  THR   7          2HG2      THR   7  -9.300   5.167  -3.623
   51   3HG2  THR   7          3HG2      THR   7  -8.541   5.086  -2.015
   52    H    PHE   8           H        PHE   8 -11.214   2.623  -0.606
   53    HA   PHE   8           HA       PHE   8 -10.568   0.378   0.085
   54   1HB   PHE   8          1HB       PHE   8 -13.528   0.140  -0.392
   55   2HB   PHE   8          2HB       PHE   8 -12.574  -0.350   1.019
   56    HD1  PHE   8           1HD      PHE   8 -13.011   2.884  -0.857
   57    HD2  PHE   8           2HD      PHE   8 -13.184   0.827   2.910
   58    HE1  PHE   8           1HE      PHE   8 -13.594   5.011   0.278
   59    HE2  PHE   8           2HE      PHE   8 -13.767   2.954   4.045
   60    HZ   PHE   8           HZ       PHE   8 -13.972   5.046   2.728
   61    H    SER   9           H        SER   9 -13.179   0.075  -2.395
   62    HA   SER   9           HA       SER   9 -12.985  -2.495  -3.145
   63   1HB   SER   9          1HB       SER   9 -14.329  -0.647  -4.248
   64   2HB   SER   9          2HB       SER   9 -12.873  -0.254  -5.194
   65    HG   SER   9           HG       SER   9 -14.232  -2.747  -5.108
   66    H    ASP  10           H        ASP  10 -10.839   0.006  -4.630
   67    HA   ASP  10           HA       ASP  10  -8.976  -2.158  -5.395
   68   1HB   ASP  10          1HB       ASP  10  -9.211   0.782  -6.119
   69   2HB   ASP  10          2HB       ASP  10  -7.857  -0.246  -6.635
   70    H    LEU  11           H        LEU  11  -9.366   0.538  -3.166
   71    HA   LEU  11           HA       LEU  11  -6.607   0.868  -2.492
   72   1HB   LEU  11          1HB       LEU  11  -8.888   2.226  -1.948
   73   2HB   LEU  11          2HB       LEU  11  -8.695   1.338  -0.418
   74    HG   LEU  11           HG       LEU  11  -6.289   2.138  -0.364
   75   1HD1  LEU  11          1HD1      LEU  11  -5.427   3.241  -2.131
   76   2HD1  LEU  11          2HD1      LEU  11  -6.949   2.946  -3.005
   77   3HD1  LEU  11          3HD1      LEU  11  -6.739   4.443  -2.066
   78   1HD2  LEU  11          1HD2      LEU  11  -7.520   4.724  -0.350
   79   2HD2  LEU  11          2HD2      LEU  11  -8.735   3.545   0.199
   80   3HD2  LEU  11          3HD2      LEU  11  -7.169   3.666   1.037
   81    H    TRP  12           H        TRP  12  -9.224  -0.602  -0.482
   82    HA   TRP  12           HA       TRP  12  -7.588  -1.848   1.378
   83   1HB   TRP  12          1HB       TRP  12  -9.573  -2.513   2.129
   84   2HB   TRP  12          2HB       TRP  12 -10.305  -1.836   0.667
   85    HD1  TRP  12           HD       TRP  12 -11.766  -3.457  -0.568
   86    HE1  TRP  12           1HE      TRP  12 -11.957  -5.980  -0.860
   87    HE3  TRP  12           3HE      TRP  12  -7.720  -4.901   2.214
   88    HZ2  TRP  12           2HZ      TRP  12 -10.533  -8.347   0.004
   89    HZ3  TRP  12           3HZ      TRP  12  -7.170  -7.294   2.456
   90    HH2  TRP  12           HH       TRP  12  -8.562  -9.025   1.360
   91    H    LYS  13           H        LYS  13  -8.503  -2.941  -1.894
   92    HA   LYS  13           HA       LYS  13  -7.299  -5.547  -1.604
   93   1HB   LYS  13          1HB       LYS  13  -9.116  -4.644  -3.282
   94   2HB   LYS  13          2HB       LYS  13  -7.701  -4.161  -4.250
   95   1HG   LYS  13          1HG       LYS  13  -7.592  -6.910  -3.117
   96   2HG   LYS  13          2HG       LYS  13  -8.842  -6.645  -4.355
   97   1HD   LYS  13          1HD       LYS  13  -6.211  -5.442  -4.995
   98   2HD   LYS  13          2HD       LYS  13  -6.203  -7.219  -4.896
   99   1HE   LYS  13          1HE       LYS  13  -8.443  -6.959  -6.317
  100   2HE   LYS  13          2HE       LYS  13  -7.702  -5.409  -6.771
  101   1HZ   LYS  13          1HZ       LYS  13  -7.076  -7.089  -8.295
  102   2HZ   LYS  13          2HZ       LYS  13  -5.743  -6.655  -7.426
  103   3HZ   LYS  13          3HZ       LYS  13  -6.517  -8.074  -7.096
  104    H    LEU  14           H        LEU  14  -6.217  -2.332  -2.639
  105    HA   LEU  14           HA       LEU  14  -3.811  -3.129  -3.922
  106   1HB   LEU  14          1HB       LEU  14  -5.082  -0.675  -2.961
  107   2HB   LEU  14          2HB       LEU  14  -3.316  -0.648  -2.736
  108    HG   LEU  14           HG       LEU  14  -4.482   0.053  -5.065
  109   1HD1  LEU  14          1HD1      LEU  14  -2.219  -1.236  -6.000
  110   2HD1  LEU  14          2HD1      LEU  14  -2.236   0.366  -5.225
  111   3HD1  LEU  14          3HD1      LEU  14  -1.876  -1.085  -4.260
  112   1HD2  LEU  14          1HD2      LEU  14  -5.122  -2.654  -4.916
  113   2HD2  LEU  14          2HD2      LEU  14  -5.112  -1.668  -6.398
  114   3HD2  LEU  14          3HD2      LEU  14  -3.681  -2.633  -5.961
  115    H    LEU  15           H        LEU  15  -4.539  -2.215  -0.520
  116    HA   LEU  15           HA       LEU  15  -1.847  -2.519   0.397
  117   1HB   LEU  15          1HB       LEU  15  -4.570  -2.456   1.718
  118   2HB   LEU  15          2HB       LEU  15  -3.088  -2.746   2.660
  119    HG   LEU  15           HG       LEU  15  -2.980  -0.472   0.737
  120   1HD1  LEU  15          1HD1      LEU  15  -5.114  -0.746   2.731
  121   2HD1  LEU  15          2HD1      LEU  15  -4.094   0.681   3.031
  122   3HD1  LEU  15          3HD1      LEU  15  -4.902   0.480   1.458
  123   1HD2  LEU  15          1HD2      LEU  15  -2.248   0.268   3.360
  124   2HD2  LEU  15          2HD2      LEU  15  -1.724  -1.424   3.188
  125   3HD2  LEU  15          3HD2      LEU  15  -1.154  -0.194   2.035
  126    H    LYS  16           H        LYS  16  -4.144  -4.782  -0.694
  127    HA   LYS  16           HA       LYS  16  -3.423  -6.948   1.099
  128   1HB   LYS  16          1HB       LYS  16  -5.515  -6.440  -0.615
  129   2HB   LYS  16          2HB       LYS  16  -4.557  -7.616  -1.548
  130   1HG   LYS  16          1HG       LYS  16  -4.445  -8.838   0.839
  131   2HG   LYS  16          2HG       LYS  16  -5.965  -7.945   1.083
  132   1HD   LYS  16          1HD       LYS  16  -6.989  -8.973  -0.818
  133   2HD   LYS  16          2HD       LYS  16  -5.432  -9.602  -1.408
  134   1HE   LYS  16          1HE       LYS  16  -5.300 -10.932   0.774
  135   2HE   LYS  16          2HE       LYS  16  -6.997 -10.480   1.043
  136   1HZ   LYS  16          1HZ       LYS  16  -5.866 -12.321  -0.843
  137   2HZ   LYS  16          2HZ       LYS  16  -7.333 -12.339  -0.091
  138   3HZ   LYS  16          3HZ       LYS  16  -7.098 -11.387  -1.417
  139    H    LYS  17           H        LYS  17  -1.417  -5.347  -0.725
  140    HA   LYS  17           HA       LYS  17   0.355  -7.555  -1.152
  141   1HB   LYS  17          1HB       LYS  17  -0.346  -8.219  -3.186
  142   2HB   LYS  17          2HB       LYS  17  -1.462  -6.839  -3.328
  143   1HG   LYS  17          1HG       LYS  17   1.546  -6.688  -3.793
  144   2HG   LYS  17          2HG       LYS  17   0.330  -6.834  -5.084
  145   1HD   LYS  17          1HD       LYS  17  -0.574  -4.724  -3.437
  146   2HD   LYS  17          2HD       LYS  17   1.178  -4.469  -3.613
  147   1HE   LYS  17          1HE       LYS  17   0.763  -3.606  -5.651
  148   2HE   LYS  17          2HE       LYS  17   0.297  -5.240  -6.171
  149   1HZ   LYS  17          1HZ       LYS  17  -1.638  -3.563  -4.800
  150   2HZ   LYS  17          2HZ       LYS  17  -1.333  -3.302  -6.399
  151   3HZ   LYS  17          3HZ       LYS  17  -1.885  -4.772  -5.894
  152    H    TRP  18           H        TRP  18  -0.619  -4.200  -1.790
  153    HA   TRP  18           HA       TRP  18   2.084  -3.334  -2.407
  154   1HB   TRP  18          1HB       TRP  18  -0.381  -2.353  -2.926
  155   2HB   TRP  18          2HB       TRP  18   0.015  -1.408  -1.483
  156    HD1  TRP  18           HD       TRP  18   0.750  -1.712  -5.149
  157    HE1  TRP  18           1HE      TRP  18   2.291   0.162  -5.925
  158    HE3  TRP  18           3HE      TRP  18   2.093   0.172  -0.583
  159    HZ2  TRP  18           2HZ      TRP  18   3.915   2.232  -4.719
  160    HZ3  TRP  18           3HZ      TRP  18   3.636   2.091  -0.437
  161    HH2  TRP  18           HH       TRP  18   4.554   3.130  -2.490
  162    H    LYS  19           H        LYS  19  -0.025  -3.519   0.446
  163    HA   LYS  19           HA       LYS  19   1.419  -1.823   2.170
  164   1HB   LYS  19          1HB       LYS  19   0.060  -2.681   3.814
  165   2HB   LYS  19          2HB       LYS  19  -0.848  -3.242   2.390
  166   1HG   LYS  19          1HG       LYS  19   0.467  -5.394   2.488
  167   2HG   LYS  19          2HG       LYS  19   1.179  -4.830   4.019
  168   1HD   LYS  19          1HD       LYS  19  -0.771  -5.133   5.194
  169   2HD   LYS  19          2HD       LYS  19  -1.797  -4.690   3.809
  170   1HE   LYS  19          1HE       LYS  19  -2.021  -6.843   3.168
  171   2HE   LYS  19          2HE       LYS  19  -0.275  -7.140   3.307
  172   1HZ   LYS  19          1HZ       LYS  19  -2.368  -7.680   5.164
  173   2HZ   LYS  19          2HZ       LYS  19  -0.887  -8.387   4.999
  174   3HZ   LYS  19          3HZ       LYS  19  -1.039  -6.979   5.843
  175    H    MET  20           H        MET  20   1.872  -5.280   1.341
  176    HA   MET  20           HA       MET  20   3.661  -6.202   3.128
  177   1HB   MET  20          1HB       MET  20   3.530  -7.734   1.465
  178   2HB   MET  20          2HB       MET  20   3.313  -6.490   0.211
  179   1HG   MET  20          1HG       MET  20   5.932  -6.116   1.110
  180   2HG   MET  20          2HG       MET  20   5.740  -7.877   1.081
  181   1HE   MET  20          1HE       MET  20   4.077  -5.139  -0.776
  182   2HE   MET  20          2HE       MET  20   5.572  -4.577  -1.561
  183   3HE   MET  20          3HE       MET  20   4.348  -5.459  -2.506
  184    H    ARG  21           H        ARG  21   4.502  -3.939   0.458
  185    HA   ARG  21           HA       ARG  21   7.178  -3.568   1.639
  186   1HB   ARG  21          1HB       ARG  21   5.825  -2.778  -0.948
  187   2HB   ARG  21          2HB       ARG  21   7.350  -2.013  -0.439
  188   1HG   ARG  21          1HG       ARG  21   8.532  -4.064  -0.488
  189   2HG   ARG  21          2HG       ARG  21   7.036  -5.028  -0.465
  190   1HD   ARG  21          1HD       ARG  21   6.610  -3.617  -2.730
  191   2HD   ARG  21          2HD       ARG  21   8.386  -3.635  -2.740
  192    HE   ARG  21           HE       ARG  21   7.780  -6.249  -2.253
  193   1HH1  ARG  21          2HH2      ARG  21   6.674  -3.896  -4.649
  194   2HH1  ARG  21          1HH2      ARG  21   6.380  -5.094  -5.890
  195   1HH2  ARG  21          2HH1      ARG  21   7.391  -7.831  -3.892
  196   2HH2  ARG  21          1HH1      ARG  21   6.788  -7.337  -5.458
  197    H    ARG  22           H        ARG  22   4.122  -1.823   1.037
  198    HA   ARG  22           HA       ARG  22   5.034   0.746   1.851
  199   1HB   ARG  22          1HB       ARG  22   2.940   1.285   1.243
  200   2HB   ARG  22          2HB       ARG  22   2.644  -0.442   0.929
  201   1HG   ARG  22          1HG       ARG  22   1.003  -0.115   2.508
  202   2HG   ARG  22          2HG       ARG  22   2.357  -0.439   3.617
  203   1HD   ARG  22          1HD       ARG  22   0.868   2.058   3.135
  204   2HD   ARG  22          2HD       ARG  22   1.845   1.569   4.536
  205    HE   ARG  22           HE       ARG  22   3.791   2.093   2.771
  206   1HH1  ARG  22          2HH2      ARG  22   0.814   3.852   3.507
  207   2HH1  ARG  22          1HH2      ARG  22   1.480   5.420   3.108
  208   1HH2  ARG  22          2HH1      ARG  22   4.670   4.164   2.244
  209   2HH2  ARG  22          1HH1      ARG  22   3.678   5.597   2.388
  210    H    ASN  23           H        ASN  23   5.426  -1.884   3.602
  211    HA   ASN  23           HA       ASN  23   4.891  -0.452   6.148
  212   1HB   ASN  23          1HB       ASN  23   3.310  -2.524   5.317
  213   2HB   ASN  23          2HB       ASN  23   4.576  -3.398   6.205
  214   1HD2  ASN  23          1HD2      ASN  23   1.621  -1.821   6.495
  215   2HD2  ASN  23          2HD2      ASN  23   1.647  -1.490   8.213
  216    H    GLN  24           H        GLN  24   7.213  -1.266   4.187
  217    HA   GLN  24           HA       GLN  24   9.176  -1.608   6.244
  218   1HB   GLN  24          1HB       GLN  24   9.901  -3.906   5.069
  219   2HB   GLN  24          2HB       GLN  24   8.800  -3.867   6.467
  220   1HG   GLN  24          1HG       GLN  24   6.982  -4.460   5.217
  221   2HG   GLN  24          2HG       GLN  24   7.510  -3.508   3.813
  222   1HE2  GLN  24          1HE2      GLN  24   6.670  -6.503   4.486
  223   2HE2  GLN  24          2HE2      GLN  24   7.836  -7.428   3.565
  224    H    PHE  25           H        PHE  25   9.707  -3.382   3.295
  225    HA   PHE  25           HA       PHE  25  11.913  -2.146   2.382
  226   1HB   PHE  25          1HB       PHE  25  11.098  -3.967   1.143
  227   2HB   PHE  25          2HB       PHE  25   9.520  -3.206   0.883
  228    HD1  PHE  25           1HD      PHE  25   9.706  -0.832  -0.408
  229    HD2  PHE  25           2HD      PHE  25  12.521  -4.067  -0.672
  230    HE1  PHE  25           1HE      PHE  25  10.478   0.019  -2.605
  231    HE2  PHE  25           2HE      PHE  25  13.293  -3.215  -2.870
  232    HZ   PHE  25           HZ       PHE  25  12.272  -1.172  -3.836
  233    H    TRP  26           H        TRP  26   8.570  -0.934   1.873
  234    HA   TRP  26           HA       TRP  26   8.976   1.181   0.185
  235   1HB   TRP  26          1HB       TRP  26   7.022   2.084   1.033
  236   2HB   TRP  26          2HB       TRP  26   6.884   0.384   1.501
  237    HD1  TRP  26           HD       TRP  26   6.634  -0.158   3.992
  238    HE1  TRP  26           1HE      TRP  26   6.497   1.186   6.151
  239    HE3  TRP  26           3HE      TRP  26   8.040   4.420   2.184
  240    HZ2  TRP  26           2HZ      TRP  26   6.940   3.916   7.002
  241    HZ3  TRP  26           3HZ      TRP  26   8.170   6.365   3.697
  242    HH2  TRP  26           HH       TRP  26   7.624   6.131   6.102
  243    H    VAL  27           H        VAL  27   9.724   1.073   3.692
  244    HA   VAL  27           HA       VAL  27  10.388   3.652   4.261
  245    HB   VAL  27           HB       VAL  27  11.993   2.782   5.851
  246   1HG1  VAL  27          1HG1      VAL  27  10.205   1.963   6.952
  247   2HG1  VAL  27          2HG1      VAL  27   9.373   1.636   5.413
  248   3HG1  VAL  27          3HG1      VAL  27  10.447   0.407   6.122
  249   1HG2  VAL  27          1HG2      VAL  27  12.038   0.434   3.937
  250   2HG2  VAL  27          2HG2      VAL  27  13.405   1.373   4.582
  251   3HG2  VAL  27          3HG2      VAL  27  12.526   0.241   5.638
  252    H    LYS  28           H        LYS  28  12.409   1.320   2.423
  253    HA   LYS  28           HA       LYS  28  14.623   3.078   2.075
  254   1HB   LYS  28          1HB       LYS  28  13.597   0.605   0.677
  255   2HB   LYS  28          2HB       LYS  28  14.995   1.497   0.031
  256   1HG   LYS  28          1HG       LYS  28  14.850   0.695   2.952
  257   2HG   LYS  28          2HG       LYS  28  15.459  -0.429   1.714
  258   1HD   LYS  28          1HD       LYS  28  17.294   0.940   1.189
  259   2HD   LYS  28          2HD       LYS  28  16.521   2.398   1.855
  260   1HE   LYS  28          1HE       LYS  28  17.203   1.942   3.979
  261   2HE   LYS  28          2HE       LYS  28  16.903   0.200   3.805
  262   1HZ   LYS  28          1HZ       LYS  28  19.217   1.664   2.749
  263   2HZ   LYS  28          2HZ       LYS  28  19.216   0.658   4.056
  264   3HZ   LYS  28          3HZ       LYS  28  18.934   0.052   2.548
  265    H    VAL  29           H        VAL  29  11.607   2.540   0.250
  266    HA   VAL  29           HA       VAL  29  12.126   3.836  -2.125
  267    HB   VAL  29           HB       VAL  29   9.646   3.986  -0.368
  268   1HG1  VAL  29          1HG1      VAL  29  10.339   5.230  -2.943
  269   2HG1  VAL  29          2HG1      VAL  29   8.892   4.199  -3.043
  270   3HG1  VAL  29          3HG1      VAL  29   8.953   5.536  -1.869
  271   1HG2  VAL  29          1HG2      VAL  29   8.874   2.113  -1.657
  272   2HG2  VAL  29          2HG2      VAL  29  10.218   2.269  -2.813
  273   3HG2  VAL  29          3HG2      VAL  29  10.534   1.717  -1.151
  274    H    GLN  30           H        GLN  30  12.260   5.160   1.059
  275    HA   GLN  30           HA       GLN  30  11.983   7.929   0.054
  276   1HB   GLN  30          1HB       GLN  30  11.451   8.500   2.197
  277   2HB   GLN  30          2HB       GLN  30  11.085   6.764   2.343
  278   1HG   GLN  30          1HG       GLN  30  13.489   6.407   3.050
  279   2HG   GLN  30          2HG       GLN  30  13.675   8.174   3.094
  280   1HE2  GLN  30          1HE2      GLN  30  13.291   9.157   4.998
  281   2HE2  GLN  30          2HE2      GLN  30  12.329   8.500   6.305
  282    H    ARG  31           H        ARG  31  14.318   5.692   1.592
  283    HA   ARG  31           HA       ARG  31  16.552   6.128   2.168
  284   1HB   ARG  31          1HB       ARG  31  16.638   4.992   0.040
  285   2HB   ARG  31          2HB       ARG  31  16.308   6.505  -0.839
  286   1HG   ARG  31          1HG       ARG  31  18.702   6.029  -0.944
  287   2HG   ARG  31          2HG       ARG  31  18.438   7.452   0.092
  288   1HD   ARG  31          1HD       ARG  31  18.338   5.706   2.039
  289   2HD   ARG  31          2HD       ARG  31  19.145   4.621   0.886
  290    HE   ARG  31           HE       ARG  31  20.480   7.168   1.014
  291   1HH1  ARG  31          2HH2      ARG  31  19.998   4.119   2.739
  292   2HH1  ARG  31          1HH2      ARG  31  21.540   4.184   3.563
  293   1HH2  ARG  31          2HH1      ARG  31  22.516   7.253   2.102
  294   2HH2  ARG  31          1HH1      ARG  31  22.976   5.971   3.200
  295    H    GLY  32           H        GLY  32  16.466   8.020   3.468
  296   1HA   GLY  32          1HA       GLY  32  17.838  10.287   2.290
  297   2HA   GLY  32          2HA       GLY  32  16.149  10.644   2.717
  Start of MODEL    9
    1    HA   PRO   1           HA       PRO   1 -17.988   0.038   1.030
    2   1HB   PRO   1          1HB       PRO   1 -20.300   0.052   2.472
    3   2HB   PRO   1          2HB       PRO   1 -19.890  -1.290   1.355
    4   1HG   PRO   1          1HG       PRO   1 -19.419  -1.181   4.348
    5   2HG   PRO   1          2HG       PRO   1 -20.246  -2.477   3.423
    6   1HD   PRO   1          1HD       PRO   1 -17.608  -2.664   4.084
    7   2HD   PRO   1          2HD       PRO   1 -18.183  -3.211   2.479
    8    HA   PRO   2           HA       PRO   2 -16.442   2.667   4.542
    9   1HB   PRO   2          1HB       PRO   2 -14.679   4.158   3.095
   10   2HB   PRO   2          2HB       PRO   2 -14.278   2.502   3.658
   11   1HG   PRO   2          1HG       PRO   2 -15.359   3.308   0.943
   12   2HG   PRO   2          2HG       PRO   2 -13.912   2.304   1.284
   13   1HD   PRO   2          1HD       PRO   2 -16.329   1.173   0.731
   14   2HD   PRO   2          2HD       PRO   2 -15.268   0.474   1.992
   15    H    LEU   3           H        LEU   3 -15.970   5.336   3.927
   16    HA   LEU   3           HA       LEU   3 -18.675   6.220   3.285
   17   1HB   LEU   3          1HB       LEU   3 -16.359   7.215   4.711
   18   2HB   LEU   3          2HB       LEU   3 -16.926   8.432   3.542
   19    HG   LEU   3           HG       LEU   3 -19.316   7.727   4.491
   20   1HD1  LEU   3          1HD1      LEU   3 -18.861   7.456   7.081
   21   2HD1  LEU   3          2HD1      LEU   3 -18.832   6.027   6.021
   22   3HD1  LEU   3          3HD1      LEU   3 -17.306   6.784   6.536
   23   1HD2  LEU   3          1HD2      LEU   3 -17.381   9.785   5.047
   24   2HD2  LEU   3          2HD2      LEU   3 -19.156   9.884   5.121
   25   3HD2  LEU   3          3HD2      LEU   3 -18.232   9.384   6.558
   26    H    SER   4           H        SER   4 -16.201   5.224   1.383
   27    HA   SER   4           HA       SER   4 -16.983   7.120  -0.771
   28   1HB   SER   4          1HB       SER   4 -14.169   6.039  -0.428
   29   2HB   SER   4          2HB       SER   4 -14.729   7.348  -1.497
   30    HG   SER   4           HG       SER   4 -15.468   8.198   0.756
   31    H    GLN   5           H        GLN   5 -14.968   5.659  -2.498
   32    HA   GLN   5           HA       GLN   5 -15.402   2.921  -2.643
   33   1HB   GLN   5          1HB       GLN   5 -17.224   2.886  -4.444
   34   2HB   GLN   5          2HB       GLN   5 -17.766   3.199  -2.778
   35   1HG   GLN   5          1HG       GLN   5 -17.629   5.668  -3.279
   36   2HG   GLN   5          2HG       GLN   5 -17.293   5.252  -4.974
   37   1HE2  GLN   5          1HE2      GLN   5 -18.961   4.677  -6.331
   38   2HE2  GLN   5          2HE2      GLN   5 -20.635   4.578  -5.830
   39    H    GLU   6           H        GLU   6 -15.543   5.915  -4.630
   40    HA   GLU   6           HA       GLU   6 -14.643   5.227  -7.048
   41   1HB   GLU   6          1HB       GLU   6 -12.894   7.239  -6.636
   42   2HB   GLU   6          2HB       GLU   6 -14.644   7.505  -6.816
   43   1HG   GLU   6          1HG       GLU   6 -14.934   7.996  -4.600
   44   2HG   GLU   6          2HG       GLU   6 -13.708   6.823  -4.073
   45    H    THR   7           H        THR   7 -12.153   5.945  -4.538
   46    HA   THR   7           HA       THR   7 -10.287   4.180  -5.967
   47    HB   THR   7           HB       THR   7  -9.186   5.202  -3.538
   48    HG1  THR   7           1HG      THR   7 -10.528   7.158  -5.096
   49   1HG2  THR   7          1HG2      THR   7  -8.633   6.714  -6.001
   50   2HG2  THR   7          2HG2      THR   7  -7.537   5.732  -5.000
   51   3HG2  THR   7          3HG2      THR   7  -8.550   4.952  -6.239
   52    H    PHE   8           H        PHE   8 -10.142   4.518  -2.476
   53    HA   PHE   8           HA       PHE   8  -9.561   2.511  -1.222
   54   1HB   PHE   8          1HB       PHE   8 -12.571   2.542  -1.194
   55   2HB   PHE   8          2HB       PHE   8 -11.441   2.330   0.154
   56    HD1  PHE   8           1HD      PHE   8 -11.819   4.958  -2.512
   57    HD2  PHE   8           2HD      PHE   8 -11.671   4.049   1.683
   58    HE1  PHE   8           1HE      PHE   8 -11.996   7.374  -1.982
   59    HE2  PHE   8           2HE      PHE   8 -11.848   6.465   2.213
   60    HZ   PHE   8           HZ       PHE   8 -12.011   8.128   0.380
   61    H    SER   9           H        SER   9 -12.515   1.870  -3.206
   62    HA   SER   9           HA       SER   9 -12.749  -0.797  -3.128
   63   1HB   SER   9          1HB       SER   9 -13.988   0.769  -4.650
   64   2HB   SER   9          2HB       SER   9 -12.591   0.732  -5.753
   65    HG   SER   9           HG       SER   9 -14.384  -0.834  -6.102
   66    H    ASP  10           H        ASP  10 -10.419   0.794  -5.386
   67    HA   ASP  10           HA       ASP  10  -9.008  -1.788  -5.647
   68   1HB   ASP  10          1HB       ASP  10  -9.232   0.744  -7.198
   69   2HB   ASP  10          2HB       ASP  10  -7.649  -0.064  -7.239
   70    H    LEU  11           H        LEU  11  -8.742   1.395  -4.170
   71    HA   LEU  11           HA       LEU  11  -5.910   1.346  -3.729
   72   1HB   LEU  11          1HB       LEU  11  -8.260   2.851  -2.573
   73   2HB   LEU  11          2HB       LEU  11  -6.642   3.009  -1.850
   74    HG   LEU  11           HG       LEU  11  -7.226   4.717  -3.668
   75   1HD1  LEU  11          1HD1      LEU  11  -4.994   4.821  -4.347
   76   2HD1  LEU  11          2HD1      LEU  11  -4.868   3.790  -2.902
   77   3HD1  LEU  11          3HD1      LEU  11  -4.858   3.055  -4.523
   78   1HD2  LEU  11          1HD2      LEU  11  -6.969   2.189  -5.348
   79   2HD2  LEU  11          2HD2      LEU  11  -8.388   3.256  -5.223
   80   3HD2  LEU  11          3HD2      LEU  11  -6.903   3.839  -6.013
   81    H    TRP  12           H        TRP  12  -8.532   1.059  -1.264
   82    HA   TRP  12           HA       TRP  12  -6.997   0.021   0.787
   83   1HB   TRP  12          1HB       TRP  12  -8.990   0.007   1.773
   84   2HB   TRP  12          2HB       TRP  12  -9.721   0.402   0.211
   85    HD1  TRP  12           HD       TRP  12 -11.576  -1.152  -0.445
   86    HE1  TRP  12           1HE      TRP  12 -12.256  -3.567  -0.012
   87    HE3  TRP  12           3HE      TRP  12  -7.602  -2.604   2.435
   88    HZ2  TRP  12           2HZ      TRP  12 -11.210  -5.860   1.411
   89    HZ3  TRP  12           3HZ      TRP  12  -7.479  -4.908   3.310
   90    HH2  TRP  12           HH       TRP  12  -9.270  -6.544   2.809
   91    H    LYS  13           H        LYS  13  -8.444  -1.697  -1.991
   92    HA   LYS  13           HA       LYS  13  -7.730  -4.320  -1.049
   93   1HB   LYS  13          1HB       LYS  13  -9.500  -3.623  -2.802
   94   2HB   LYS  13          2HB       LYS  13  -8.136  -3.523  -3.942
   95   1HG   LYS  13          1HG       LYS  13  -7.608  -5.833  -3.671
   96   2HG   LYS  13          2HG       LYS  13  -8.625  -5.976  -2.218
   97   1HD   LYS  13          1HD       LYS  13 -10.622  -5.929  -3.454
   98   2HD   LYS  13          2HD       LYS  13  -9.850  -5.148  -4.855
   99   1HE   LYS  13          1HE       LYS  13  -8.861  -7.136  -5.588
  100   2HE   LYS  13          2HE       LYS  13  -8.934  -7.885  -3.978
  101   1HZ   LYS  13          1HZ       LYS  13 -11.019  -8.534  -4.309
  102   2HZ   LYS  13          2HZ       LYS  13 -11.449  -7.212  -5.197
  103   3HZ   LYS  13          3HZ       LYS  13 -10.609  -8.443  -5.904
  104    H    LEU  14           H        LEU  14  -6.168  -1.837  -3.072
  105    HA   LEU  14           HA       LEU  14  -4.068  -3.438  -4.094
  106   1HB   LEU  14          1HB       LEU  14  -4.722  -0.577  -3.816
  107   2HB   LEU  14          2HB       LEU  14  -2.975  -0.917  -3.786
  108    HG   LEU  14           HG       LEU  14  -4.436  -0.654  -6.083
  109   1HD1  LEU  14          1HD1      LEU  14  -2.315  -0.861  -6.815
  110   2HD1  LEU  14          2HD1      LEU  14  -1.844  -1.604  -5.268
  111   3HD1  LEU  14          3HD1      LEU  14  -2.425  -2.625  -6.605
  112   1HD2  LEU  14          1HD2      LEU  14  -5.406  -3.025  -5.086
  113   2HD2  LEU  14          2HD2      LEU  14  -5.365  -2.604  -6.815
  114   3HD2  LEU  14          3HD2      LEU  14  -4.068  -3.598  -6.110
  115    H    LEU  15           H        LEU  15  -4.375  -1.536  -1.067
  116    HA   LEU  15           HA       LEU  15  -1.694  -2.090  -0.187
  117   1HB   LEU  15          1HB       LEU  15  -3.926  -0.522   0.641
  118   2HB   LEU  15          2HB       LEU  15  -3.495  -1.585   2.002
  119    HG   LEU  15           HG       LEU  15  -1.011  -0.823   1.200
  120   1HD1  LEU  15          1HD1      LEU  15  -2.850   0.960  -0.135
  121   2HD1  LEU  15          2HD1      LEU  15  -1.927   1.875   1.081
  122   3HD1  LEU  15          3HD1      LEU  15  -1.071   0.957  -0.180
  123   1HD2  LEU  15          1HD2      LEU  15  -2.953  -0.021   3.253
  124   2HD2  LEU  15          2HD2      LEU  15  -1.211  -0.351   3.406
  125   3HD2  LEU  15          3HD2      LEU  15  -1.771   1.260   2.897
  126    H    LYS  16           H        LYS  16  -4.406  -4.065  -0.562
  127    HA   LYS  16           HA       LYS  16  -4.095  -5.686   1.816
  128   1HB   LYS  16          1HB       LYS  16  -6.047  -5.356  -0.091
  129   2HB   LYS  16          2HB       LYS  16  -5.324  -6.907  -0.582
  130   1HG   LYS  16          1HG       LYS  16  -5.507  -7.623   1.864
  131   2HG   LYS  16          2HG       LYS  16  -6.501  -6.169   2.125
  132   1HD   LYS  16          1HD       LYS  16  -8.309  -7.174   1.224
  133   2HD   LYS  16          2HD       LYS  16  -7.396  -7.605  -0.241
  134   1HE   LYS  16          1HE       LYS  16  -6.650  -9.650   0.683
  135   2HE   LYS  16          2HE       LYS  16  -7.037  -9.144   2.342
  136   1HZ   LYS  16          1HZ       LYS  16  -8.836 -10.023   0.229
  137   2HZ   LYS  16          2HZ       LYS  16  -8.734 -10.533   1.794
  138   3HZ   LYS  16          3HZ       LYS  16  -9.398  -9.064   1.447
  139    H    LYS  17           H        LYS  17  -1.846  -5.107  -0.348
  140    HA   LYS  17           HA       LYS  17  -0.552  -7.664   0.011
  141   1HB   LYS  17          1HB       LYS  17  -1.465  -8.636  -1.825
  142   2HB   LYS  17          2HB       LYS  17  -2.019  -7.082  -2.494
  143   1HG   LYS  17          1HG       LYS  17   0.888  -7.989  -2.488
  144   2HG   LYS  17          2HG       LYS  17  -0.219  -8.215  -3.863
  145   1HD   LYS  17          1HD       LYS  17  -0.543  -5.522  -3.146
  146   2HD   LYS  17          2HD       LYS  17   1.207  -5.809  -2.996
  147   1HE   LYS  17          1HE       LYS  17   0.686  -5.122  -5.284
  148   2HE   LYS  17          2HE       LYS  17   1.205  -6.822  -5.275
  149   1HZ   LYS  17          1HZ       LYS  17  -0.687  -7.338  -6.194
  150   2HZ   LYS  17          2HZ       LYS  17  -1.535  -6.729  -4.917
  151   3HZ   LYS  17          3HZ       LYS  17  -1.170  -5.761  -6.202
  152    H    TRP  18           H        TRP  18  -0.741  -4.504  -1.636
  153    HA   TRP  18           HA       TRP  18   2.089  -4.378  -2.192
  154   1HB   TRP  18          1HB       TRP  18  -0.064  -3.079  -3.130
  155   2HB   TRP  18          2HB       TRP  18   0.432  -1.916  -1.892
  156    HD1  TRP  18           HD       TRP  18   0.956  -2.711  -5.396
  157    HE1  TRP  18           1HE      TRP  18   2.997  -1.541  -6.372
  158    HE3  TRP  18           3HE      TRP  18   3.202  -1.236  -1.039
  159    HZ2  TRP  18           2HZ      TRP  18   5.328  -0.134  -5.391
  160    HZ3  TRP  18           3HZ      TRP  18   5.328   0.015  -1.100
  161    HH2  TRP  18           HH       TRP  18   6.402   0.572  -3.262
  162    H    LYS  19           H        LYS  19  -0.076  -3.107   0.371
  163    HA   LYS  19           HA       LYS  19   1.473  -1.417   1.793
  164   1HB   LYS  19          1HB       LYS  19  -0.753  -2.243   2.500
  165   2HB   LYS  19          2HB       LYS  19  -0.018  -3.792   2.978
  166   1HG   LYS  19          1HG       LYS  19   1.295  -2.746   4.691
  167   2HG   LYS  19          2HG       LYS  19   0.920  -1.117   4.079
  168   1HD   LYS  19          1HD       LYS  19  -0.604  -1.250   5.825
  169   2HD   LYS  19          2HD       LYS  19  -1.590  -1.920   4.503
  170   1HE   LYS  19          1HE       LYS  19  -0.171  -4.129   5.434
  171   2HE   LYS  19          2HE       LYS  19  -0.544  -3.228   6.919
  172   1HZ   LYS  19          1HZ       LYS  19  -2.222  -4.880   6.029
  173   2HZ   LYS  19          2HZ       LYS  19  -2.770  -3.408   6.532
  174   3HZ   LYS  19          3HZ       LYS  19  -2.606  -3.720   4.921
  175    H    MET  20           H        MET  20   1.888  -4.978   1.700
  176    HA   MET  20           HA       MET  20   3.703  -5.534   3.599
  177   1HB   MET  20          1HB       MET  20   3.508  -7.358   2.259
  178   2HB   MET  20          2HB       MET  20   3.353  -6.378   0.782
  179   1HG   MET  20          1HG       MET  20   5.974  -5.929   1.693
  180   2HG   MET  20          2HG       MET  20   5.706  -7.664   1.924
  181   1HE   MET  20          1HE       MET  20   5.570  -4.940  -1.506
  182   2HE   MET  20          2HE       MET  20   4.139  -5.944  -1.842
  183   3HE   MET  20          3HE       MET  20   4.296  -5.113  -0.275
  184    H    ARG  21           H        ARG  21   4.379  -3.622   0.653
  185    HA   ARG  21           HA       ARG  21   7.109  -3.085   1.694
  186   1HB   ARG  21          1HB       ARG  21   5.803  -3.057  -1.012
  187   2HB   ARG  21          2HB       ARG  21   7.185  -1.975  -0.717
  188   1HG   ARG  21          1HG       ARG  21   8.351  -4.081   0.272
  189   2HG   ARG  21          2HG       ARG  21   7.078  -5.000  -0.567
  190   1HD   ARG  21          1HD       ARG  21   8.856  -2.935  -1.922
  191   2HD   ARG  21          2HD       ARG  21   9.202  -4.678  -1.908
  192    HE   ARG  21           HE       ARG  21   6.546  -4.295  -2.836
  193   1HH1  ARG  21          2HH2      ARG  21   9.897  -3.684  -3.785
  194   2HH1  ARG  21          1HH2      ARG  21   9.570  -3.772  -5.502
  195   1HH2  ARG  21          2HH1      ARG  21   6.115  -4.411  -5.103
  196   2HH2  ARG  21          1HH1      ARG  21   7.414  -4.187  -6.253
  197    H    ARG  22           H        ARG  22   4.096  -1.524   0.540
  198    HA   ARG  22           HA       ARG  22   5.043   1.155   0.970
  199   1HB   ARG  22          1HB       ARG  22   3.150   0.458  -0.545
  200   2HB   ARG  22          2HB       ARG  22   2.178   0.139   0.911
  201   1HG   ARG  22          1HG       ARG  22   1.578   2.325   0.770
  202   2HG   ARG  22          2HG       ARG  22   3.202   2.665   1.415
  203   1HD   ARG  22          1HD       ARG  22   2.299   2.634  -1.484
  204   2HD   ARG  22          2HD       ARG  22   2.997   3.986  -0.567
  205    HE   ARG  22           HE       ARG  22   4.782   1.707  -0.715
  206   1HH1  ARG  22          2HH2      ARG  22   3.568   4.557  -2.419
  207   2HH1  ARG  22          1HH2      ARG  22   5.000   4.747  -3.405
  208   1HH2  ARG  22          2HH1      ARG  22   6.674   1.958  -2.019
  209   2HH2  ARG  22          1HH1      ARG  22   6.771   3.265  -3.177
  210    H    ASN  23           H        ASN  23   5.170  -0.995   3.207
  211    HA   ASN  23           HA       ASN  23   4.195   0.837   5.314
  212   1HB   ASN  23          1HB       ASN  23   2.737  -1.400   4.589
  213   2HB   ASN  23          2HB       ASN  23   3.744  -2.008   5.921
  214   1HD2  ASN  23          1HD2      ASN  23   1.631   0.769   5.015
  215   2HD2  ASN  23          2HD2      ASN  23   0.982   1.022   6.621
  216    H    GLN  24           H        GLN  24   6.768  -0.409   3.958
  217    HA   GLN  24           HA       GLN  24   8.343  -0.367   6.355
  218   1HB   GLN  24          1HB       GLN  24   7.591  -3.029   5.139
  219   2HB   GLN  24          2HB       GLN  24   9.164  -2.810   5.943
  220   1HG   GLN  24          1HG       GLN  24   7.525  -1.652   7.779
  221   2HG   GLN  24          2HG       GLN  24   6.415  -2.859   7.094
  222   1HE2  GLN  24          1HE2      GLN  24   6.589  -4.963   7.725
  223   2HE2  GLN  24          2HE2      GLN  24   7.887  -5.601   8.712
  224    H    PHE  25           H        PHE  25   9.274  -2.679   3.923
  225    HA   PHE  25           HA       PHE  25  11.659  -1.691   3.192
  226   1HB   PHE  25          1HB       PHE  25  10.924  -3.689   2.179
  227   2HB   PHE  25          2HB       PHE  25   9.487  -2.915   1.488
  228    HD1  PHE  25           1HD      PHE  25  10.109  -0.830  -0.131
  229    HD2  PHE  25           2HD      PHE  25  12.632  -4.202   0.714
  230    HE1  PHE  25           1HE      PHE  25  11.336  -0.444  -2.251
  231    HE2  PHE  25           2HE      PHE  25  13.859  -3.816  -1.406
  232    HZ   PHE  25           HZ       PHE  25  13.211  -1.937  -2.889
  233    H    TRP  26           H        TRP  26   8.537  -0.546   1.813
  234    HA   TRP  26           HA       TRP  26   9.376   1.242  -0.076
  235   1HB   TRP  26          1HB       TRP  26   7.338   2.316   0.190
  236   2HB   TRP  26          2HB       TRP  26   7.024   0.711   0.866
  237    HD1  TRP  26           HD       TRP  26   6.214   0.573   3.288
  238    HE1  TRP  26           1HE      TRP  26   5.700   2.237   5.146
  239    HE3  TRP  26           3HE      TRP  26   8.232   4.780   1.184
  240    HZ2  TRP  26           2HZ      TRP  26   6.109   5.055   5.667
  241    HZ3  TRP  26           3HZ      TRP  26   8.151   6.932   2.389
  242    HH2  TRP  26           HH       TRP  26   7.096   7.086   4.625
  243    H    VAL  27           H        VAL  27   9.383   1.742   3.476
  244    HA   VAL  27           HA       VAL  27  10.039   4.377   3.721
  245    HB   VAL  27           HB       VAL  27  11.230   3.786   5.744
  246   1HG1  VAL  27          1HG1      VAL  27   9.549   1.522   6.097
  247   2HG1  VAL  27          2HG1      VAL  27   9.204   3.209   6.548
  248   3HG1  VAL  27          3HG1      VAL  27   8.708   2.595   4.953
  249   1HG2  VAL  27          1HG2      VAL  27  11.626   1.207   6.064
  250   2HG2  VAL  27          2HG2      VAL  27  11.595   1.163   4.285
  251   3HG2  VAL  27          3HG2      VAL  27  12.806   2.158   5.130
  252    H    LYS  28           H        LYS  28  12.279   1.726   2.791
  253    HA   LYS  28           HA       LYS  28  14.604   3.363   2.630
  254   1HB   LYS  28          1HB       LYS  28  13.775   0.709   1.430
  255   2HB   LYS  28          2HB       LYS  28  15.349   1.450   1.052
  256   1HG   LYS  28          1HG       LYS  28  16.148   0.597   2.981
  257   2HG   LYS  28          2HG       LYS  28  15.035   1.669   3.863
  258   1HD   LYS  28          1HD       LYS  28  13.241  -0.159   3.378
  259   2HD   LYS  28          2HD       LYS  28  14.630  -1.214   3.023
  260   1HE   LYS  28          1HE       LYS  28  15.138   0.255   5.459
  261   2HE   LYS  28          2HE       LYS  28  13.551  -0.538   5.572
  262   1HZ   LYS  28          1HZ       LYS  28  14.784  -2.545   4.715
  263   2HZ   LYS  28          2HZ       LYS  28  16.168  -1.751   5.135
  264   3HZ   LYS  28          3HZ       LYS  28  15.039  -2.105   6.284
  265    H    VAL  29           H        VAL  29  12.002   2.569   0.327
  266    HA   VAL  29           HA       VAL  29  13.072   3.409  -2.070
  267    HB   VAL  29           HB       VAL  29  10.296   3.915  -0.931
  268   1HG1  VAL  29          1HG1      VAL  29  11.278   3.952  -3.818
  269   2HG1  VAL  29          2HG1      VAL  29   9.597   4.172  -3.275
  270   3HG1  VAL  29          3HG1      VAL  29  10.831   5.390  -2.870
  271   1HG2  VAL  29          1HG2      VAL  29  11.198   1.527  -1.110
  272   2HG2  VAL  29          2HG2      VAL  29   9.701   1.857  -2.015
  273   3HG2  VAL  29          3HG2      VAL  29  11.260   1.780  -2.870
  274    H    GLN  30           H        GLN  30  12.630   5.273   0.798
  275    HA   GLN  30           HA       GLN  30  12.724   7.825  -0.702
  276   1HB   GLN  30          1HB       GLN  30  11.791   8.784   1.146
  277   2HB   GLN  30          2HB       GLN  30  11.289   7.112   1.493
  278   1HG   GLN  30          1HG       GLN  30  13.470   6.825   2.757
  279   2HG   GLN  30          2HG       GLN  30  13.734   8.572   2.564
  280   1HE2  GLN  30          1HE2      GLN  30  11.143   6.277   3.606
  281   2HE2  GLN  30          2HE2      GLN  30  10.603   7.239   4.966
  282    H    ARG  31           H        ARG  31  14.551   5.839   1.649
  283    HA   ARG  31           HA       ARG  31  16.631   6.330   2.626
  284   1HB   ARG  31          1HB       ARG  31  17.138   4.832   0.825
  285   2HB   ARG  31          2HB       ARG  31  17.015   6.135  -0.381
  286   1HG   ARG  31          1HG       ARG  31  19.137   6.834   0.006
  287   2HG   ARG  31          2HG       ARG  31  18.931   6.739   1.772
  288   1HD   ARG  31          1HD       ARG  31  18.902   4.065   0.822
  289   2HD   ARG  31          2HD       ARG  31  20.241   4.874  -0.020
  290    HE   ARG  31           HE       ARG  31  20.447   5.626   2.668
  291   1HH1  ARG  31          2HH2      ARG  31  20.499   2.653   0.755
  292   2HH1  ARG  31          1HH2      ARG  31  21.566   1.805   1.852
  293   1HH2  ARG  31          2HH1      ARG  31  21.855   4.505   4.117
  294   2HH2  ARG  31          1HH1      ARG  31  22.339   2.860   3.768
  295    H    GLY  32           H        GLY  32  17.601   7.981  -0.319
  296   1HA   GLY  32          1HA       GLY  32  17.915  10.474   1.283
  297   2HA   GLY  32          2HA       GLY  32  18.941   9.990  -0.087
  Start of MODEL   10
    1    HA   PRO   1           HA       PRO   1 -21.264   9.341  -1.671
    2   1HB   PRO   1          1HB       PRO   1 -22.672   9.724   0.630
    3   2HB   PRO   1          2HB       PRO   1 -22.537  11.004  -0.620
    4   1HG   PRO   1          1HG       PRO   1 -24.794   9.011  -0.267
    5   2HG   PRO   1          2HG       PRO   1 -24.929  10.795  -0.403
    6   1HD   PRO   1          1HD       PRO   1 -25.256   9.176  -2.571
    7   2HD   PRO   1          2HD       PRO   1 -24.375  10.726  -2.721
    8    HA   PRO   2           HA       PRO   2 -22.256   4.873  -0.908
    9   1HB   PRO   2          1HB       PRO   2 -19.948   3.848  -1.930
   10   2HB   PRO   2          2HB       PRO   2 -21.301   4.370  -2.987
   11   1HG   PRO   2          1HG       PRO   2 -18.847   5.975  -2.214
   12   2HG   PRO   2          2HG       PRO   2 -19.472   5.671  -3.868
   13   1HD   PRO   2          1HD       PRO   2 -20.088   7.954  -2.512
   14   2HD   PRO   2          2HD       PRO   2 -21.326   7.126  -3.505
   15    H    LEU   3           H        LEU   3 -20.278   7.303   0.243
   16    HA   LEU   3           HA       LEU   3 -18.790   7.495   1.986
   17   1HB   LEU   3          1HB       LEU   3 -21.154   6.431   2.858
   18   2HB   LEU   3          2HB       LEU   3 -19.996   5.215   3.449
   19    HG   LEU   3           HG       LEU   3 -19.160   8.039   3.839
   20   1HD1  LEU   3          1HD1      LEU   3 -21.285   6.924   5.684
   21   2HD1  LEU   3          2HD1      LEU   3 -20.712   8.601   5.521
   22   3HD1  LEU   3          3HD1      LEU   3 -21.738   7.883   4.255
   23   1HD2  LEU   3          1HD2      LEU   3 -17.855   6.971   5.333
   24   2HD2  LEU   3          2HD2      LEU   3 -19.293   6.387   6.206
   25   3HD2  LEU   3          3HD2      LEU   3 -18.618   5.434   4.863
   26    H    SER   4           H        SER   4 -18.181   5.479  -0.203
   27    HA   SER   4           HA       SER   4 -15.711   4.634   0.408
   28   1HB   SER   4          1HB       SER   4 -16.176   2.196   1.241
   29   2HB   SER   4          2HB       SER   4 -16.177   3.530   2.419
   30    HG   SER   4           HG       SER   4 -18.584   3.028   1.150
   31    H    GLN   5           H        GLN   5 -15.132   4.230  -1.639
   32    HA   GLN   5           HA       GLN   5 -15.818   1.948  -3.066
   33   1HB   GLN   5          1HB       GLN   5 -18.054   2.491  -3.401
   34   2HB   GLN   5          2HB       GLN   5 -17.729   4.240  -3.465
   35   1HG   GLN   5          1HG       GLN   5 -16.701   4.031  -5.652
   36   2HG   GLN   5          2HG       GLN   5 -16.788   2.258  -5.573
   37   1HE2  GLN   5          1HE2      GLN   5 -17.909   2.758  -7.738
   38   2HE2  GLN   5          2HE2      GLN   5 -19.645   2.981  -7.680
   39    H    GLU   6           H        GLU   6 -15.568   5.497  -3.702
   40    HA   GLU   6           HA       GLU   6 -14.239   5.594  -6.050
   41   1HB   GLU   6          1HB       GLU   6 -14.615   7.324  -3.929
   42   2HB   GLU   6          2HB       GLU   6 -12.842   7.180  -3.994
   43   1HG   GLU   6          1HG       GLU   6 -13.504   7.383  -6.666
   44   2HG   GLU   6          2HG       GLU   6 -14.715   8.438  -5.906
   45    H    THR   7           H        THR   7 -12.428   5.309  -2.933
   46    HA   THR   7           HA       THR   7 -10.115   4.276  -4.421
   47    HB   THR   7           HB       THR   7  -9.827   4.215  -1.545
   48    HG1  THR   7           1HG      THR   7 -10.597   6.111  -0.998
   49   1HG2  THR   7          1HG2      THR   7  -8.019   4.491  -3.217
   50   2HG2  THR   7          2HG2      THR   7  -8.716   6.053  -3.709
   51   3HG2  THR   7          3HG2      THR   7  -8.049   5.853  -2.071
   52    H    PHE   8           H        PHE   8 -10.816   3.127  -1.183
   53    HA   PHE   8           HA       PHE   8 -10.381   0.789  -0.715
   54   1HB   PHE   8          1HB       PHE   8 -13.277   0.827  -1.554
   55   2HB   PHE   8          2HB       PHE   8 -12.530   0.028  -0.160
   56    HD1  PHE   8           1HD      PHE   8 -12.503   3.560  -1.460
   57    HD2  PHE   8           2HD      PHE   8 -13.316   0.914   1.825
   58    HE1  PHE   8           1HE      PHE   8 -13.080   5.506  -0.035
   59    HE2  PHE   8           2HE      PHE   8 -13.893   2.860   3.250
   60    HZ   PHE   8           HZ       PHE   8 -13.775   5.156   2.320
   61    H    SER   9           H        SER   9 -12.648   0.974  -3.524
   62    HA   SER   9           HA       SER   9 -12.515  -1.490  -4.574
   63   1HB   SER   9          1HB       SER   9 -13.580   0.533  -5.618
   64   2HB   SER   9          2HB       SER   9 -11.976   0.999  -6.236
   65    HG   SER   9           HG       SER   9 -12.157  -1.445  -6.931
   66    H    ASP  10           H        ASP  10 -10.003   0.979  -5.386
   67    HA   ASP  10           HA       ASP  10  -8.152  -1.284  -5.950
   68   1HB   ASP  10          1HB       ASP  10  -8.585   1.430  -7.117
   69   2HB   ASP  10          2HB       ASP  10  -6.908   0.852  -7.018
   70    H    LEU  11           H        LEU  11  -8.944   1.110  -3.677
   71    HA   LEU  11           HA       LEU  11  -6.279   1.838  -2.848
   72   1HB   LEU  11          1HB       LEU  11  -8.569   3.028  -2.438
   73   2HB   LEU  11          2HB       LEU  11  -8.721   1.899  -1.071
   74    HG   LEU  11           HG       LEU  11  -7.101   4.302  -1.294
   75   1HD1  LEU  11          1HD1      LEU  11  -6.935   3.986   1.124
   76   2HD1  LEU  11          2HD1      LEU  11  -8.591   3.602   0.598
   77   3HD1  LEU  11          3HD1      LEU  11  -7.448   2.289   0.968
   78   1HD2  LEU  11          1HD2      LEU  11  -5.027   3.263  -0.275
   79   2HD2  LEU  11          2HD2      LEU  11  -5.673   1.670  -0.738
   80   3HD2  LEU  11          3HD2      LEU  11  -5.277   2.869  -1.993
   81    H    TRP  12           H        TRP  12  -8.731   0.149  -0.837
   82    HA   TRP  12           HA       TRP  12  -6.930  -1.075   0.887
   83   1HB   TRP  12          1HB       TRP  12  -8.736  -2.239   1.680
   84   2HB   TRP  12          2HB       TRP  12  -9.558  -0.944   0.800
   85    HD1  TRP  12           HD       TRP  12 -11.422  -1.712  -0.698
   86    HE1  TRP  12           1HE      TRP  12 -12.130  -3.859  -1.872
   87    HE3  TRP  12           3HE      TRP  12  -7.424  -4.660   0.534
   88    HZ2  TRP  12           2HZ      TRP  12 -11.094  -6.537  -2.237
   89    HZ3  TRP  12           3HZ      TRP  12  -7.320  -7.000  -0.244
   90    HH2  TRP  12           HH       TRP  12  -9.142  -7.951  -1.626
   91    H    LYS  13           H        LYS  13  -8.194  -2.263  -2.253
   92    HA   LYS  13           HA       LYS  13  -7.023  -4.829  -2.169
   93   1HB   LYS  13          1HB       LYS  13  -8.611  -3.426  -3.913
   94   2HB   LYS  13          2HB       LYS  13  -7.072  -3.481  -4.804
   95   1HG   LYS  13          1HG       LYS  13  -7.950  -6.011  -3.471
   96   2HG   LYS  13          2HG       LYS  13  -8.882  -5.489  -4.895
   97   1HD   LYS  13          1HD       LYS  13  -7.094  -5.752  -6.334
   98   2HD   LYS  13          2HD       LYS  13  -5.891  -5.375  -5.078
   99   1HE   LYS  13          1HE       LYS  13  -5.563  -7.661  -5.294
  100   2HE   LYS  13          2HE       LYS  13  -6.785  -7.631  -4.004
  101   1HZ   LYS  13          1HZ       LYS  13  -8.334  -8.433  -5.369
  102   2HZ   LYS  13          2HZ       LYS  13  -7.746  -7.690  -6.719
  103   3HZ   LYS  13          3HZ       LYS  13  -7.033  -9.068  -6.159
  104    H    LEU  14           H        LEU  14  -5.700  -1.641  -3.032
  105    HA   LEU  14           HA       LEU  14  -3.255  -2.644  -4.154
  106   1HB   LEU  14          1HB       LEU  14  -4.372  -0.017  -3.272
  107   2HB   LEU  14          2HB       LEU  14  -2.599  -0.152  -3.363
  108    HG   LEU  14           HG       LEU  14  -4.270   0.393  -5.505
  109   1HD1  LEU  14          1HD1      LEU  14  -1.630   0.383  -5.052
  110   2HD1  LEU  14          2HD1      LEU  14  -1.721  -1.115  -6.011
  111   3HD1  LEU  14          3HD1      LEU  14  -2.289   0.423  -6.705
  112   1HD2  LEU  14          1HD2      LEU  14  -4.721  -1.502  -6.741
  113   2HD2  LEU  14          2HD2      LEU  14  -3.325  -2.391  -6.085
  114   3HD2  LEU  14          3HD2      LEU  14  -4.807  -2.217  -5.114
  115    H    LEU  15           H        LEU  15  -4.336  -1.719  -0.886
  116    HA   LEU  15           HA       LEU  15  -1.759  -1.762   0.335
  117   1HB   LEU  15          1HB       LEU  15  -4.608  -1.746   1.183
  118   2HB   LEU  15          2HB       LEU  15  -3.457  -2.430   2.356
  119    HG   LEU  15           HG       LEU  15  -2.217  -0.428   2.494
  120   1HD1  LEU  15          1HD1      LEU  15  -1.704   0.614   0.559
  121   2HD1  LEU  15          2HD1      LEU  15  -3.063  -0.173  -0.277
  122   3HD1  LEU  15          3HD1      LEU  15  -3.321   1.357   0.595
  123   1HD2  LEU  15          1HD2      LEU  15  -4.531   1.230   2.067
  124   2HD2  LEU  15          2HD2      LEU  15  -5.067  -0.327   2.744
  125   3HD2  LEU  15          3HD2      LEU  15  -3.853   0.648   3.607
  126    H    LYS  16           H        LYS  16  -3.657  -4.242  -1.038
  127    HA   LYS  16           HA       LYS  16  -2.922  -6.368   0.779
  128   1HB   LYS  16          1HB       LYS  16  -4.729  -6.016  -1.321
  129   2HB   LYS  16          2HB       LYS  16  -3.536  -7.167  -1.970
  130   1HG   LYS  16          1HG       LYS  16  -3.790  -8.362   0.344
  131   2HG   LYS  16          2HG       LYS  16  -5.298  -7.428   0.477
  132   1HD   LYS  16          1HD       LYS  16  -5.757  -8.326  -1.950
  133   2HD   LYS  16          2HD       LYS  16  -4.543  -9.558  -1.530
  134   1HE   LYS  16          1HE       LYS  16  -5.830 -10.340   0.321
  135   2HE   LYS  16          2HE       LYS  16  -6.896  -8.919   0.277
  136   1HZ   LYS  16          1HZ       LYS  16  -6.941 -11.297  -1.329
  137   2HZ   LYS  16          2HZ       LYS  16  -8.179 -10.327  -0.832
  138   3HZ   LYS  16          3HZ       LYS  16  -7.260  -9.890  -2.130
  139    H    LYS  17           H        LYS  17  -0.900  -4.471  -0.769
  140    HA   LYS  17           HA       LYS  17   1.163  -6.477  -0.964
  141   1HB   LYS  17          1HB       LYS  17   0.734  -7.075  -3.107
  142   2HB   LYS  17          2HB       LYS  17  -0.325  -5.672  -3.386
  143   1HG   LYS  17          1HG       LYS  17   2.714  -5.511  -3.247
  144   2HG   LYS  17          2HG       LYS  17   1.794  -5.654  -4.764
  145   1HD   LYS  17          1HD       LYS  17   0.514  -3.585  -3.361
  146   2HD   LYS  17          2HD       LYS  17   2.249  -3.305  -3.080
  147   1HE   LYS  17          1HE       LYS  17   1.091  -3.874  -5.831
  148   2HE   LYS  17          2HE       LYS  17   1.267  -2.229  -5.183
  149   1HZ   LYS  17          1HZ       LYS  17   3.228  -3.960  -6.248
  150   2HZ   LYS  17          2HZ       LYS  17   3.289  -2.333  -5.981
  151   3HZ   LYS  17          3HZ       LYS  17   3.664  -3.383  -4.766
  152    H    TRP  18           H        TRP  18  -0.020  -3.190  -1.694
  153    HA   TRP  18           HA       TRP  18   2.627  -2.032  -1.780
  154   1HB   TRP  18          1HB       TRP  18   0.197  -1.255  -2.642
  155   2HB   TRP  18          2HB       TRP  18   0.234  -0.396  -1.096
  156    HD1  TRP  18           HD       TRP  18   1.236  -0.056  -4.602
  157    HE1  TRP  18           1HE      TRP  18   2.783   1.934  -4.971
  158    HE3  TRP  18           3HE      TRP  18   2.444   0.943   0.271
  159    HZ2  TRP  18           2HZ      TRP  18   4.358   3.746  -3.356
  160    HZ3  TRP  18           3HZ      TRP  18   3.969   2.806   0.815
  161    HH2  TRP  18           HH       TRP  18   4.932   4.213  -0.982
  162    H    LYS  19           H        LYS  19   0.100  -2.512   0.689
  163    HA   LYS  19           HA       LYS  19   1.307  -0.863   2.687
  164   1HB   LYS  19          1HB       LYS  19  -1.077  -2.133   2.423
  165   2HB   LYS  19          2HB       LYS  19  -0.248  -3.261   3.522
  166   1HG   LYS  19          1HG       LYS  19   0.289  -1.389   5.045
  167   2HG   LYS  19          2HG       LYS  19  -0.525  -0.253   3.943
  168   1HD   LYS  19          1HD       LYS  19  -2.659  -1.181   4.372
  169   2HD   LYS  19          2HD       LYS  19  -1.970  -2.680   5.040
  170   1HE   LYS  19          1HE       LYS  19  -1.131  -0.211   6.443
  171   2HE   LYS  19          2HE       LYS  19  -2.871  -0.557   6.546
  172   1HZ   LYS  19          1HZ       LYS  19  -1.016  -1.630   8.106
  173   2HZ   LYS  19          2HZ       LYS  19  -2.495  -2.301   7.818
  174   3HZ   LYS  19          3HZ       LYS  19  -1.177  -2.813   6.968
  175    H    MET  20           H        MET  20   1.744  -4.240   1.668
  176    HA   MET  20           HA       MET  20   3.093  -5.296   3.853
  177   1HB   MET  20          1HB       MET  20   2.550  -6.676   1.963
  178   2HB   MET  20          2HB       MET  20   3.530  -5.670   0.869
  179   1HG   MET  20          1HG       MET  20   5.285  -6.383   2.930
  180   2HG   MET  20          2HG       MET  20   4.341  -7.854   2.637
  181   1HE   MET  20          1HE       MET  20   6.621  -5.094   1.125
  182   2HE   MET  20          2HE       MET  20   6.854  -5.632  -0.556
  183   3HE   MET  20          3HE       MET  20   5.258  -5.053  -0.020
  184    H    ARG  21           H        ARG  21   4.599  -3.623   1.027
  185    HA   ARG  21           HA       ARG  21   7.174  -3.487   2.322
  186   1HB   ARG  21          1HB       ARG  21   7.597  -1.854   0.371
  187   2HB   ARG  21          2HB       ARG  21   7.184  -3.535  -0.047
  188   1HG   ARG  21          1HG       ARG  21   4.710  -2.191   0.237
  189   2HG   ARG  21          2HG       ARG  21   5.756  -1.081  -0.681
  190   1HD   ARG  21          1HD       ARG  21   5.795  -3.982  -1.435
  191   2HD   ARG  21          2HD       ARG  21   4.358  -3.036  -1.877
  192    HE   ARG  21           HE       ARG  21   7.060  -2.782  -2.978
  193   1HH1  ARG  21          2HH2      ARG  21   3.885  -1.299  -2.503
  194   2HH1  ARG  21          1HH2      ARG  21   4.041  -0.206  -3.860
  195   1HH2  ARG  21          2HH1      ARG  21   7.265  -1.337  -4.770
  196   2HH2  ARG  21          1HH1      ARG  21   5.968  -0.227  -5.152
  197    H    ARG  22           H        ARG  22   4.421  -1.253   1.843
  198    HA   ARG  22           HA       ARG  22   5.625   1.104   2.785
  199   1HB   ARG  22          1HB       ARG  22   3.379   0.911   1.701
  200   2HB   ARG  22          2HB       ARG  22   2.753   0.185   3.201
  201   1HG   ARG  22          1HG       ARG  22   4.172   2.545   3.947
  202   2HG   ARG  22          2HG       ARG  22   3.135   2.978   2.566
  203   1HD   ARG  22          1HD       ARG  22   1.997   3.214   4.797
  204   2HD   ARG  22          2HD       ARG  22   1.172   2.098   3.687
  205    HE   ARG  22           HE       ARG  22   2.759   0.397   5.074
  206   1HH1  ARG  22          2HH2      ARG  22   0.622   3.026   6.087
  207   2HH1  ARG  22          1HH2      ARG  22   0.227   2.294   7.627
  208   1HH2  ARG  22          2HH1      ARG  22   2.237  -0.569   7.108
  209   2HH2  ARG  22          1HH1      ARG  22   1.148   0.245   8.208
  210    H    ASN  23           H        ASN  23   5.845  -1.667   4.365
  211    HA   ASN  23           HA       ASN  23   5.806  -0.323   7.003
  212   1HB   ASN  23          1HB       ASN  23   3.742  -1.954   6.300
  213   2HB   ASN  23          2HB       ASN  23   4.879  -3.145   6.968
  214   1HD2  ASN  23          1HD2      ASN  23   4.099   0.281   7.808
  215   2HD2  ASN  23          2HD2      ASN  23   3.740  -0.037   9.492
  216    H    GLN  24           H        GLN  24   7.664  -1.561   4.747
  217    HA   GLN  24           HA       GLN  24   9.723  -2.380   6.575
  218   1HB   GLN  24          1HB       GLN  24   8.175  -4.481   5.049
  219   2HB   GLN  24          2HB       GLN  24   9.895  -4.720   5.442
  220   1HG   GLN  24          1HG       GLN  24   8.988  -3.868   7.852
  221   2HG   GLN  24          2HG       GLN  24   7.511  -4.642   7.237
  222   1HE2  GLN  24          1HE2      GLN  24  10.648  -5.121   8.611
  223   2HE2  GLN  24          2HE2      GLN  24  10.670  -6.871   8.546
  224    H    PHE  25           H        PHE  25   9.477  -4.023   3.492
  225    HA   PHE  25           HA       PHE  25  11.826  -3.224   2.394
  226   1HB   PHE  25          1HB       PHE  25  10.569  -4.801   1.203
  227   2HB   PHE  25          2HB       PHE  25   9.130  -3.768   1.160
  228    HD1  PHE  25           1HD      PHE  25   9.620  -1.384  -0.064
  229    HD2  PHE  25           2HD      PHE  25  11.688  -5.077  -0.796
  230    HE1  PHE  25           1HE      PHE  25  10.267  -0.576  -2.318
  231    HE2  PHE  25           2HE      PHE  25  12.335  -4.269  -3.049
  232    HZ   PHE  25           HZ       PHE  25  11.624  -2.018  -3.810
  233    H    TRP  26           H        TRP  26   8.804  -1.327   2.489
  234    HA   TRP  26           HA       TRP  26   9.389   0.727   0.734
  235   1HB   TRP  26          1HB       TRP  26   7.777   1.950   1.848
  236   2HB   TRP  26          2HB       TRP  26   7.368   0.293   2.313
  237    HD1  TRP  26           HD       TRP  26   7.382  -0.297   4.811
  238    HE1  TRP  26           1HE      TRP  26   7.784   0.973   6.982
  239    HE3  TRP  26           3HE      TRP  26   9.327   4.022   2.871
  240    HZ2  TRP  26           2HZ      TRP  26   8.823   3.550   7.790
  241    HZ3  TRP  26           3HZ      TRP  26  10.010   5.859   4.370
  242    HH2  TRP  26           HH       TRP  26   9.765   5.640   6.825
  243    H    VAL  27           H        VAL  27  10.556   0.292   4.096
  244    HA   VAL  27           HA       VAL  27  11.785   2.656   4.647
  245    HB   VAL  27           HB       VAL  27  13.404   1.400   5.944
  246   1HG1  VAL  27          1HG1      VAL  27  10.571   0.822   5.882
  247   2HG1  VAL  27          2HG1      VAL  27  11.461  -0.638   6.376
  248   3HG1  VAL  27          3HG1      VAL  27  11.667   0.880   7.283
  249   1HG2  VAL  27          1HG2      VAL  27  12.726  -0.760   3.941
  250   2HG2  VAL  27          2HG2      VAL  27  14.323  -0.196   4.488
  251   3HG2  VAL  27          3HG2      VAL  27  13.319  -1.199   5.561
  252    H    LYS  28           H        LYS  28  12.985   0.134   2.398
  253    HA   LYS  28           HA       LYS  28  15.443   1.480   1.801
  254   1HB   LYS  28          1HB       LYS  28  13.821  -0.749   0.590
  255   2HB   LYS  28          2HB       LYS  28  15.172  -0.048  -0.333
  256   1HG   LYS  28          1HG       LYS  28  15.646  -0.742   2.551
  257   2HG   LYS  28          2HG       LYS  28  15.548  -2.076   1.376
  258   1HD   LYS  28          1HD       LYS  28  17.276  -0.963  -0.017
  259   2HD   LYS  28          2HD       LYS  28  17.385   0.350   1.180
  260   1HE   LYS  28          1HE       LYS  28  18.282  -1.081   2.840
  261   2HE   LYS  28          2HE       LYS  28  17.769  -2.547   1.976
  262   1HZ   LYS  28          1HZ       LYS  28  20.071  -2.246   1.692
  263   2HZ   LYS  28          2HZ       LYS  28  19.352  -1.927   0.243
  264   3HZ   LYS  28          3HZ       LYS  28  19.894  -0.686   1.185
  265    H    VAL  29           H        VAL  29  12.156   1.540   0.416
  266    HA   VAL  29           HA       VAL  29  12.548   2.825  -1.983
  267    HB   VAL  29           HB       VAL  29  10.422   3.327   0.134
  268   1HG1  VAL  29          1HG1      VAL  29   9.234   3.885  -2.251
  269   2HG1  VAL  29          2HG1      VAL  29   9.978   5.127  -1.215
  270   3HG1  VAL  29          3HG1      VAL  29  10.887   4.453  -2.589
  271   1HG2  VAL  29          1HG2      VAL  29  10.760   0.987  -0.855
  272   2HG2  VAL  29          2HG2      VAL  29   9.141   1.695  -1.068
  273   3HG2  VAL  29          3HG2      VAL  29  10.294   1.687  -2.424
  274    H    GLN  30           H        GLN  30  13.359   3.984   1.171
  275    HA   GLN  30           HA       GLN  30  13.463   6.792   0.247
  276   1HB   GLN  30          1HB       GLN  30  13.347   7.367   2.450
  277   2HB   GLN  30          2HB       GLN  30  12.698   5.719   2.629
  278   1HG   GLN  30          1HG       GLN  30  15.072   4.917   2.977
  279   2HG   GLN  30          2HG       GLN  30  15.580   6.620   3.010
  280   1HE2  GLN  30          1HE2      GLN  30  16.352   6.137   5.214
  281   2HE2  GLN  30          2HE2      GLN  30  15.212   6.175   6.542
  282    H    ARG  31           H        ARG  31  15.540   4.114   1.405
  283    HA   ARG  31           HA       ARG  31  17.873   4.115   1.654
  284   1HB   ARG  31          1HB       ARG  31  17.457   3.075  -0.482
  285   2HB   ARG  31          2HB       ARG  31  17.282   4.657  -1.278
  286   1HG   ARG  31          1HG       ARG  31  19.631   5.187  -0.809
  287   2HG   ARG  31          2HG       ARG  31  19.821   3.658   0.081
  288   1HD   ARG  31          1HD       ARG  31  20.398   2.690  -1.869
  289   2HD   ARG  31          2HD       ARG  31  18.720   2.924  -2.404
  290    HE   ARG  31           HE       ARG  31  19.962   5.358  -2.886
  291   1HH1  ARG  31          2HH2      ARG  31  20.487   1.984  -3.803
  292   2HH1  ARG  31          1HH2      ARG  31  21.210   2.374  -5.348
  293   1HH2  ARG  31          2HH1      ARG  31  20.917   5.873  -4.926
  294   2HH2  ARG  31          1HH1      ARG  31  21.455   4.591  -5.988
  295    H    GLY  32           H        GLY  32  18.305   5.939   2.988
  296   1HA   GLY  32          1HA       GLY  32  20.145   7.783   2.033
  297   2HA   GLY  32          2HA       GLY  32  18.566   8.590   1.894
  Start of MODEL   11
    1    HA   PRO   1           HA       PRO   1 -11.884   9.674   4.155
    2   1HB   PRO   1          1HB       PRO   1 -12.918  12.181   3.898
    3   2HB   PRO   1          2HB       PRO   1 -12.207  11.605   5.441
    4   1HG   PRO   1          1HG       PRO   1 -10.839  13.235   3.281
    5   2HG   PRO   1          2HG       PRO   1 -10.922  13.604   5.035
    6   1HD   PRO   1          1HD       PRO   1  -8.772  12.327   3.951
    7   2HD   PRO   1          2HD       PRO   1  -9.413  11.830   5.546
    8    HA   PRO   2           HA       PRO   2 -11.313   9.924  -0.408
    9   1HB   PRO   2          1HB       PRO   2 -12.101   7.373  -0.950
   10   2HB   PRO   2          2HB       PRO   2 -10.471   7.741  -0.298
   11   1HG   PRO   2          1HG       PRO   2 -12.931   6.904   1.265
   12   2HG   PRO   2          2HG       PRO   2 -11.297   6.166   1.330
   13   1HD   PRO   2          1HD       PRO   2 -12.082   8.041   3.146
   14   2HD   PRO   2          2HD       PRO   2 -10.417   8.055   2.489
   15    H    LEU   3           H        LEU   3 -13.217   8.540  -1.933
   16    HA   LEU   3           HA       LEU   3 -15.609  10.126  -1.311
   17   1HB   LEU   3          1HB       LEU   3 -14.496   8.658  -3.676
   18   2HB   LEU   3          2HB       LEU   3 -16.260   8.886  -3.587
   19    HG   LEU   3           HG       LEU   3 -15.130  10.758  -4.787
   20   1HD1  LEU   3          1HD1      LEU   3 -16.871  10.950  -2.456
   21   2HD1  LEU   3          2HD1      LEU   3 -15.890  12.424  -2.639
   22   3HD1  LEU   3          3HD1      LEU   3 -16.922  11.870  -3.979
   23   1HD2  LEU   3          1HD2      LEU   3 -13.041  10.494  -3.237
   24   2HD2  LEU   3          2HD2      LEU   3 -13.513  12.129  -3.758
   25   3HD2  LEU   3          3HD2      LEU   3 -13.932  11.559  -2.125
   26    H    SER   4           H        SER   4 -14.518   7.366  -0.070
   27    HA   SER   4           HA       SER   4 -15.488   5.516   0.863
   28   1HB   SER   4          1HB       SER   4 -17.751   5.740   1.657
   29   2HB   SER   4          2HB       SER   4 -16.987   7.345   1.765
   30    HG   SER   4           HG       SER   4 -18.084   6.962  -0.667
   31    H    GLN   5           H        GLN   5 -15.452   3.662  -0.254
   32    HA   GLN   5           HA       GLN   5 -16.393   1.971  -1.555
   33   1HB   GLN   5          1HB       GLN   5 -18.535   3.573  -1.413
   34   2HB   GLN   5          2HB       GLN   5 -18.109   3.866  -3.117
   35   1HG   GLN   5          1HG       GLN   5 -18.073   1.407  -3.505
   36   2HG   GLN   5          2HG       GLN   5 -18.565   1.149  -1.817
   37   1HE2  GLN   5          1HE2      GLN   5 -20.057   0.222  -4.071
   38   2HE2  GLN   5          2HE2      GLN   5 -21.584   1.076  -4.100
   39    H    GLU   6           H        GLU   6 -15.798   5.181  -3.037
   40    HA   GLU   6           HA       GLU   6 -15.166   4.427  -5.629
   41   1HB   GLU   6          1HB       GLU   6 -15.084   6.740  -4.233
   42   2HB   GLU   6          2HB       GLU   6 -13.342   6.389  -4.316
   43   1HG   GLU   6          1HG       GLU   6 -13.340   6.375  -6.684
   44   2HG   GLU   6          2HG       GLU   6 -15.106   6.200  -6.771
   45    H    THR   7           H        THR   7 -13.036   4.389  -2.730
   46    HA   THR   7           HA       THR   7 -10.953   3.027  -4.326
   47    HB   THR   7           HB       THR   7 -10.288   3.346  -1.541
   48    HG1  THR   7           1HG      THR   7 -11.351   5.101  -1.148
   49   1HG2  THR   7          1HG2      THR   7  -9.385   4.850  -4.035
   50   2HG2  THR   7          2HG2      THR   7  -8.496   4.725  -2.497
   51   3HG2  THR   7          3HG2      THR   7  -8.743   3.277  -3.502
   52    H    PHE   8           H        PHE   8 -11.280   2.420  -0.897
   53    HA   PHE   8           HA       PHE   8 -10.974   0.144  -0.132
   54   1HB   PHE   8          1HB       PHE   8 -13.947   0.329  -0.595
   55   2HB   PHE   8          2HB       PHE   8 -13.073  -0.312   0.806
   56    HD1  PHE   8           1HD      PHE   8 -12.965   2.963  -1.044
   57    HD2  PHE   8           2HD      PHE   8 -13.524   0.933   2.700
   58    HE1  PHE   8           1HE      PHE   8 -13.200   5.148   0.105
   59    HE2  PHE   8           2HE      PHE   8 -13.760   3.118   3.849
   60    HZ   PHE   8           HZ       PHE   8 -13.598   5.226   2.552
   61    H    SER   9           H        SER   9 -13.614   0.121  -2.601
   62    HA   SER   9           HA       SER   9 -13.792  -2.468  -3.270
   63   1HB   SER   9          1HB       SER   9 -14.862  -0.515  -4.452
   64   2HB   SER   9          2HB       SER   9 -13.348  -0.310  -5.366
   65    HG   SER   9           HG       SER   9 -14.845  -2.719  -5.247
   66    H    ASP  10           H        ASP  10 -11.288  -0.363  -4.808
   67    HA   ASP  10           HA       ASP  10  -9.701  -2.829  -5.306
   68   1HB   ASP  10          1HB       ASP  10  -8.547  -1.472  -7.008
   69   2HB   ASP  10          2HB       ASP  10 -10.301  -1.508  -7.292
   70    H    LEU  11           H        LEU  11  -9.916   0.035  -3.394
   71    HA   LEU  11           HA       LEU  11  -7.121   0.491  -2.962
   72   1HB   LEU  11          1HB       LEU  11  -9.214   1.982  -2.457
   73   2HB   LEU  11          2HB       LEU  11  -9.268   1.079  -0.924
   74    HG   LEU  11           HG       LEU  11  -7.477   3.225  -1.731
   75   1HD1  LEU  11          1HD1      LEU  11  -7.823   1.606   0.829
   76   2HD1  LEU  11          2HD1      LEU  11  -6.929   3.139   0.698
   77   3HD1  LEU  11          3HD1      LEU  11  -8.685   3.106   0.409
   78   1HD2  LEU  11          1HD2      LEU  11  -6.248   0.549  -0.955
   79   2HD2  LEU  11          2HD2      LEU  11  -5.913   1.511  -2.414
   80   3HD2  LEU  11          3HD2      LEU  11  -5.392   2.104  -0.819
   81    H    TRP  12           H        TRP  12  -9.559  -0.855  -0.661
   82    HA   TRP  12           HA       TRP  12  -7.752  -1.905   1.172
   83   1HB   TRP  12          1HB       TRP  12  -9.654  -2.526   2.144
   84   2HB   TRP  12          2HB       TRP  12 -10.516  -1.963   0.705
   85    HD1  TRP  12           HD       TRP  12 -12.049  -3.675  -0.302
   86    HE1  TRP  12           1HE      TRP  12 -12.252  -6.213  -0.375
   87    HE3  TRP  12           3HE      TRP  12  -7.807  -4.898   2.288
   88    HZ2  TRP  12           2HZ      TRP  12 -10.760  -8.505   0.573
   89    HZ3  TRP  12           3HZ      TRP  12  -7.233  -7.265   2.682
   90    HH2  TRP  12           HH       TRP  12  -8.695  -9.076   1.834
   91    H    LYS  13           H        LYS  13  -8.863  -3.245  -1.932
   92    HA   LYS  13           HA       LYS  13  -7.625  -5.826  -1.506
   93   1HB   LYS  13          1HB       LYS  13  -9.453  -4.692  -3.309
   94   2HB   LYS  13          2HB       LYS  13  -8.019  -5.066  -4.294
   95   1HG   LYS  13          1HG       LYS  13  -8.045  -7.356  -3.025
   96   2HG   LYS  13          2HG       LYS  13  -9.729  -6.932  -2.634
   97   1HD   LYS  13          1HD       LYS  13 -10.367  -6.882  -4.918
   98   2HD   LYS  13          2HD       LYS  13  -8.679  -6.785  -5.476
   99   1HE   LYS  13          1HE       LYS  13  -9.284  -9.158  -3.814
  100   2HE   LYS  13          2HE       LYS  13 -10.169  -9.101  -5.354
  101   1HZ   LYS  13          1HZ       LYS  13  -7.970 -10.180  -5.424
  102   2HZ   LYS  13          2HZ       LYS  13  -8.166  -8.958  -6.514
  103   3HZ   LYS  13          3HZ       LYS  13  -7.273  -8.710  -5.150
  104    H    LEU  14           H        LEU  14  -6.645  -2.687  -2.791
  105    HA   LEU  14           HA       LEU  14  -4.375  -3.526  -4.270
  106   1HB   LEU  14          1HB       LEU  14  -5.605  -1.077  -3.408
  107   2HB   LEU  14          2HB       LEU  14  -3.865  -0.998  -3.038
  108    HG   LEU  14           HG       LEU  14  -4.051  -0.214  -5.281
  109   1HD1  LEU  14          1HD1      LEU  14  -2.562  -2.415  -4.677
  110   2HD1  LEU  14          2HD1      LEU  14  -3.549  -3.061  -6.009
  111   3HD1  LEU  14          3HD1      LEU  14  -2.536  -1.621  -6.270
  112   1HD2  LEU  14          1HD2      LEU  14  -5.310  -1.520  -7.016
  113   2HD2  LEU  14          2HD2      LEU  14  -5.879  -2.612  -5.730
  114   3HD2  LEU  14          3HD2      LEU  14  -6.356  -0.897  -5.717
  115    H    LEU  15           H        LEU  15  -4.813  -2.649  -0.819
  116    HA   LEU  15           HA       LEU  15  -2.018  -2.968  -0.182
  117   1HB   LEU  15          1HB       LEU  15  -4.578  -2.459   1.263
  118   2HB   LEU  15          2HB       LEU  15  -3.262  -3.200   2.206
  119    HG   LEU  15           HG       LEU  15  -2.226  -1.070   0.520
  120   1HD1  LEU  15          1HD1      LEU  15  -4.786  -0.469   1.106
  121   2HD1  LEU  15          2HD1      LEU  15  -4.034   0.035   2.639
  122   3HD1  LEU  15          3HD1      LEU  15  -3.501   0.762   1.104
  123   1HD2  LEU  15          1HD2      LEU  15  -1.988  -0.296   3.170
  124   2HD2  LEU  15          2HD2      LEU  15  -2.139  -2.065   3.299
  125   3HD2  LEU  15          3HD2      LEU  15  -0.847  -1.352   2.303
  126    H    LYS  16           H        LYS  16  -4.410  -5.168  -1.050
  127    HA   LYS  16           HA       LYS  16  -3.746  -7.289   0.811
  128   1HB   LYS  16          1HB       LYS  16  -5.800  -6.760  -0.986
  129   2HB   LYS  16          2HB       LYS  16  -4.905  -8.087  -1.766
  130   1HG   LYS  16          1HG       LYS  16  -4.940  -8.955   0.827
  131   2HG   LYS  16          2HG       LYS  16  -6.484  -8.073   0.756
  132   1HD   LYS  16          1HD       LYS  16  -6.849  -9.352  -1.490
  133   2HD   LYS  16          2HD       LYS  16  -5.565 -10.435  -0.902
  134   1HE   LYS  16          1HE       LYS  16  -7.136 -10.219   1.333
  135   2HE   LYS  16          2HE       LYS  16  -8.357 -10.096   0.049
  136   1HZ   LYS  16          1HZ       LYS  16  -6.756 -12.324   0.838
  137   2HZ   LYS  16          2HZ       LYS  16  -8.232 -12.284   0.102
  138   3HZ   LYS  16          3HZ       LYS  16  -6.858 -12.108  -0.794
  139    H    LYS  17           H        LYS  17  -1.716  -5.825  -1.127
  140    HA   LYS  17           HA       LYS  17  -0.057  -8.156  -1.498
  141   1HB   LYS  17          1HB       LYS  17  -0.892  -8.737  -3.523
  142   2HB   LYS  17          2HB       LYS  17  -1.740  -7.185  -3.724
  143   1HG   LYS  17          1HG       LYS  17   1.271  -7.536  -4.032
  144   2HG   LYS  17          2HG       LYS  17   0.121  -7.559  -5.390
  145   1HD   LYS  17          1HD       LYS  17  -0.575  -5.267  -3.925
  146   2HD   LYS  17          2HD       LYS  17   1.205  -5.279  -3.911
  147   1HE   LYS  17          1HE       LYS  17   0.471  -6.032  -6.529
  148   2HE   LYS  17          2HE       LYS  17  -0.623  -4.698  -6.103
  149   1HZ   LYS  17          1HZ       LYS  17   2.305  -4.691  -6.088
  150   2HZ   LYS  17          2HZ       LYS  17   1.290  -3.763  -6.999
  151   3HZ   LYS  17          3HZ       LYS  17   1.405  -3.509  -5.373
  152    H    TRP  18           H        TRP  18  -0.787  -4.738  -2.206
  153    HA   TRP  18           HA       TRP  18   1.964  -4.041  -2.751
  154   1HB   TRP  18          1HB       TRP  18  -0.394  -2.886  -3.290
  155   2HB   TRP  18          2HB       TRP  18  -0.020  -2.031  -1.787
  156    HD1  TRP  18           HD       TRP  18   0.488  -1.815  -5.387
  157    HE1  TRP  18           1HE      TRP  18   2.274  -0.112  -6.018
  158    HE3  TRP  18           3HE      TRP  18   2.609  -1.127  -0.780
  159    HZ2  TRP  18           2HZ      TRP  18   4.374   1.373  -4.692
  160    HZ3  TRP  18           3HZ      TRP  18   4.497   0.437  -0.504
  161    HH2  TRP  18           HH       TRP  18   5.390   1.692  -2.444
  162    H    LYS  19           H        LYS  19  -0.225  -3.857   0.083
  163    HA   LYS  19           HA       LYS  19   1.143  -2.376   1.886
  164   1HB   LYS  19          1HB       LYS  19  -0.918  -3.666   2.366
  165   2HB   LYS  19          2HB       LYS  19   0.042  -5.164   2.416
  166   1HG   LYS  19          1HG       LYS  19   1.428  -3.419   4.109
  167   2HG   LYS  19          2HG       LYS  19  -0.285  -3.086   4.460
  168   1HD   LYS  19          1HD       LYS  19  -0.717  -5.323   5.081
  169   2HD   LYS  19          2HD       LYS  19   0.738  -5.930   4.256
  170   1HE   LYS  19          1HE       LYS  19   2.117  -4.592   5.909
  171   2HE   LYS  19          2HE       LYS  19   0.613  -4.259   6.795
  172   1HZ   LYS  19          1HZ       LYS  19   2.146  -6.665   6.635
  173   2HZ   LYS  19          2HZ       LYS  19   1.145  -6.120   7.828
  174   3HZ   LYS  19          3HZ       LYS  19   0.516  -6.885   6.508
  175    H    MET  20           H        MET  20   2.015  -5.707   0.874
  176    HA   MET  20           HA       MET  20   4.003  -6.413   2.567
  177   1HB   MET  20          1HB       MET  20   4.035  -7.953   0.919
  178   2HB   MET  20          2HB       MET  20   3.461  -6.783  -0.293
  179   1HG   MET  20          1HG       MET  20   6.085  -5.982   0.371
  180   2HG   MET  20          2HG       MET  20   6.155  -7.745   0.219
  181   1HE   MET  20          1HE       MET  20   5.107  -4.354  -1.932
  182   2HE   MET  20          2HE       MET  20   4.113  -5.293  -3.071
  183   3HE   MET  20          3HE       MET  20   3.748  -5.332  -1.330
  184    H    ARG  21           H        ARG  21   4.323  -3.989  -0.065
  185    HA   ARG  21           HA       ARG  21   7.042  -3.334   0.865
  186   1HB   ARG  21          1HB       ARG  21   5.323  -2.579  -1.507
  187   2HB   ARG  21          2HB       ARG  21   6.794  -1.660  -1.108
  188   1HG   ARG  21          1HG       ARG  21   8.203  -3.466  -1.538
  189   2HG   ARG  21          2HG       ARG  21   6.933  -4.669  -1.210
  190   1HD   ARG  21          1HD       ARG  21   5.802  -3.434  -3.322
  191   2HD   ARG  21          2HD       ARG  21   7.508  -3.117  -3.705
  192    HE   ARG  21           HE       ARG  21   6.130  -5.616  -3.971
  193   1HH1  ARG  21          2HH2      ARG  21   9.217  -4.199  -2.989
  194   2HH1  ARG  21          1HH2      ARG  21  10.155  -5.615  -3.405
  195   1HH2  ARG  21          2HH1      ARG  21   7.370  -7.486  -4.521
  196   2HH2  ARG  21          1HH1      ARG  21   9.102  -7.490  -4.278
  197    H    ARG  22           H        ARG  22   3.803  -1.819   0.500
  198    HA   ARG  22           HA       ARG  22   4.550   0.718   1.551
  199   1HB   ARG  22          1HB       ARG  22   2.481   0.255   0.248
  200   2HB   ARG  22          2HB       ARG  22   1.850  -0.686   1.622
  201   1HG   ARG  22          1HG       ARG  22   2.748   1.800   2.680
  202   2HG   ARG  22          2HG       ARG  22   1.812   2.179   1.214
  203   1HD   ARG  22          1HD       ARG  22   0.411   2.036   3.299
  204   2HD   ARG  22          2HD       ARG  22  -0.086   0.906   2.021
  205    HE   ARG  22           HE       ARG  22   1.627  -0.613   3.499
  206   1HH1  ARG  22          2HH2      ARG  22  -1.121   1.452   4.325
  207   2HH1  ARG  22          1HH2      ARG  22  -1.581   0.512   5.727
  208   1HH2  ARG  22          2HH1      ARG  22   1.020  -1.854   5.351
  209   2HH2  ARG  22          1HH1      ARG  22  -0.360  -1.373   6.312
  210    H    ASN  23           H        ASN  23   5.240  -1.940   3.062
  211    HA   ASN  23           HA       ASN  23   4.671  -0.794   5.720
  212   1HB   ASN  23          1HB       ASN  23   3.089  -2.840   4.699
  213   2HB   ASN  23          2HB       ASN  23   4.304  -3.704   5.666
  214   1HD2  ASN  23          1HD2      ASN  23   4.830  -1.837   7.686
  215   2HD2  ASN  23          2HD2      ASN  23   3.393  -1.627   8.663
  216    H    GLN  24           H        GLN  24   6.930  -1.503   3.645
  217    HA   GLN  24           HA       GLN  24   8.913  -2.090   5.639
  218   1HB   GLN  24          1HB       GLN  24   7.952  -4.297   3.809
  219   2HB   GLN  24          2HB       GLN  24   9.637  -4.253   4.381
  220   1HG   GLN  24          1HG       GLN  24   8.350  -3.792   6.722
  221   2HG   GLN  24          2HG       GLN  24   7.113  -4.761   5.892
  222   1HE2  GLN  24          1HE2      GLN  24   7.976  -6.000   8.029
  223   2HE2  GLN  24          2HE2      GLN  24   9.163  -7.238   7.677
  224    H    PHE  25           H        PHE  25   9.365  -3.509   2.487
  225    HA   PHE  25           HA       PHE  25  11.592  -2.210   1.704
  226   1HB   PHE  25          1HB       PHE  25  10.884  -3.786   0.188
  227   2HB   PHE  25          2HB       PHE  25   9.205  -3.221   0.214
  228    HD1  PHE  25           1HD      PHE  25   8.964  -0.670  -0.696
  229    HD2  PHE  25           2HD      PHE  25  12.051  -3.456  -1.775
  230    HE1  PHE  25           1HE      PHE  25   9.350   0.574  -2.806
  231    HE2  PHE  25           2HE      PHE  25  12.436  -2.212  -3.885
  232    HZ   PHE  25           HZ       PHE  25  11.086  -0.196  -4.401
  233    H    TRP  26           H        TRP  26   8.298  -0.854   1.652
  234    HA   TRP  26           HA       TRP  26   8.789   1.454   0.129
  235   1HB   TRP  26          1HB       TRP  26   6.764   2.206   0.932
  236   2HB   TRP  26          2HB       TRP  26   6.620   0.461   1.189
  237    HD1  TRP  26           HD       TRP  26   6.244  -0.378   3.584
  238    HE1  TRP  26           1HE      TRP  26   5.931   0.705   5.868
  239    HE3  TRP  26           3HE      TRP  26   7.622   4.408   2.403
  240    HZ2  TRP  26           2HZ      TRP  26   6.238   3.329   7.050
  241    HZ3  TRP  26           3HZ      TRP  26   7.599   6.169   4.132
  242    HH2  TRP  26           HH       TRP  26   6.911   5.648   6.454
  243    H    VAL  27           H        VAL  27   9.267   0.833   3.631
  244    HA   VAL  27           HA       VAL  27   9.851   3.246   4.681
  245    HB   VAL  27           HB       VAL  27  11.444   2.160   6.135
  246   1HG1  VAL  27          1HG1      VAL  27  10.014  -0.307   5.794
  247   2HG1  VAL  27          2HG1      VAL  27   9.730   0.977   6.993
  248   3HG1  VAL  27          3HG1      VAL  27   8.905   1.033   5.417
  249   1HG2  VAL  27          1HG2      VAL  27  11.728   0.288   3.777
  250   2HG2  VAL  27          2HG2      VAL  27  12.997   1.100   4.726
  251   3HG2  VAL  27          3HG2      VAL  27  12.110  -0.278   5.421
  252    H    LYS  28           H        LYS  28  11.995   1.421   2.456
  253    HA   LYS  28           HA       LYS  28  14.093   3.390   2.527
  254   1HB   LYS  28          1HB       LYS  28  13.424   0.920   0.992
  255   2HB   LYS  28          2HB       LYS  28  14.531   2.074   0.211
  256   1HG   LYS  28          1HG       LYS  28  14.984   1.378   3.103
  257   2HG   LYS  28          2HG       LYS  28  15.454   0.195   1.860
  258   1HD   LYS  28          1HD       LYS  28  17.233   1.439   1.216
  259   2HD   LYS  28          2HD       LYS  28  16.263   2.930   1.162
  260   1HE   LYS  28          1HE       LYS  28  16.364   2.840   3.756
  261   2HE   LYS  28          2HE       LYS  28  17.690   1.680   3.525
  262   1HZ   LYS  28          1HZ       LYS  28  17.905   4.361   3.526
  263   2HZ   LYS  28          2HZ       LYS  28  19.035   3.299   2.965
  264   3HZ   LYS  28          3HZ       LYS  28  17.963   3.991   1.920
  265    H    VAL  29           H        VAL  29  11.262   2.764   0.439
  266    HA   VAL  29           HA       VAL  29  11.773   4.435  -1.700
  267    HB   VAL  29           HB       VAL  29   9.707   2.962  -1.112
  268   1HG1  VAL  29          1HG1      VAL  29   8.291   3.750   0.454
  269   2HG1  VAL  29          2HG1      VAL  29   9.386   5.125   0.732
  270   3HG1  VAL  29          3HG1      VAL  29   8.082   5.255  -0.473
  271   1HG2  VAL  29          1HG2      VAL  29   8.267   4.833  -2.439
  272   2HG2  VAL  29          2HG2      VAL  29   9.899   5.504  -2.674
  273   3HG2  VAL  29          3HG2      VAL  29   9.528   3.852  -3.225
  274    H    GLN  30           H        GLN  30  11.529   5.295   1.625
  275    HA   GLN  30           HA       GLN  30  10.881   8.111   1.004
  276   1HB   GLN  30          1HB       GLN  30  10.187   8.258   3.163
  277   2HB   GLN  30          2HB       GLN  30  10.159   6.480   3.081
  278   1HG   GLN  30          1HG       GLN  30  12.538   6.456   3.871
  279   2HG   GLN  30          2HG       GLN  30  12.457   8.221   4.063
  280   1HE2  GLN  30          1HE2      GLN  30  13.102   7.242   6.338
  281   2HE2  GLN  30          2HE2      GLN  30  11.760   7.010   7.437
  282    H    ARG  31           H        ARG  31  13.489   6.064   2.375
  283    HA   ARG  31           HA       ARG  31  15.616   6.739   3.087
  284   1HB   ARG  31          1HB       ARG  31  15.940   5.933   0.838
  285   2HB   ARG  31          2HB       ARG  31  15.389   7.477   0.146
  286   1HG   ARG  31          1HG       ARG  31  17.505   8.024   2.017
  287   2HG   ARG  31          2HG       ARG  31  18.046   6.732   0.919
  288   1HD   ARG  31          1HD       ARG  31  17.154   8.183  -0.995
  289   2HD   ARG  31          2HD       ARG  31  17.010   9.495   0.195
  290    HE   ARG  31           HE       ARG  31  19.607   8.579   0.487
  291   1HH1  ARG  31          2HH2      ARG  31  17.615   9.795  -2.169
  292   2HH1  ARG  31          1HH2      ARG  31  18.963  10.492  -3.041
  293   1HH2  ARG  31          2HH1      ARG  31  21.386   9.499  -0.665
  294   2HH2  ARG  31          1HH1      ARG  31  21.112  10.323  -2.183
  295    H    GLY  32           H        GLY  32  15.134   8.408   4.616
  296   1HA   GLY  32          1HA       GLY  32  15.771  11.119   3.558
  297   2HA   GLY  32          2HA       GLY  32  14.423  10.871   4.691
  Start of MODEL   12
    1    HA   PRO   1           HA       PRO   1 -11.626   4.938   5.093
    2   1HB   PRO   1          1HB       PRO   1 -13.694   6.657   5.533
    3   2HB   PRO   1          2HB       PRO   1 -13.128   5.516   6.796
    4   1HG   PRO   1          1HG       PRO   1 -12.342   8.425   6.461
    5   2HG   PRO   1          2HG       PRO   1 -12.959   7.628   7.945
    6   1HD   PRO   1          1HD       PRO   1 -10.288   7.957   7.514
    7   2HD   PRO   1          2HD       PRO   1 -10.910   6.445   8.241
    8    HA   PRO   2           HA       PRO   2 -10.602   7.564   1.609
    9   1HB   PRO   2          1HB       PRO   2 -11.379   5.827  -0.340
   10   2HB   PRO   2          2HB       PRO   2  -9.918   5.535   0.658
   11   1HG   PRO   2          1HG       PRO   2 -12.702   4.421   1.105
   12   2HG   PRO   2          2HG       PRO   2 -11.163   3.503   1.023
   13   1HD   PRO   2          1HD       PRO   2 -12.236   4.268   3.409
   14   2HD   PRO   2          2HD       PRO   2 -10.468   4.350   3.141
   15    H    LEU   3           H        LEU   3 -12.185   7.504  -0.702
   16    HA   LEU   3           HA       LEU   3 -14.286   9.248  -0.041
   17   1HB   LEU   3          1HB       LEU   3 -13.269   7.847  -2.414
   18   2HB   LEU   3          2HB       LEU   3 -15.031   8.095  -2.458
   19    HG   LEU   3           HG       LEU   3 -13.749  10.018  -3.432
   20   1HD1  LEU   3          1HD1      LEU   3 -15.954  10.058  -1.810
   21   2HD1  LEU   3          2HD1      LEU   3 -14.881  11.181  -0.940
   22   3HD1  LEU   3          3HD1      LEU   3 -15.305  11.493  -2.641
   23   1HD2  LEU   3          1HD2      LEU   3 -12.243  11.291  -2.163
   24   2HD2  LEU   3          2HD2      LEU   3 -12.887  10.693  -0.616
   25   3HD2  LEU   3          3HD2      LEU   3 -11.874   9.634  -1.626
   26    H    SER   4           H        SER   4 -15.188   6.349  -1.855
   27    HA   SER   4           HA       SER   4 -16.508   4.870   0.105
   28   1HB   SER   4          1HB       SER   4 -18.867   6.020  -0.932
   29   2HB   SER   4          2HB       SER   4 -18.248   6.146   0.732
   30    HG   SER   4           HG       SER   4 -18.618   8.162  -0.550
   31    H    GLN   5           H        GLN   5 -15.884   3.185  -1.244
   32    HA   GLN   5           HA       GLN   5 -16.517   1.564  -2.790
   33   1HB   GLN   5          1HB       GLN   5 -18.731   3.133  -2.872
   34   2HB   GLN   5          2HB       GLN   5 -18.091   3.418  -4.508
   35   1HG   GLN   5          1HG       GLN   5 -17.993   0.591  -3.655
   36   2HG   GLN   5          2HG       GLN   5 -19.639   1.254  -3.758
   37   1HE2  GLN   5          1HE2      GLN   5 -18.844  -0.775  -5.488
   38   2HE2  GLN   5          2HE2      GLN   5 -18.695  -0.136  -7.112
   39    H    GLU   6           H        GLU   6 -16.044   4.897  -4.067
   40    HA   GLU   6           HA       GLU   6 -14.986   4.410  -6.540
   41   1HB   GLU   6          1HB       GLU   6 -14.549   6.436  -4.415
   42   2HB   GLU   6          2HB       GLU   6 -13.265   6.331  -5.644
   43   1HG   GLU   6          1HG       GLU   6 -15.004   6.491  -7.427
   44   2HG   GLU   6          2HG       GLU   6 -16.244   6.687  -6.169
   45    H    THR   7           H        THR   7 -13.062   4.434  -3.480
   46    HA   THR   7           HA       THR   7 -10.851   3.113  -4.910
   47    HB   THR   7           HB       THR   7 -10.465   3.426  -2.055
   48    HG1  THR   7           1HG      THR   7 -10.600   5.788  -2.227
   49   1HG2  THR   7          1HG2      THR   7  -8.588   4.819  -2.848
   50   2HG2  THR   7          2HG2      THR   7  -8.705   3.323  -3.806
   51   3HG2  THR   7          3HG2      THR   7  -9.298   4.861  -4.480
   52    H    PHE   8           H        PHE   8 -11.539   2.460  -1.522
   53    HA   PHE   8           HA       PHE   8 -11.203   0.188  -0.741
   54   1HB   PHE   8          1HB       PHE   8 -14.107   0.218  -1.534
   55   2HB   PHE   8          2HB       PHE   8 -13.360  -0.353  -0.032
   56    HD1  PHE   8           1HD      PHE   8 -13.216   2.901  -1.915
   57    HD2  PHE   8           2HD      PHE   8 -14.114   0.885   1.770
   58    HE1  PHE   8           1HE      PHE   8 -13.707   5.082  -0.841
   59    HE2  PHE   8           2HE      PHE   8 -14.605   3.066   2.844
   60    HZ   PHE   8           HZ       PHE   8 -14.401   5.165   1.538
   61    H    SER   9           H        SER   9 -13.549   0.068  -3.488
   62    HA   SER   9           HA       SER   9 -13.522  -2.519  -4.188
   63   1HB   SER   9          1HB       SER   9 -14.556  -0.605  -5.466
   64   2HB   SER   9          2HB       SER   9 -12.965  -0.319  -6.212
   65    HG   SER   9           HG       SER   9 -13.099  -2.652  -6.765
   66    H    ASP  10           H        ASP  10 -10.984  -0.276  -5.452
   67    HA   ASP  10           HA       ASP  10  -9.227  -2.652  -5.784
   68   1HB   ASP  10          1HB       ASP  10  -8.077  -1.405  -7.455
   69   2HB   ASP  10          2HB       ASP  10  -9.809  -1.146  -7.758
   70    H    LEU  11           H        LEU  11  -9.851   0.002  -3.753
   71    HA   LEU  11           HA       LEU  11  -7.114   0.641  -3.060
   72   1HB   LEU  11          1HB       LEU  11  -9.313   2.044  -2.795
   73   2HB   LEU  11          2HB       LEU  11  -9.502   1.130  -1.279
   74    HG   LEU  11           HG       LEU  11  -7.724   3.353  -1.872
   75   1HD1  LEU  11          1HD1      LEU  11  -8.902   1.882   0.411
   76   2HD1  LEU  11          2HD1      LEU  11  -7.311   2.605   0.750
   77   3HD1  LEU  11          3HD1      LEU  11  -8.653   3.630   0.187
   78   1HD2  LEU  11          1HD2      LEU  11  -6.475   0.720  -0.993
   79   2HD2  LEU  11          2HD2      LEU  11  -6.018   1.723  -2.390
   80   3HD2  LEU  11          3HD2      LEU  11  -5.707   2.305  -0.737
   81    H    TRP  12           H        TRP  12  -9.737  -0.756  -1.010
   82    HA   TRP  12           HA       TRP  12  -8.083  -1.790   0.974
   83   1HB   TRP  12          1HB       TRP  12 -10.058  -2.414   1.784
   84   2HB   TRP  12          2HB       TRP  12 -10.798  -1.865   0.274
   85    HD1  TRP  12           HD       TRP  12 -12.243  -3.593  -0.831
   86    HE1  TRP  12           1HE      TRP  12 -12.419  -6.132  -0.910
   87    HE3  TRP  12           3HE      TRP  12  -8.198  -4.773   2.075
   88    HZ2  TRP  12           2HZ      TRP  12 -10.985  -8.409   0.155
   89    HZ3  TRP  12           3HZ      TRP  12  -7.636  -7.134   2.520
   90    HH2  TRP  12           HH       TRP  12  -9.016  -8.960   1.570
   91    H    LYS  13           H        LYS  13  -8.965  -3.171  -2.193
   92    HA   LYS  13           HA       LYS  13  -7.791  -5.746  -1.686
   93   1HB   LYS  13          1HB       LYS  13  -9.402  -4.611  -3.638
   94   2HB   LYS  13          2HB       LYS  13  -7.855  -4.851  -4.486
   95   1HG   LYS  13          1HG       LYS  13  -8.019  -7.210  -3.149
   96   2HG   LYS  13          2HG       LYS  13  -9.752  -6.862  -3.358
   97   1HD   LYS  13          1HD       LYS  13  -9.336  -7.936  -5.366
   98   2HD   LYS  13          2HD       LYS  13  -8.950  -6.265  -5.843
   99   1HE   LYS  13          1HE       LYS  13  -6.584  -7.247  -4.683
  100   2HE   LYS  13          2HE       LYS  13  -7.201  -8.597  -5.660
  101   1HZ   LYS  13          1HZ       LYS  13  -5.815  -6.498  -6.580
  102   2HZ   LYS  13          2HZ       LYS  13  -6.727  -7.522  -7.497
  103   3HZ   LYS  13          3HZ       LYS  13  -7.364  -6.092  -6.976
  104    H    LEU  14           H        LEU  14  -6.600  -2.615  -2.817
  105    HA   LEU  14           HA       LEU  14  -4.155  -3.541  -3.959
  106   1HB   LEU  14          1HB       LEU  14  -5.438  -1.010  -3.262
  107   2HB   LEU  14          2HB       LEU  14  -3.690  -0.980  -2.928
  108    HG   LEU  14           HG       LEU  14  -4.676  -0.434  -5.367
  109   1HD1  LEU  14          1HD1      LEU  14  -2.273  -0.464  -4.574
  110   2HD1  LEU  14          2HD1      LEU  14  -2.225  -2.198  -4.970
  111   3HD1  LEU  14          3HD1      LEU  14  -2.493  -0.999  -6.257
  112   1HD2  LEU  14          1HD2      LEU  14  -5.393  -3.122  -5.055
  113   2HD2  LEU  14          2HD2      LEU  14  -5.319  -2.226  -6.591
  114   3HD2  LEU  14          3HD2      LEU  14  -3.920  -3.184  -6.052
  115    H    LEU  15           H        LEU  15  -5.039  -2.386  -0.671
  116    HA   LEU  15           HA       LEU  15  -2.410  -2.605   0.410
  117   1HB   LEU  15          1HB       LEU  15  -5.195  -2.591   1.609
  118   2HB   LEU  15          2HB       LEU  15  -3.728  -2.703   2.610
  119    HG   LEU  15           HG       LEU  15  -4.356  -0.494   0.604
  120   1HD1  LEU  15          1HD1      LEU  15  -4.289   0.865   2.809
  121   2HD1  LEU  15          2HD1      LEU  15  -5.733  -0.132   2.505
  122   3HD1  LEU  15          3HD1      LEU  15  -4.477  -0.705   3.629
  123   1HD2  LEU  15          1HD2      LEU  15  -1.962  -1.175   2.320
  124   2HD2  LEU  15          2HD2      LEU  15  -2.013  -0.652   0.620
  125   3HD2  LEU  15          3HD2      LEU  15  -2.323   0.521   1.922
  126    H    LYS  16           H        LYS  16  -4.627  -4.972  -0.657
  127    HA   LYS  16           HA       LYS  16  -3.967  -7.027   1.271
  128   1HB   LYS  16          1HB       LYS  16  -5.905  -6.646  -0.686
  129   2HB   LYS  16          2HB       LYS  16  -4.876  -7.926  -1.372
  130   1HG   LYS  16          1HG       LYS  16  -5.046  -9.156   0.814
  131   2HG   LYS  16          2HG       LYS  16  -6.197  -7.919   1.374
  132   1HD   LYS  16          1HD       LYS  16  -7.807  -8.518  -0.279
  133   2HD   LYS  16          2HD       LYS  16  -6.615  -9.454  -1.213
  134   1HE   LYS  16          1HE       LYS  16  -6.499 -11.154   0.486
  135   2HE   LYS  16          2HE       LYS  16  -7.431 -10.163   1.629
  136   1HZ   LYS  16          1HZ       LYS  16  -8.899 -11.691   0.744
  137   2HZ   LYS  16          2HZ       LYS  16  -9.241 -10.291  -0.058
  138   3HZ   LYS  16          3HZ       LYS  16  -8.375 -11.480  -0.805
  139    H    LYS  17           H        LYS  17  -1.905  -5.461  -0.575
  140    HA   LYS  17           HA       LYS  17  -0.077  -7.691  -0.766
  141   1HB   LYS  17          1HB       LYS  17  -0.767  -8.348  -2.829
  142   2HB   LYS  17          2HB       LYS  17  -1.625  -6.820  -3.139
  143   1HG   LYS  17          1HG       LYS  17   1.408  -7.096  -3.173
  144   2HG   LYS  17          2HG       LYS  17   0.388  -7.205  -4.627
  145   1HD   LYS  17          1HD       LYS  17  -0.510  -4.888  -3.327
  146   2HD   LYS  17          2HD       LYS  17   1.259  -4.840  -3.136
  147   1HE   LYS  17          1HE       LYS  17   0.501  -3.747  -5.244
  148   2HE   LYS  17          2HE       LYS  17   1.565  -5.138  -5.543
  149   1HZ   LYS  17          1HZ       LYS  17  -1.328  -5.470  -5.505
  150   2HZ   LYS  17          2HZ       LYS  17  -0.573  -4.907  -6.859
  151   3HZ   LYS  17          3HZ       LYS  17  -0.182  -6.390  -6.253
  152    H    TRP  18           H        TRP  18  -0.950  -4.339  -1.640
  153    HA   TRP  18           HA       TRP  18   1.767  -3.468  -2.002
  154   1HB   TRP  18          1HB       TRP  18  -0.648  -2.460  -2.630
  155   2HB   TRP  18          2HB       TRP  18  -0.358  -1.571  -1.128
  156    HD1  TRP  18           HD       TRP  18   0.207  -1.341  -4.711
  157    HE1  TRP  18           1HE      TRP  18   1.926   0.437  -5.318
  158    HE3  TRP  18           3HE      TRP  18   2.227  -0.555  -0.074
  159    HZ2  TRP  18           2HZ      TRP  18   3.939   2.015  -3.964
  160    HZ3  TRP  18           3HZ      TRP  18   4.040   1.091   0.227
  161    HH2  TRP  18           HH       TRP  18   4.906   2.381  -1.702
  162    H    LYS  19           H        LYS  19  -0.574  -3.368   0.718
  163    HA   LYS  19           HA       LYS  19   0.726  -1.830   2.562
  164   1HB   LYS  19          1HB       LYS  19  -1.423  -3.095   2.878
  165   2HB   LYS  19          2HB       LYS  19  -0.462  -4.566   3.158
  166   1HG   LYS  19          1HG       LYS  19   0.783  -3.199   4.961
  167   2HG   LYS  19          2HG       LYS  19  -0.547  -2.025   4.816
  168   1HD   LYS  19          1HD       LYS  19  -2.127  -4.044   5.151
  169   2HD   LYS  19          2HD       LYS  19  -0.679  -4.929   5.688
  170   1HE   LYS  19          1HE       LYS  19  -0.536  -2.478   7.040
  171   2HE   LYS  19          2HE       LYS  19  -2.260  -2.906   7.095
  172   1HZ   LYS  19          1HZ       LYS  19  -0.114  -4.026   8.501
  173   2HZ   LYS  19          2HZ       LYS  19  -1.733  -4.269   8.699
  174   3HZ   LYS  19          3HZ       LYS  19  -0.885  -5.196   7.630
  175    H    MET  20           H        MET  20   1.763  -4.945   1.285
  176    HA   MET  20           HA       MET  20   3.544  -5.798   3.251
  177   1HB   MET  20          1HB       MET  20   3.045  -7.126   1.279
  178   2HB   MET  20          2HB       MET  20   3.776  -5.896   0.219
  179   1HG   MET  20          1HG       MET  20   5.715  -6.483   2.188
  180   2HG   MET  20          2HG       MET  20   5.043  -8.048   1.700
  181   1HE   MET  20          1HE       MET  20   6.939  -4.998  -1.226
  182   2HE   MET  20          2HE       MET  20   5.272  -4.852  -0.620
  183   3HE   MET  20          3HE       MET  20   6.644  -4.703   0.504
  184    H    ARG  21           H        ARG  21   4.190  -3.556   0.501
  185    HA   ARG  21           HA       ARG  21   6.832  -2.923   1.579
  186   1HB   ARG  21          1HB       ARG  21   6.759  -1.260  -0.382
  187   2HB   ARG  21          2HB       ARG  21   6.694  -2.992  -0.791
  188   1HG   ARG  21          1HG       ARG  21   4.033  -1.867  -0.269
  189   2HG   ARG  21          2HG       ARG  21   4.867  -1.040  -1.607
  190   1HD   ARG  21          1HD       ARG  21   5.452  -3.703  -2.089
  191   2HD   ARG  21          2HD       ARG  21   3.795  -3.786  -1.454
  192    HE   ARG  21           HE       ARG  21   3.045  -2.882  -3.433
  193   1HH1  ARG  21          2HH2      ARG  21   6.458  -2.079  -2.975
  194   2HH1  ARG  21          1HH2      ARG  21   6.625  -1.301  -4.533
  195   1HH2  ARG  21          2HH1      ARG  21   3.266  -1.853  -5.490
  196   2HH2  ARG  21          1HH1      ARG  21   4.805  -1.172  -5.967
  197    H    ARG  22           H        ARG  22   3.615  -1.385   1.270
  198    HA   ARG  22           HA       ARG  22   4.359   1.176   2.231
  199   1HB   ARG  22          1HB       ARG  22   2.229   0.731   1.103
  200   2HB   ARG  22          2HB       ARG  22   1.725  -0.337   2.435
  201   1HG   ARG  22          1HG       ARG  22   0.888   2.134   2.449
  202   2HG   ARG  22          2HG       ARG  22   1.535   1.455   3.962
  203   1HD   ARG  22          1HD       ARG  22   2.412   3.760   3.368
  204   2HD   ARG  22          2HD       ARG  22   3.663   2.526   3.629
  205    HE   ARG  22           HE       ARG  22   4.222   2.610   1.363
  206   1HH1  ARG  22          2HH2      ARG  22   1.280   4.451   2.040
  207   2HH1  ARG  22          1HH2      ARG  22   1.244   5.231   0.475
  208   1HH2  ARG  22          2HH1      ARG  22   4.174   3.641  -0.705
  209   2HH2  ARG  22          1HH1      ARG  22   2.894   4.769  -1.090
  210    H    ASN  23           H        ASN  23   5.170  -1.469   3.752
  211    HA   ASN  23           HA       ASN  23   4.811  -0.246   6.414
  212   1HB   ASN  23          1HB       ASN  23   3.109  -2.255   5.606
  213   2HB   ASN  23          2HB       ASN  23   4.411  -3.170   6.396
  214   1HD2  ASN  23          1HD2      ASN  23   1.469  -1.797   6.955
  215   2HD2  ASN  23          2HD2      ASN  23   1.624  -1.407   8.655
  216    H    GLN  24           H        GLN  24   6.891  -1.066   4.177
  217    HA   GLN  24           HA       GLN  24   9.034  -1.564   6.017
  218   1HB   GLN  24          1HB       GLN  24   7.890  -3.871   4.435
  219   2HB   GLN  24          2HB       GLN  24   9.624  -3.814   4.834
  220   1HG   GLN  24          1HG       GLN  24   8.560  -3.178   7.254
  221   2HG   GLN  24          2HG       GLN  24   7.262  -4.206   6.611
  222   1HE2  GLN  24          1HE2      GLN  24   8.394  -5.239   8.768
  223   2HE2  GLN  24          2HE2      GLN  24   9.530  -6.515   8.384
  224    H    PHE  25           H        PHE  25   9.142  -3.169   2.912
  225    HA   PHE  25           HA       PHE  25  11.317  -1.990   1.848
  226   1HB   PHE  25          1HB       PHE  25  10.308  -3.663   0.568
  227   2HB   PHE  25          2HB       PHE  25   8.728  -2.862   0.582
  228    HD1  PHE  25           1HD      PHE  25   8.829  -0.377  -0.524
  229    HD2  PHE  25           2HD      PHE  25  11.440  -3.662  -1.443
  230    HE1  PHE  25           1HE      PHE  25   9.320   0.632  -2.736
  231    HE2  PHE  25           2HE      PHE  25  11.930  -2.653  -3.655
  232    HZ   PHE  25           HZ       PHE  25  10.871  -0.506  -4.301
  233    H    TRP  26           H        TRP  26   8.064  -0.529   2.002
  234    HA   TRP  26           HA       TRP  26   8.453   1.682   0.343
  235   1HB   TRP  26          1HB       TRP  26   6.588   2.584   1.374
  236   2HB   TRP  26          2HB       TRP  26   6.394   0.854   1.691
  237    HD1  TRP  26           HD       TRP  26   6.234   0.095   4.130
  238    HE1  TRP  26           1HE      TRP  26   6.268   1.234   6.408
  239    HE3  TRP  26           3HE      TRP  26   7.780   4.754   2.680
  240    HZ2  TRP  26           2HZ      TRP  26   6.889   3.848   7.482
  241    HZ3  TRP  26           3HZ      TRP  26   8.081   6.539   4.356
  242    HH2  TRP  26           HH       TRP  26   7.641   6.105   6.755
  243    H    VAL  27           H        VAL  27   9.374   1.217   3.778
  244    HA   VAL  27           HA       VAL  27  10.179   3.700   4.549
  245    HB   VAL  27           HB       VAL  27  11.784   2.632   5.981
  246   1HG1  VAL  27          1HG1      VAL  27  10.207   0.228   5.947
  247   2HG1  VAL  27          2HG1      VAL  27  10.083   1.616   7.054
  248   3HG1  VAL  27          3HG1      VAL  27   9.146   1.598   5.541
  249   1HG2  VAL  27          1HG2      VAL  27  12.355   0.160   5.481
  250   2HG2  VAL  27          2HG2      VAL  27  11.755   0.484   3.836
  251   3HG2  VAL  27          3HG2      VAL  27  13.145   1.395   4.472
  252    H    LYS  28           H        LYS  28  12.020   1.476   2.407
  253    HA   LYS  28           HA       LYS  28  14.277   3.177   2.091
  254   1HB   LYS  28          1HB       LYS  28  13.067   0.899   0.517
  255   2HB   LYS  28          2HB       LYS  28  14.472   1.794  -0.111
  256   1HG   LYS  28          1HG       LYS  28  14.343   0.536   2.661
  257   2HG   LYS  28          2HG       LYS  28  15.090  -0.241   1.244
  258   1HD   LYS  28          1HD       LYS  28  16.461   1.956   1.021
  259   2HD   LYS  28          2HD       LYS  28  15.943   2.281   2.693
  260   1HE   LYS  28          1HE       LYS  28  16.743  -0.291   2.965
  261   2HE   LYS  28          2HE       LYS  28  17.810   0.204   1.633
  262   1HZ   LYS  28          1HZ       LYS  28  18.230   2.203   3.140
  263   2HZ   LYS  28          2HZ       LYS  28  17.668   1.232   4.349
  264   3HZ   LYS  28          3HZ       LYS  28  18.986   0.774   3.468
  265    H    VAL  29           H        VAL  29  11.155   2.924   0.378
  266    HA   VAL  29           HA       VAL  29  11.615   4.446  -1.874
  267    HB   VAL  29           HB       VAL  29   9.213   4.497  -0.006
  268   1HG1  VAL  29          1HG1      VAL  29   8.837   6.350  -1.375
  269   2HG1  VAL  29          2HG1      VAL  29   9.756   5.662  -2.734
  270   3HG1  VAL  29          3HG1      VAL  29   8.128   5.048  -2.359
  271   1HG2  VAL  29          1HG2      VAL  29   9.989   2.274  -0.995
  272   2HG2  VAL  29          2HG2      VAL  29   8.331   2.763  -1.421
  273   3HG2  VAL  29          3HG2      VAL  29   9.650   2.967  -2.599
  274    H    GLN  30           H        GLN  30  11.914   5.425   1.423
  275    HA   GLN  30           HA       GLN  30  11.644   8.288   0.752
  276   1HB   GLN  30          1HB       GLN  30  11.270   8.604   2.973
  277   2HB   GLN  30          2HB       GLN  30  10.942   6.854   2.972
  278   1HG   GLN  30          1HG       GLN  30  13.341   6.432   3.496
  279   2HG   GLN  30          2HG       GLN  30  13.618   8.186   3.562
  280   1HE2  GLN  30          1HE2      GLN  30  12.853   9.400   5.325
  281   2HE2  GLN  30          2HE2      GLN  30  12.232   8.649   6.780
  282    H    ARG  31           H        ARG  31  14.059   5.904   1.927
  283    HA   ARG  31           HA       ARG  31  16.334   6.305   2.376
  284   1HB   ARG  31          1HB       ARG  31  15.800   5.475  -0.063
  285   2HB   ARG  31          2HB       ARG  31  16.361   7.098  -0.533
  286   1HG   ARG  31          1HG       ARG  31  18.332   6.435   1.202
  287   2HG   ARG  31          2HG       ARG  31  17.887   4.808   0.635
  288   1HD   ARG  31          1HD       ARG  31  18.375   5.330  -1.618
  289   2HD   ARG  31          2HD       ARG  31  18.324   7.080  -1.317
  290    HE   ARG  31           HE       ARG  31  20.394   6.134   0.279
  291   1HH1  ARG  31          2HH2      ARG  31  19.552   6.080  -3.155
  292   2HH1  ARG  31          1HH2      ARG  31  21.214   6.067  -3.702
  293   1HH2  ARG  31          2HH1      ARG  31  22.589   6.118  -0.444
  294   2HH2  ARG  31          1HH1      ARG  31  22.945   6.089  -2.157
  295    H    GLY  32           H        GLY  32  17.770   8.135   0.310
  296   1HA   GLY  32          1HA       GLY  32  17.941  10.519   0.009
  297   2HA   GLY  32          2HA       GLY  32  17.063  10.752   1.538
  Start of MODEL   13
    1    HA   PRO   1           HA       PRO   1 -15.013  10.733  -3.343
    2   1HB   PRO   1          1HB       PRO   1 -15.340  12.962  -1.810
    3   2HB   PRO   1          2HB       PRO   1 -14.107  12.882  -3.111
    4   1HG   PRO   1          1HG       PRO   1 -16.901  14.046  -3.295
    5   2HG   PRO   1          2HG       PRO   1 -15.359  14.839  -3.755
    6   1HD   PRO   1          1HD       PRO   1 -16.911  13.572  -5.602
    7   2HD   PRO   1          2HD       PRO   1 -15.128  13.432  -5.666
    8    HA   PRO   2           HA       PRO   2 -19.425   9.914  -2.255
    9   1HB   PRO   2          1HB       PRO   2 -19.173   7.217  -1.959
   10   2HB   PRO   2          2HB       PRO   2 -19.284   7.985  -3.577
   11   1HG   PRO   2          1HG       PRO   2 -16.765   7.187  -2.090
   12   2HG   PRO   2          2HG       PRO   2 -17.221   6.752  -3.770
   13   1HD   PRO   2          1HD       PRO   2 -15.590   8.871  -3.243
   14   2HD   PRO   2          2HD       PRO   2 -16.838   8.983  -4.521
   15    H    LEU   3           H        LEU   3 -16.508  10.194  -0.767
   16    HA   LEU   3           HA       LEU   3 -15.949  10.424   1.449
   17   1HB   LEU   3          1HB       LEU   3 -18.792  10.545   1.449
   18   2HB   LEU   3          2HB       LEU   3 -18.319   9.467   2.784
   19    HG   LEU   3           HG       LEU   3 -16.477  11.629   2.816
   20   1HD1  LEU   3          1HD1      LEU   3 -18.275  13.470   3.240
   21   2HD1  LEU   3          2HD1      LEU   3 -17.843  13.088   1.557
   22   3HD1  LEU   3          3HD1      LEU   3 -19.343  12.438   2.260
   23   1HD2  LEU   3          1HD2      LEU   3 -18.050  12.166   4.912
   24   2HD2  LEU   3          2HD2      LEU   3 -18.735  10.577   4.497
   25   3HD2  LEU   3          3HD2      LEU   3 -17.004  10.727   4.884
   26    H    SER   4           H        SER   4 -16.580   7.681  -0.199
   27    HA   SER   4           HA       SER   4 -14.909   5.966   1.038
   28   1HB   SER   4          1HB       SER   4 -16.602   4.565   2.462
   29   2HB   SER   4          2HB       SER   4 -15.859   6.016   3.176
   30    HG   SER   4           HG       SER   4 -18.464   5.511   2.544
   31    H    GLN   5           H        GLN   5 -15.168   3.712   0.375
   32    HA   GLN   5           HA       GLN   5 -16.189   1.996  -0.849
   33   1HB   GLN   5          1HB       GLN   5 -18.374   3.426  -0.494
   34   2HB   GLN   5          2HB       GLN   5 -18.071   3.945  -2.169
   35   1HG   GLN   5          1HG       GLN   5 -18.321   1.783  -3.025
   36   2HG   GLN   5          2HG       GLN   5 -17.952   1.014  -1.465
   37   1HE2  GLN   5          1HE2      GLN   5 -19.896  -0.283  -1.764
   38   2HE2  GLN   5          2HE2      GLN   5 -21.465   0.401  -1.399
   39    H    GLU   6           H        GLU   6 -15.459   5.218  -2.118
   40    HA   GLU   6           HA       GLU   6 -15.116   4.569  -4.840
   41   1HB   GLU   6          1HB       GLU   6 -15.098   6.861  -3.699
   42   2HB   GLU   6          2HB       GLU   6 -13.403   6.523  -3.273
   43   1HG   GLU   6          1HG       GLU   6 -13.957   5.912  -6.078
   44   2HG   GLU   6          2HG       GLU   6 -14.343   7.602  -5.690
   45    H    THR   7           H        THR   7 -12.660   4.664  -2.192
   46    HA   THR   7           HA       THR   7 -10.772   3.230  -3.937
   47    HB   THR   7           HB       THR   7  -9.964   3.665  -1.157
   48    HG1  THR   7           1HG      THR   7 -10.875   5.844  -2.733
   49   1HG2  THR   7          1HG2      THR   7  -8.963   4.863  -3.772
   50   2HG2  THR   7          2HG2      THR   7  -8.057   4.691  -2.250
   51   3HG2  THR   7          3HG2      THR   7  -8.511   3.245  -3.184
   52    H    PHE   8           H        PHE   8 -10.963   2.714  -0.448
   53    HA   PHE   8           HA       PHE   8 -10.528   0.454   0.346
   54   1HB   PHE   8          1HB       PHE   8 -13.519   0.530   0.020
   55   2HB   PHE   8          2HB       PHE   8 -12.556  -0.009   1.406
   56    HD1  PHE   8           1HD      PHE   8 -12.665   3.176  -0.595
   57    HD2  PHE   8           2HD      PHE   8 -12.976   1.307   3.260
   58    HE1  PHE   8           1HE      PHE   8 -12.938   5.403   0.462
   59    HE2  PHE   8           2HE      PHE   8 -13.250   3.533   4.317
   60    HZ   PHE   8           HZ       PHE   8 -13.231   5.581   2.918
   61    H    SER   9           H        SER   9 -13.283   0.304  -1.989
   62    HA   SER   9           HA       SER   9 -13.423  -2.300  -2.595
   63   1HB   SER   9          1HB       SER   9 -14.606  -0.420  -3.771
   64   2HB   SER   9          2HB       SER   9 -13.136  -0.166  -4.743
   65    HG   SER   9           HG       SER   9 -14.238  -2.738  -4.548
   66    H    ASP  10           H        ASP  10 -11.050  -0.175  -4.305
   67    HA   ASP  10           HA       ASP  10  -9.447  -2.611  -4.866
   68   1HB   ASP  10          1HB       ASP  10  -9.986  -0.048  -6.242
   69   2HB   ASP  10          2HB       ASP  10  -8.284  -0.557  -6.268
   70    H    LEU  11           H        LEU  11  -9.593   0.261  -2.931
   71    HA   LEU  11           HA       LEU  11  -6.785   0.675  -2.560
   72   1HB   LEU  11          1HB       LEU  11  -8.979   2.095  -1.944
   73   2HB   LEU  11          2HB       LEU  11  -8.731   1.295  -0.374
   74    HG   LEU  11           HG       LEU  11  -6.902   3.185  -1.864
   75   1HD1  LEU  11          1HD1      LEU  11  -7.594   4.518  -0.183
   76   2HD1  LEU  11          2HD1      LEU  11  -8.510   3.175   0.543
   77   3HD1  LEU  11          3HD1      LEU  11  -6.800   3.419   0.971
   78   1HD2  LEU  11          1HD2      LEU  11  -5.334   1.486  -1.487
   79   2HD2  LEU  11          2HD2      LEU  11  -5.220   2.429   0.019
   80   3HD2  LEU  11          3HD2      LEU  11  -6.158   0.916  -0.015
   81    H    TRP  12           H        TRP  12  -9.163  -0.603  -0.163
   82    HA   TRP  12           HA       TRP  12  -7.306  -1.707   1.589
   83   1HB   TRP  12          1HB       TRP  12  -9.183  -2.243   2.654
   84   2HB   TRP  12          2HB       TRP  12 -10.093  -1.677   1.246
   85    HD1  TRP  12           HD       TRP  12 -11.735  -3.356   0.367
   86    HE1  TRP  12           1HE      TRP  12 -12.010  -5.888   0.337
   87    HE3  TRP  12           3HE      TRP  12  -7.381  -4.669   2.717
   88    HZ2  TRP  12           2HZ      TRP  12 -10.528  -8.210   1.223
   89    HZ3  TRP  12           3HZ      TRP  12  -6.849  -7.047   3.106
   90    HH2  TRP  12           HH       TRP  12  -8.407  -8.826   2.367
   91    H    LYS  13           H        LYS  13  -8.658  -3.054  -1.424
   92    HA   LYS  13           HA       LYS  13  -7.509  -5.669  -1.059
   93   1HB   LYS  13          1HB       LYS  13  -9.449  -4.749  -2.634
   94   2HB   LYS  13          2HB       LYS  13  -8.100  -4.533  -3.775
   95   1HG   LYS  13          1HG       LYS  13  -8.123  -7.126  -2.323
   96   2HG   LYS  13          2HG       LYS  13  -9.476  -6.881  -3.453
   97   1HD   LYS  13          1HD       LYS  13  -7.386  -5.956  -4.957
   98   2HD   LYS  13          2HD       LYS  13  -6.572  -7.217  -4.000
   99   1HE   LYS  13          1HE       LYS  13  -7.540  -8.838  -5.222
  100   2HE   LYS  13          2HE       LYS  13  -9.155  -8.175  -4.890
  101   1HZ   LYS  13          1HZ       LYS  13  -9.151  -7.040  -6.802
  102   2HZ   LYS  13          2HZ       LYS  13  -7.517  -6.821  -6.846
  103   3HZ   LYS  13          3HZ       LYS  13  -8.167  -8.275  -7.276
  104    H    LEU  14           H        LEU  14  -6.423  -2.593  -2.446
  105    HA   LEU  14           HA       LEU  14  -4.221  -3.560  -3.937
  106   1HB   LEU  14          1HB       LEU  14  -5.274  -1.021  -2.995
  107   2HB   LEU  14          2HB       LEU  14  -3.500  -1.058  -2.855
  108    HG   LEU  14           HG       LEU  14  -4.723  -0.380  -5.147
  109   1HD1  LEU  14          1HD1      LEU  14  -2.646  -1.643  -6.262
  110   2HD1  LEU  14          2HD1      LEU  14  -2.411  -0.236  -5.198
  111   3HD1  LEU  14          3HD1      LEU  14  -2.188  -1.883  -4.559
  112   1HD2  LEU  14          1HD2      LEU  14  -5.542  -2.095  -6.382
  113   2HD2  LEU  14          2HD2      LEU  14  -4.159  -3.144  -5.985
  114   3HD2  LEU  14          3HD2      LEU  14  -5.539  -3.028  -4.866
  115    H    LEU  15           H        LEU  15  -4.506  -2.525  -0.507
  116    HA   LEU  15           HA       LEU  15  -1.735  -2.951   0.094
  117   1HB   LEU  15          1HB       LEU  15  -4.271  -2.628   1.708
  118   2HB   LEU  15          2HB       LEU  15  -2.727  -3.025   2.499
  119    HG   LEU  15           HG       LEU  15  -3.032  -0.704   0.558
  120   1HD1  LEU  15          1HD1      LEU  15  -4.557  -0.466   2.545
  121   2HD1  LEU  15          2HD1      LEU  15  -3.134  -0.628   3.603
  122   3HD1  LEU  15          3HD1      LEU  15  -3.266   0.759   2.495
  123   1HD2  LEU  15          1HD2      LEU  15  -1.049  -0.375   2.612
  124   2HD2  LEU  15          2HD2      LEU  15  -0.838  -1.988   1.889
  125   3HD2  LEU  15          3HD2      LEU  15  -0.805  -0.539   0.856
  126    H    LYS  16           H        LYS  16  -4.252  -5.100  -0.650
  127    HA   LYS  16           HA       LYS  16  -3.503  -7.237   1.163
  128   1HB   LYS  16          1HB       LYS  16  -5.670  -6.654  -0.490
  129   2HB   LYS  16          2HB       LYS  16  -4.876  -8.021  -1.306
  130   1HG   LYS  16          1HG       LYS  16  -4.756  -8.819   1.322
  131   2HG   LYS  16          2HG       LYS  16  -6.295  -7.924   1.299
  132   1HD   LYS  16          1HD       LYS  16  -6.855 -10.170   0.702
  133   2HD   LYS  16          2HD       LYS  16  -6.859  -9.258  -0.827
  134   1HE   LYS  16          1HE       LYS  16  -4.657 -10.069  -1.399
  135   2HE   LYS  16          2HE       LYS  16  -4.447 -10.794   0.209
  136   1HZ   LYS  16          1HZ       LYS  16  -5.519 -12.573  -0.440
  137   2HZ   LYS  16          2HZ       LYS  16  -6.774 -11.720  -1.086
  138   3HZ   LYS  16          3HZ       LYS  16  -5.426 -12.015  -1.989
  139    H    LYS  17           H        LYS  17  -1.600  -5.824  -0.942
  140    HA   LYS  17           HA       LYS  17  -0.036  -8.201  -1.436
  141   1HB   LYS  17          1HB       LYS  17  -1.058  -8.745  -3.387
  142   2HB   LYS  17          2HB       LYS  17  -1.844  -7.154  -3.531
  143   1HG   LYS  17          1HG       LYS  17   1.118  -7.641  -4.048
  144   2HG   LYS  17          2HG       LYS  17  -0.122  -7.620  -5.324
  145   1HD   LYS  17          1HD       LYS  17  -0.617  -5.294  -3.832
  146   2HD   LYS  17          2HD       LYS  17   1.157  -5.384  -3.936
  147   1HE   LYS  17          1HE       LYS  17   0.405  -6.083  -6.493
  148   2HE   LYS  17          2HE       LYS  17  -0.849  -4.901  -6.058
  149   1HZ   LYS  17          1HZ       LYS  17   1.241  -3.625  -5.226
  150   2HZ   LYS  17          2HZ       LYS  17   1.997  -4.533  -6.376
  151   3HZ   LYS  17          3HZ       LYS  17   0.747  -3.543  -6.797
  152    H    TRP  18           H        TRP  18  -0.718  -4.761  -2.082
  153    HA   TRP  18           HA       TRP  18   2.004  -4.141  -2.828
  154   1HB   TRP  18          1HB       TRP  18  -0.356  -2.915  -3.182
  155   2HB   TRP  18          2HB       TRP  18   0.161  -2.076  -1.713
  156    HD1  TRP  18           HD       TRP  18   0.352  -1.814  -5.325
  157    HE1  TRP  18           1HE      TRP  18   2.148  -0.183  -6.099
  158    HE3  TRP  18           3HE      TRP  18   2.943  -1.326  -0.938
  159    HZ2  TRP  18           2HZ      TRP  18   4.436   1.176  -4.961
  160    HZ3  TRP  18           3HZ      TRP  18   4.922   0.143  -0.822
  161    HH2  TRP  18           HH       TRP  18   5.680   1.397  -2.819
  162    H    LYS  19           H        LYS  19   0.034  -3.863   0.159
  163    HA   LYS  19           HA       LYS  19   1.585  -2.446   1.855
  164   1HB   LYS  19          1HB       LYS  19  -0.482  -3.676   2.478
  165   2HB   LYS  19          2HB       LYS  19   0.442  -5.198   2.478
  166   1HG   LYS  19          1HG       LYS  19   1.858  -4.419   4.279
  167   2HG   LYS  19          2HG       LYS  19   1.172  -2.779   4.179
  168   1HD   LYS  19          1HD       LYS  19  -0.230  -3.490   5.826
  169   2HD   LYS  19          2HD       LYS  19  -1.092  -4.321   4.508
  170   1HE   LYS  19          1HE       LYS  19   0.169  -6.363   4.898
  171   2HE   LYS  19          2HE       LYS  19   1.200  -5.546   6.093
  172   1HZ   LYS  19          1HZ       LYS  19  -0.335  -6.598   7.366
  173   2HZ   LYS  19          2HZ       LYS  19  -1.019  -5.103   7.236
  174   3HZ   LYS  19          3HZ       LYS  19  -1.585  -6.352   6.319
  175    H    MET  20           H        MET  20   2.265  -5.802   0.782
  176    HA   MET  20           HA       MET  20   4.323  -6.623   2.302
  177   1HB   MET  20          1HB       MET  20   4.190  -8.079   0.577
  178   2HB   MET  20          2HB       MET  20   3.661  -6.816  -0.560
  179   1HG   MET  20          1HG       MET  20   6.326  -6.178   0.049
  180   2HG   MET  20          2HG       MET  20   6.318  -7.941  -0.125
  181   1HE   MET  20          1HE       MET  20   4.076  -5.329  -1.530
  182   2HE   MET  20          2HE       MET  20   5.424  -4.477  -2.321
  183   3HE   MET  20          3HE       MET  20   4.255  -5.396  -3.299
  184    H    ARG  21           H        ARG  21   4.585  -4.079  -0.221
  185    HA   ARG  21           HA       ARG  21   7.354  -3.529   0.655
  186   1HB   ARG  21          1HB       ARG  21   5.635  -2.734  -1.701
  187   2HB   ARG  21          2HB       ARG  21   7.116  -1.829  -1.306
  188   1HG   ARG  21          1HG       ARG  21   8.504  -3.694  -1.675
  189   2HG   ARG  21          2HG       ARG  21   7.164  -4.850  -1.483
  190   1HD   ARG  21          1HD       ARG  21   6.236  -3.406  -3.588
  191   2HD   ARG  21          2HD       ARG  21   7.985  -3.247  -3.861
  192    HE   ARG  21           HE       ARG  21   6.372  -5.612  -4.242
  193   1HH1  ARG  21          2HH2      ARG  21   9.571  -4.441  -3.297
  194   2HH1  ARG  21          1HH2      ARG  21  10.402  -5.899  -3.790
  195   1HH2  ARG  21          2HH1      ARG  21   7.470  -7.539  -4.894
  196   2HH2  ARG  21          1HH1      ARG  21   9.203  -7.666  -4.700
  197    H    ARG  22           H        ARG  22   4.145  -1.943   0.336
  198    HA   ARG  22           HA       ARG  22   4.981   0.564   1.419
  199   1HB   ARG  22          1HB       ARG  22   2.901   0.119   0.065
  200   2HB   ARG  22          2HB       ARG  22   2.212  -0.692   1.492
  201   1HG   ARG  22          1HG       ARG  22   1.473   1.367   2.095
  202   2HG   ARG  22          2HG       ARG  22   3.164   1.698   2.540
  203   1HD   ARG  22          1HD       ARG  22   1.777   2.318  -0.093
  204   2HD   ARG  22          2HD       ARG  22   2.455   3.474   1.074
  205    HE   ARG  22           HE       ARG  22   4.452   1.623   0.099
  206   1HH1  ARG  22          2HH2      ARG  22   2.623   4.553  -0.660
  207   2HH1  ARG  22          1HH2      ARG  22   3.838   5.196  -1.741
  208   1HH2  ARG  22          2HH1      ARG  22   6.057   2.473  -1.330
  209   2HH2  ARG  22          1HH1      ARG  22   5.796   4.010  -2.123
  210    H    ASN  23           H        ASN  23   5.570  -2.122   2.898
  211    HA   ASN  23           HA       ASN  23   4.963  -1.012   5.564
  212   1HB   ASN  23          1HB       ASN  23   3.372  -3.015   4.470
  213   2HB   ASN  23          2HB       ASN  23   4.551  -3.914   5.449
  214   1HD2  ASN  23          1HD2      ASN  23   2.105  -1.311   5.512
  215   2HD2  ASN  23          2HD2      ASN  23   1.789  -1.395   7.232
  216    H    GLN  24           H        GLN  24   7.251  -1.737   3.518
  217    HA   GLN  24           HA       GLN  24   9.190  -2.367   5.538
  218   1HB   GLN  24          1HB       GLN  24   8.206  -4.561   3.707
  219   2HB   GLN  24          2HB       GLN  24   9.888  -4.548   4.288
  220   1HG   GLN  24          1HG       GLN  24   8.582  -4.047   6.618
  221   2HG   GLN  24          2HG       GLN  24   7.349  -5.016   5.781
  222   1HE2  GLN  24          1HE2      GLN  24   7.984  -7.157   4.948
  223   2HE2  GLN  24          2HE2      GLN  24   9.243  -8.052   5.772
  224    H    PHE  25           H        PHE  25   9.645  -3.799   2.388
  225    HA   PHE  25           HA       PHE  25  11.913  -2.567   1.628
  226   1HB   PHE  25          1HB       PHE  25  11.151  -4.114   0.102
  227   2HB   PHE  25          2HB       PHE  25   9.501  -3.469   0.104
  228    HD1  PHE  25           1HD      PHE  25   9.388  -0.913  -0.802
  229    HD2  PHE  25           2HD      PHE  25  12.374  -3.823  -1.834
  230    HE1  PHE  25           1HE      PHE  25   9.866   0.322  -2.899
  231    HE2  PHE  25           2HE      PHE  25  12.853  -2.588  -3.930
  232    HZ   PHE  25           HZ       PHE  25  11.599  -0.516  -4.463
  233    H    TRP  26           H        TRP  26   8.655  -1.112   1.489
  234    HA   TRP  26           HA       TRP  26   9.249   1.194   0.016
  235   1HB   TRP  26          1HB       TRP  26   7.240   2.011   0.803
  236   2HB   TRP  26          2HB       TRP  26   7.032   0.269   1.029
  237    HD1  TRP  26           HD       TRP  26   6.594  -0.594   3.406
  238    HE1  TRP  26           1HE      TRP  26   6.280   0.464   5.701
  239    HE3  TRP  26           3HE      TRP  26   8.142   4.162   2.319
  240    HZ2  TRP  26           2HZ      TRP  26   6.651   3.060   6.927
  241    HZ3  TRP  26           3HZ      TRP  26   8.147   5.897   4.074
  242    HH2  TRP  26           HH       TRP  26   7.407   5.364   6.377
  243    H    VAL  27           H        VAL  27   9.657   0.533   3.520
  244    HA   VAL  27           HA       VAL  27  10.302   2.917   4.597
  245    HB   VAL  27           HB       VAL  27  11.852   1.769   6.057
  246   1HG1  VAL  27          1HG1      VAL  27  10.337  -0.638   5.720
  247   2HG1  VAL  27          2HG1      VAL  27  10.072   0.673   6.895
  248   3HG1  VAL  27          3HG1      VAL  27   9.277   0.730   5.303
  249   1HG2  VAL  27          1HG2      VAL  27  12.395  -0.707   5.316
  250   2HG2  VAL  27          2HG2      VAL  27  12.094  -0.075   3.679
  251   3HG2  VAL  27          3HG2      VAL  27  13.376   0.639   4.687
  252    H    LYS  28           H        LYS  28  12.405   1.050   2.372
  253    HA   LYS  28           HA       LYS  28  14.566   2.955   2.491
  254   1HB   LYS  28          1HB       LYS  28  13.851   0.507   0.943
  255   2HB   LYS  28          2HB       LYS  28  14.993   1.634   0.172
  256   1HG   LYS  28          1HG       LYS  28  15.281   0.554   3.008
  257   2HG   LYS  28          2HG       LYS  28  16.125  -0.107   1.587
  258   1HD   LYS  28          1HD       LYS  28  17.728   1.454   1.862
  259   2HD   LYS  28          2HD       LYS  28  16.516   2.713   1.529
  260   1HE   LYS  28          1HE       LYS  28  17.176   3.358   3.650
  261   2HE   LYS  28          2HE       LYS  28  15.850   2.252   4.068
  262   1HZ   LYS  28          1HZ       LYS  28  18.140   2.017   5.166
  263   2HZ   LYS  28          2HZ       LYS  28  17.297   0.669   4.729
  264   3HZ   LYS  28          3HZ       LYS  28  18.542   1.203   3.790
  265    H    VAL  29           H        VAL  29  11.742   2.423   0.370
  266    HA   VAL  29           HA       VAL  29  12.326   4.076  -1.762
  267    HB   VAL  29           HB       VAL  29  10.206   2.677  -1.198
  268   1HG1  VAL  29          1HG1      VAL  29   8.654   5.016  -0.554
  269   2HG1  VAL  29          2HG1      VAL  29   8.811   3.501   0.367
  270   3HG1  VAL  29          3HG1      VAL  29   9.947   4.841   0.657
  271   1HG2  VAL  29          1HG2      VAL  29  10.408   3.784  -3.321
  272   2HG2  VAL  29          2HG2      VAL  29   8.817   4.242  -2.667
  273   3HG2  VAL  29          3HG2      VAL  29  10.177   5.386  -2.581
  274    H    GLN  30           H        GLN  30  12.082   4.945   1.561
  275    HA   GLN  30           HA       GLN  30  11.548   7.783   0.930
  276   1HB   GLN  30          1HB       GLN  30  10.832   7.962   3.082
  277   2HB   GLN  30          2HB       GLN  30  10.720   6.188   2.991
  278   1HG   GLN  30          1HG       GLN  30  13.088   6.053   3.815
  279   2HG   GLN  30          2HG       GLN  30  13.074   7.817   4.027
  280   1HE2  GLN  30          1HE2      GLN  30  13.590   6.154   6.199
  281   2HE2  GLN  30          2HE2      GLN  30  12.239   6.206   7.311
  282    H    ARG  31           H        ARG  31  14.052   5.633   2.334
  283    HA   ARG  31           HA       ARG  31  16.190   6.229   3.089
  284   1HB   ARG  31          1HB       ARG  31  16.493   5.404   0.832
  285   2HB   ARG  31          2HB       ARG  31  16.064   6.990   0.147
  286   1HG   ARG  31          1HG       ARG  31  18.463   6.866   0.116
  287   2HG   ARG  31          2HG       ARG  31  18.035   7.950   1.461
  288   1HD   ARG  31          1HD       ARG  31  18.323   4.999   1.990
  289   2HD   ARG  31          2HD       ARG  31  19.789   5.987   1.809
  290    HE   ARG  31           HE       ARG  31  17.959   5.965   4.055
  291   1HH1  ARG  31          2HH2      ARG  31  20.202   7.944   2.169
  292   2HH1  ARG  31          1HH2      ARG  31  20.564   9.034   3.488
  293   1HH2  ARG  31          2HH1      ARG  31  18.438   7.406   5.797
  294   2HH2  ARG  31          1HH1      ARG  31  19.558   8.727   5.557
  295    H    GLY  32           H        GLY  32  15.772   7.918   4.606
  296   1HA   GLY  32          1HA       GLY  32  16.673  10.559   3.611
  297   2HA   GLY  32          2HA       GLY  32  15.139  10.461   4.506
  Start of MODEL   14
    1    HA   PRO   1           HA       PRO   1 -20.805   7.627  -4.647
    2   1HB   PRO   1          1HB       PRO   1 -18.142   7.764  -5.210
    3   2HB   PRO   1          2HB       PRO   1 -19.365   7.470  -6.489
    4   1HG   PRO   1          1HG       PRO   1 -18.124  10.124  -5.706
    5   2HG   PRO   1          2HG       PRO   1 -18.225   9.412  -7.350
    6   1HD   PRO   1          1HD       PRO   1 -20.065  11.219  -6.469
    7   2HD   PRO   1          2HD       PRO   1 -20.573   9.812  -7.452
    8    HA   PRO   2           HA       PRO   2 -19.708   9.417  -0.725
    9   1HB   PRO   2          1HB       PRO   2 -19.621   7.111   0.724
   10   2HB   PRO   2          2HB       PRO   2 -21.162   7.764   0.077
   11   1HG   PRO   2          1HG       PRO   2 -19.395   5.644  -1.176
   12   2HG   PRO   2          2HG       PRO   2 -21.156   5.539  -0.850
   13   1HD   PRO   2          1HD       PRO   2 -20.204   6.270  -3.298
   14   2HD   PRO   2          2HD       PRO   2 -21.639   7.083  -2.602
   15    H    LEU   3           H        LEU   3 -18.035   8.199   1.109
   16    HA   LEU   3           HA       LEU   3 -15.485   7.957  -0.418
   17   1HB   LEU   3          1HB       LEU   3 -16.066   9.218   2.289
   18   2HB   LEU   3          2HB       LEU   3 -14.433   8.953   1.632
   19    HG   LEU   3           HG       LEU   3 -15.775  10.185  -0.475
   20   1HD1  LEU   3          1HD1      LEU   3 -16.521  12.318   0.987
   21   2HD1  LEU   3          2HD1      LEU   3 -17.659  11.015   0.570
   22   3HD1  LEU   3          3HD1      LEU   3 -16.887  11.043   2.174
   23   1HD2  LEU   3          1HD2      LEU   3 -13.446  10.525   0.685
   24   2HD2  LEU   3          2HD2      LEU   3 -14.206  11.903  -0.147
   25   3HD2  LEU   3          3HD2      LEU   3 -14.292  11.776   1.627
   26    H    SER   4           H        SER   4 -17.334   5.788   0.293
   27    HA   SER   4           HA       SER   4 -15.493   4.279   2.081
   28   1HB   SER   4          1HB       SER   4 -18.521   4.433   2.136
   29   2HB   SER   4          2HB       SER   4 -17.625   3.069   2.848
   30    HG   SER   4           HG       SER   4 -17.473   4.349   4.501
   31    H    GLN   5           H        GLN   5 -15.963   4.609  -0.940
   32    HA   GLN   5           HA       GLN   5 -15.947   1.718  -1.497
   33   1HB   GLN   5          1HB       GLN   5 -17.611   1.921  -3.282
   34   2HB   GLN   5          2HB       GLN   5 -18.323   2.419  -1.728
   35   1HG   GLN   5          1HG       GLN   5 -19.003   4.162  -3.117
   36   2HG   GLN   5          2HG       GLN   5 -17.492   4.817  -2.450
   37   1HE2  GLN   5          1HE2      GLN   5 -16.792   6.097  -4.125
   38   2HE2  GLN   5          2HE2      GLN   5 -16.425   5.496  -5.728
   39    H    GLU   6           H        GLU   6 -15.757   5.073  -2.774
   40    HA   GLU   6           HA       GLU   6 -14.541   4.753  -5.182
   41   1HB   GLU   6          1HB       GLU   6 -13.027   6.768  -4.298
   42   2HB   GLU   6          2HB       GLU   6 -14.770   6.970  -4.591
   43   1HG   GLU   6          1HG       GLU   6 -15.251   7.159  -2.373
   44   2HG   GLU   6          2HG       GLU   6 -14.073   5.912  -1.911
   45    H    THR   7           H        THR   7 -12.831   4.629  -2.008
   46    HA   THR   7           HA       THR   7 -10.470   3.517  -3.410
   47    HB   THR   7           HB       THR   7 -10.164   3.850  -0.548
   48    HG1  THR   7           1HG      THR   7 -11.245   5.997  -2.049
   49   1HG2  THR   7          1HG2      THR   7  -8.990   5.590  -2.732
   50   2HG2  THR   7          2HG2      THR   7  -8.235   5.036  -1.218
   51   3HG2  THR   7          3HG2      THR   7  -8.496   3.889  -2.554
   52    H    PHE   8           H        PHE   8 -11.132   2.821  -0.039
   53    HA   PHE   8           HA       PHE   8 -10.630   0.493   0.616
   54   1HB   PHE   8          1HB       PHE   8 -13.616   0.665   0.226
   55   2HB   PHE   8          2HB       PHE   8 -12.707  -0.047   1.570
   56    HD1  PHE   8           1HD      PHE   8 -12.794   3.320  -0.115
   57    HD2  PHE   8           2HD      PHE   8 -12.986   1.095   3.555
   58    HE1  PHE   8           1HE      PHE   8 -13.015   5.438   1.157
   59    HE2  PHE   8           2HE      PHE   8 -13.208   3.213   4.827
   60    HZ   PHE   8           HZ       PHE   8 -13.223   5.384   3.628
   61    H    SER   9           H        SER   9 -13.291   0.555  -1.830
   62    HA   SER   9           HA       SER   9 -13.455  -2.022  -2.586
   63   1HB   SER   9          1HB       SER   9 -14.497   0.084  -3.652
   64   2HB   SER   9          2HB       SER   9 -13.054   0.116  -4.695
   65    HG   SER   9           HG       SER   9 -14.229  -2.355  -4.452
   66    H    ASP  10           H        ASP  10 -10.979   0.201  -3.995
   67    HA   ASP  10           HA       ASP  10  -9.376  -2.218  -4.660
   68   1HB   ASP  10          1HB       ASP  10  -9.982   0.309  -6.032
   69   2HB   ASP  10          2HB       ASP  10  -8.244  -0.055  -5.978
   70    H    LEU  11           H        LEU  11  -9.596   0.595  -2.658
   71    HA   LEU  11           HA       LEU  11  -6.806   1.070  -2.246
   72   1HB   LEU  11          1HB       LEU  11  -8.926   2.496  -1.647
   73   2HB   LEU  11          2HB       LEU  11  -8.915   1.546  -0.142
   74    HG   LEU  11           HG       LEU  11  -6.938   3.565  -1.149
   75   1HD1  LEU  11          1HD1      LEU  11  -7.604   4.541   0.769
   76   2HD1  LEU  11          2HD1      LEU  11  -8.675   3.157   1.093
   77   3HD1  LEU  11          3HD1      LEU  11  -7.001   3.147   1.697
   78   1HD2  LEU  11          1HD2      LEU  11  -5.531   1.595  -1.083
   79   2HD2  LEU  11          2HD2      LEU  11  -5.213   2.534   0.396
   80   3HD2  LEU  11          3HD2      LEU  11  -6.237   1.081   0.468
   81    H    TRP  12           H        TRP  12  -9.150  -0.331   0.114
   82    HA   TRP  12           HA       TRP  12  -7.272  -1.451   1.826
   83   1HB   TRP  12          1HB       TRP  12  -9.134  -2.078   2.870
   84   2HB   TRP  12          2HB       TRP  12 -10.056  -1.473   1.486
   85    HD1  TRP  12           HD       TRP  12 -11.655  -3.148   0.519
   86    HE1  TRP  12           1HE      TRP  12 -11.883  -5.681   0.393
   87    HE3  TRP  12           3HE      TRP  12  -7.299  -4.468   2.860
   88    HZ2  TRP  12           2HZ      TRP  12 -10.366  -8.008   1.206
   89    HZ3  TRP  12           3HZ      TRP  12  -6.726  -6.849   3.165
   90    HH2  TRP  12           HH       TRP  12  -8.244  -8.627   2.346
   91    H    LYS  13           H        LYS  13  -8.557  -2.711  -1.248
   92    HA   LYS  13           HA       LYS  13  -7.350  -5.315  -0.958
   93   1HB   LYS  13          1HB       LYS  13  -9.306  -4.351  -2.521
   94   2HB   LYS  13          2HB       LYS  13  -7.945  -4.152  -3.651
   95   1HG   LYS  13          1HG       LYS  13  -7.520  -6.684  -2.552
   96   2HG   LYS  13          2HG       LYS  13  -9.287  -6.604  -2.749
   97   1HD   LYS  13          1HD       LYS  13  -7.361  -5.790  -4.954
   98   2HD   LYS  13          2HD       LYS  13  -7.958  -7.456  -4.774
   99   1HE   LYS  13          1HE       LYS  13  -9.489  -6.477  -6.279
  100   2HE   LYS  13          2HE       LYS  13 -10.321  -6.385  -4.711
  101   1HZ   LYS  13          1HZ       LYS  13  -9.791  -4.148  -4.533
  102   2HZ   LYS  13          2HZ       LYS  13  -8.705  -4.189  -5.774
  103   3HZ   LYS  13          3HZ       LYS  13 -10.318  -4.337  -6.085
  104    H    LEU  14           H        LEU  14  -6.343  -2.164  -2.219
  105    HA   LEU  14           HA       LEU  14  -4.136  -2.988  -3.772
  106   1HB   LEU  14          1HB       LEU  14  -5.254  -0.550  -2.733
  107   2HB   LEU  14          2HB       LEU  14  -3.497  -0.546  -2.443
  108    HG   LEU  14           HG       LEU  14  -4.469   0.295  -4.761
  109   1HD1  LEU  14          1HD1      LEU  14  -2.377  -0.349  -5.815
  110   2HD1  LEU  14          2HD1      LEU  14  -2.055  -0.022  -4.096
  111   3HD1  LEU  14          3HD1      LEU  14  -2.169  -1.701  -4.676
  112   1HD2  LEU  14          1HD2      LEU  14  -5.393  -2.355  -4.739
  113   2HD2  LEU  14          2HD2      LEU  14  -5.329  -1.270  -6.148
  114   3HD2  LEU  14          3HD2      LEU  14  -3.982  -2.389  -5.824
  115    H    LEU  15           H        LEU  15  -4.395  -2.195  -0.275
  116    HA   LEU  15           HA       LEU  15  -1.607  -2.654   0.252
  117   1HB   LEU  15          1HB       LEU  15  -3.969  -1.804   1.669
  118   2HB   LEU  15          2HB       LEU  15  -3.160  -3.087   2.599
  119    HG   LEU  15           HG       LEU  15  -0.969  -1.747   2.028
  120   1HD1  LEU  15          1HD1      LEU  15  -1.281   0.164   0.875
  121   2HD1  LEU  15          2HD1      LEU  15  -3.044  -0.081   0.898
  122   3HD1  LEU  15          3HD1      LEU  15  -2.249   0.790   2.231
  123   1HD2  LEU  15          1HD2      LEU  15  -1.174  -0.569   4.109
  124   2HD2  LEU  15          2HD2      LEU  15  -2.947  -0.491   3.967
  125   3HD2  LEU  15          3HD2      LEU  15  -2.147  -2.050   4.279
  126    H    LYS  16           H        LYS  16  -4.122  -4.744  -0.597
  127    HA   LYS  16           HA       LYS  16  -3.417  -6.973   1.113
  128   1HB   LYS  16          1HB       LYS  16  -5.596  -6.335  -0.385
  129   2HB   LYS  16          2HB       LYS  16  -4.771  -7.461  -1.489
  130   1HG   LYS  16          1HG       LYS  16  -4.568  -9.079   0.444
  131   2HG   LYS  16          2HG       LYS  16  -5.594  -7.980   1.397
  132   1HD   LYS  16          1HD       LYS  16  -7.478  -8.362   0.051
  133   2HD   LYS  16          2HD       LYS  16  -6.500  -8.907  -1.333
  134   1HE   LYS  16          1HE       LYS  16  -6.618 -10.428   1.294
  135   2HE   LYS  16          2HE       LYS  16  -7.755 -10.731  -0.038
  136   1HZ   LYS  16          1HZ       LYS  16  -4.842 -11.041  -0.074
  137   2HZ   LYS  16          2HZ       LYS  16  -5.985 -12.216  -0.247
  138   3HZ   LYS  16          3HZ       LYS  16  -5.774 -11.090  -1.433
  139    H    LYS  17           H        LYS  17  -1.468  -5.465  -0.887
  140    HA   LYS  17           HA       LYS  17   0.103  -7.820  -1.458
  141   1HB   LYS  17          1HB       LYS  17  -0.875  -8.276  -3.452
  142   2HB   LYS  17          2HB       LYS  17  -1.670  -6.686  -3.535
  143   1HG   LYS  17          1HG       LYS  17   1.304  -7.132  -4.026
  144   2HG   LYS  17          2HG       LYS  17   0.083  -7.052  -5.318
  145   1HD   LYS  17          1HD       LYS  17  -0.445  -4.806  -3.719
  146   2HD   LYS  17          2HD       LYS  17   1.331  -4.883  -3.802
  147   1HE   LYS  17          1HE       LYS  17   0.535  -3.580  -5.688
  148   2HE   LYS  17          2HE       LYS  17   1.144  -5.135  -6.295
  149   1HZ   LYS  17          1HZ       LYS  17  -1.334  -4.058  -6.680
  150   2HZ   LYS  17          2HZ       LYS  17  -0.822  -5.568  -7.101
  151   3HZ   LYS  17          3HZ       LYS  17  -1.569  -5.325  -5.651
  152    H    TRP  18           H        TRP  18  -0.565  -4.353  -1.963
  153    HA   TRP  18           HA       TRP  18   2.170  -3.704  -2.631
  154   1HB   TRP  18          1HB       TRP  18  -0.188  -2.461  -2.963
  155   2HB   TRP  18          2HB       TRP  18   0.316  -1.686  -1.454
  156    HD1  TRP  18           HD       TRP  18   0.573  -1.308  -5.063
  157    HE1  TRP  18           1HE      TRP  18   2.373   0.360  -5.745
  158    HE3  TRP  18           3HE      TRP  18   3.054  -0.931  -0.602
  159    HZ2  TRP  18           2HZ      TRP  18   4.622   1.701  -4.512
  160    HZ3  TRP  18           3HZ      TRP  18   5.017   0.550  -0.395
  161    HH2  TRP  18           HH       TRP  18   5.813   1.869  -2.335
  162    H    LYS  19           H        LYS  19   0.151  -3.582   0.332
  163    HA   LYS  19           HA       LYS  19   1.668  -2.239   2.120
  164   1HB   LYS  19          1HB       LYS  19  -0.404  -3.502   2.649
  165   2HB   LYS  19          2HB       LYS  19   0.523  -5.020   2.589
  166   1HG   LYS  19          1HG       LYS  19   1.910  -4.328   4.448
  167   2HG   LYS  19          2HG       LYS  19   1.220  -2.688   4.419
  168   1HD   LYS  19          1HD       LYS  19  -0.037  -3.648   6.127
  169   2HD   LYS  19          2HD       LYS  19  -1.071  -4.003   4.723
  170   1HE   LYS  19          1HE       LYS  19   1.091  -5.934   5.593
  171   2HE   LYS  19          2HE       LYS  19  -0.504  -5.940   6.376
  172   1HZ   LYS  19          1HZ       LYS  19  -1.306  -6.011   3.955
  173   2HZ   LYS  19          2HZ       LYS  19   0.202  -6.600   3.639
  174   3HZ   LYS  19          3HZ       LYS  19  -0.790  -7.394   4.691
  175    H    MET  20           H        MET  20   2.364  -5.558   0.936
  176    HA   MET  20           HA       MET  20   4.423  -6.400   2.457
  177   1HB   MET  20          1HB       MET  20   4.307  -7.845   0.726
  178   2HB   MET  20          2HB       MET  20   3.732  -6.585  -0.392
  179   1HG   MET  20          1HG       MET  20   6.405  -5.914   0.184
  180   2HG   MET  20          2HG       MET  20   6.410  -7.672  -0.036
  181   1HE   MET  20          1HE       MET  20   4.313  -5.029  -3.132
  182   2HE   MET  20          2HE       MET  20   4.057  -5.093  -1.372
  183   3HE   MET  20          3HE       MET  20   5.420  -4.163  -2.040
  184    H    ARG  21           H        ARG  21   4.674  -3.835  -0.043
  185    HA   ARG  21           HA       ARG  21   7.451  -3.299   0.806
  186   1HB   ARG  21          1HB       ARG  21   5.689  -2.428  -1.494
  187   2HB   ARG  21          2HB       ARG  21   7.197  -1.563  -1.111
  188   1HG   ARG  21          1HG       ARG  21   8.540  -3.416  -1.600
  189   2HG   ARG  21          2HG       ARG  21   7.216  -4.574  -1.332
  190   1HD   ARG  21          1HD       ARG  21   6.143  -3.190  -3.376
  191   2HD   ARG  21          2HD       ARG  21   7.860  -2.920  -3.744
  192    HE   ARG  21           HE       ARG  21   7.672  -5.641  -3.259
  193   1HH1  ARG  21          2HH2      ARG  21   6.114  -3.319  -5.422
  194   2HH1  ARG  21          1HH2      ARG  21   5.843  -4.484  -6.699
  195   1HH2  ARG  21          2HH1      ARG  21   7.313  -7.180  -4.945
  196   2HH2  ARG  21          1HH1      ARG  21   6.526  -6.685  -6.427
  197    H    ARG  22           H        ARG  22   4.234  -1.715   0.602
  198    HA   ARG  22           HA       ARG  22   5.086   0.775   1.708
  199   1HB   ARG  22          1HB       ARG  22   3.001   0.518   0.440
  200   2HB   ARG  22          2HB       ARG  22   2.361  -0.582   1.684
  201   1HG   ARG  22          1HG       ARG  22   1.686   1.944   1.777
  202   2HG   ARG  22          2HG       ARG  22   2.176   1.137   3.286
  203   1HD   ARG  22          1HD       ARG  22   3.239   3.421   2.836
  204   2HD   ARG  22          2HD       ARG  22   4.361   2.094   3.205
  205    HE   ARG  22           HE       ARG  22   5.280   2.351   1.110
  206   1HH1  ARG  22          2HH2      ARG  22   2.017   3.712   1.156
  207   2HH1  ARG  22          1HH2      ARG  22   2.110   4.343  -0.474
  208   1HH2  ARG  22          2HH1      ARG  22   5.402   3.184  -1.042
  209   2HH2  ARG  22          1HH1      ARG  22   4.040   4.041  -1.726
  210    H    ASN  23           H        ASN  23   5.762  -1.919   3.118
  211    HA   ASN  23           HA       ASN  23   5.214  -0.872   5.822
  212   1HB   ASN  23          1HB       ASN  23   3.627  -2.878   4.745
  213   2HB   ASN  23          2HB       ASN  23   4.863  -3.783   5.645
  214   1HD2  ASN  23          1HD2      ASN  23   2.747  -0.877   6.006
  215   2HD2  ASN  23          2HD2      ASN  23   2.363  -1.158   7.691
  216    H    GLN  24           H        GLN  24   7.452  -1.517   3.688
  217    HA   GLN  24           HA       GLN  24   9.471  -2.124   5.634
  218   1HB   GLN  24          1HB       GLN  24   8.470  -4.325   3.820
  219   2HB   GLN  24          2HB       GLN  24  10.171  -4.280   4.342
  220   1HG   GLN  24          1HG       GLN  24   8.936  -3.824   6.720
  221   2HG   GLN  24          2HG       GLN  24   7.697  -4.815   5.919
  222   1HE2  GLN  24          1HE2      GLN  24   8.788  -6.759   4.611
  223   2HE2  GLN  24          2HE2      GLN  24   9.926  -7.699   5.552
  224    H    PHE  25           H        PHE  25   9.850  -3.523   2.460
  225    HA   PHE  25           HA       PHE  25  12.064  -2.236   1.634
  226   1HB   PHE  25          1HB       PHE  25  11.180  -3.851   0.190
  227   2HB   PHE  25          2HB       PHE  25   9.595  -3.062   0.116
  228    HD1  PHE  25           1HD      PHE  25   9.749  -0.525  -0.841
  229    HD2  PHE  25           2HD      PHE  25  12.488  -3.718  -1.707
  230    HE1  PHE  25           1HE      PHE  25  10.411   0.613  -2.943
  231    HE2  PHE  25           2HE      PHE  25  13.151  -2.580  -3.808
  232    HZ   PHE  25           HZ       PHE  25  12.112  -0.415  -4.426
  233    H    TRP  26           H        TRP  26   8.758  -0.866   1.538
  234    HA   TRP  26           HA       TRP  26   9.213   1.451   0.082
  235   1HB   TRP  26          1HB       TRP  26   7.265   2.258   1.036
  236   2HB   TRP  26          2HB       TRP  26   7.089   0.510   1.240
  237    HD1  TRP  26           HD       TRP  26   6.756  -0.384   3.610
  238    HE1  TRP  26           1HE      TRP  26   6.626   0.617   5.948
  239    HE3  TRP  26           3HE      TRP  26   8.362   4.358   2.547
  240    HZ2  TRP  26           2HZ      TRP  26   7.151   3.166   7.215
  241    HZ3  TRP  26           3HZ      TRP  26   8.533   6.042   4.343
  242    HH2  TRP  26           HH       TRP  26   7.933   5.464   6.676
  243    H    VAL  27           H        VAL  27   9.913   0.814   3.541
  244    HA   VAL  27           HA       VAL  27  10.614   3.271   4.489
  245    HB   VAL  27           HB       VAL  27  12.139   2.153   5.977
  246   1HG1  VAL  27          1HG1      VAL  27  10.598  -0.255   5.751
  247   2HG1  VAL  27          2HG1      VAL  27  10.365   1.100   6.882
  248   3HG1  VAL  27          3HG1      VAL  27   9.547   1.109   5.301
  249   1HG2  VAL  27          1HG2      VAL  27  12.283   0.126   3.726
  250   2HG2  VAL  27          2HG2      VAL  27  13.615   0.986   4.536
  251   3HG2  VAL  27          3HG2      VAL  27  12.739  -0.305   5.392
  252    H    LYS  28           H        LYS  28  12.632   1.182   2.372
  253    HA   LYS  28           HA       LYS  28  14.881   2.922   2.306
  254   1HB   LYS  28          1HB       LYS  28  13.821   0.743   0.490
  255   2HB   LYS  28          2HB       LYS  28  15.296   1.655   0.090
  256   1HG   LYS  28          1HG       LYS  28  16.498   0.441   1.562
  257   2HG   LYS  28          2HG       LYS  28  15.366   0.848   2.873
  258   1HD   LYS  28          1HD       LYS  28  13.822  -0.954   1.966
  259   2HD   LYS  28          2HD       LYS  28  15.143  -1.438   0.875
  260   1HE   LYS  28          1HE       LYS  28  15.445  -1.235   3.895
  261   2HE   LYS  28          2HE       LYS  28  15.013  -2.740   3.054
  262   1HZ   LYS  28          1HZ       LYS  28  17.088  -2.231   1.705
  263   2HZ   LYS  28          2HZ       LYS  28  17.505  -1.237   2.954
  264   3HZ   LYS  28          3HZ       LYS  28  17.265  -2.846   3.225
  265    H    VAL  29           H        VAL  29  11.882   2.735   0.384
  266    HA   VAL  29           HA       VAL  29  12.473   4.365  -1.760
  267    HB   VAL  29           HB       VAL  29   9.958   4.302  -0.048
  268   1HG1  VAL  29          1HG1      VAL  29  10.415   5.318  -2.887
  269   2HG1  VAL  29          2HG1      VAL  29   8.839   5.194  -2.068
  270   3HG1  VAL  29          3HG1      VAL  29  10.069   6.331  -1.465
  271   1HG2  VAL  29          1HG2      VAL  29  10.568   2.930  -2.694
  272   2HG2  VAL  29          2HG2      VAL  29  10.816   2.146  -1.116
  273   3HG2  VAL  29          3HG2      VAL  29   9.183   2.648  -1.612
  274    H    GLN  30           H        GLN  30  12.580   5.182   1.586
  275    HA   GLN  30           HA       GLN  30  12.351   8.077   1.019
  276   1HB   GLN  30          1HB       GLN  30  11.799   8.318   3.218
  277   2HB   GLN  30          2HB       GLN  30  11.411   6.585   3.092
  278   1HG   GLN  30          1HG       GLN  30  13.800   6.091   3.761
  279   2HG   GLN  30          2HG       GLN  30  14.009   7.828   4.075
  280   1HE2  GLN  30          1HE2      GLN  30  14.441   7.371   6.315
  281   2HE2  GLN  30          2HE2      GLN  30  13.138   6.979   7.416
  282    H    ARG  31           H        ARG  31  14.637   5.594   2.218
  283    HA   ARG  31           HA       ARG  31  16.869   5.901   2.876
  284   1HB   ARG  31          1HB       ARG  31  16.972   5.110   0.600
  285   2HB   ARG  31          2HB       ARG  31  16.663   6.742  -0.039
  286   1HG   ARG  31          1HG       ARG  31  19.072   6.170  -0.162
  287   2HG   ARG  31          2HG       ARG  31  18.789   7.535   0.944
  288   1HD   ARG  31          1HD       ARG  31  18.620   4.876   2.228
  289   2HD   ARG  31          2HD       ARG  31  20.224   5.261   1.568
  290    HE   ARG  31           HE       ARG  31  19.014   6.390   3.914
  291   1HH1  ARG  31          2HH2      ARG  31  21.032   7.177   1.119
  292   2HH1  ARG  31          1HH2      ARG  31  21.871   8.485   1.922
  293   1HH2  ARG  31          2HH1      ARG  31  20.123   8.118   4.974
  294   2HH2  ARG  31          1HH1      ARG  31  21.353   9.022   4.119
  295    H    GLY  32           H        GLY  32  16.787   7.568   4.455
  296   1HA   GLY  32          1HA       GLY  32  17.374   9.606   5.334
  297   2HA   GLY  32          2HA       GLY  32  18.354   9.854   3.871
  Start of MODEL   15
    1    HA   PRO   1           HA       PRO   1 -15.297   7.641   4.616
    2   1HB   PRO   1          1HB       PRO   1 -17.308   9.476   4.723
    3   2HB   PRO   1          2HB       PRO   1 -16.645   8.712   6.205
    4   1HG   PRO   1          1HG       PRO   1 -15.870  11.390   5.014
    5   2HG   PRO   1          2HG       PRO   1 -16.365  11.054   6.705
    6   1HD   PRO   1          1HD       PRO   1 -13.737  11.170   5.989
    7   2HD   PRO   1          2HD       PRO   1 -14.306   9.936   7.155
    8    HA   PRO   2           HA       PRO   2 -14.266   9.615   0.604
    9   1HB   PRO   2          1HB       PRO   2 -13.908   7.295  -0.780
   10   2HB   PRO   2          2HB       PRO   2 -12.667   7.921   0.355
   11   1HG   PRO   2          1HG       PRO   2 -14.809   5.855   0.932
   12   2HG   PRO   2          2HG       PRO   2 -13.047   5.707   1.231
   13   1HD   PRO   2          1HD       PRO   2 -14.762   6.487   3.200
   14   2HD   PRO   2          2HD       PRO   2 -13.157   7.261   3.037
   15    H    LEU   3           H        LEU   3 -15.229   8.307  -1.681
   16    HA   LEU   3           HA       LEU   3 -18.015   8.965  -1.548
   17   1HB   LEU   3          1HB       LEU   3 -16.041   8.085  -3.561
   18   2HB   LEU   3          2HB       LEU   3 -17.699   7.514  -3.869
   19    HG   LEU   3           HG       LEU   3 -17.178   9.773  -4.881
   20   1HD1  LEU   3          1HD1      LEU   3 -19.250  10.882  -3.856
   21   2HD1  LEU   3          2HD1      LEU   3 -19.486   9.243  -4.511
   22   3HD1  LEU   3          3HD1      LEU   3 -19.332   9.486  -2.754
   23   1HD2  LEU   3          1HD2      LEU   3 -15.731  10.456  -2.887
   24   2HD2  LEU   3          2HD2      LEU   3 -16.888  11.684  -3.454
   25   3HD2  LEU   3          3HD2      LEU   3 -17.246  10.731  -1.995
   26    H    SER   4           H        SER   4 -16.201   6.130  -0.780
   27    HA   SER   4           HA       SER   4 -16.946   4.146   0.127
   28   1HB   SER   4          1HB       SER   4 -19.808   4.741  -0.579
   29   2HB   SER   4          2HB       SER   4 -19.137   3.920   0.851
   30    HG   SER   4           HG       SER   4 -19.403   6.643   0.300
   31    H    GLN   5           H        GLN   5 -16.364   2.457  -1.094
   32    HA   GLN   5           HA       GLN   5 -16.733   0.742  -2.630
   33   1HB   GLN   5          1HB       GLN   5 -19.178   1.737  -2.675
   34   2HB   GLN   5          2HB       GLN   5 -18.645   2.442  -4.220
   35   1HG   GLN   5          1HG       GLN   5 -17.706  -0.150  -4.405
   36   2HG   GLN   5          2HG       GLN   5 -19.232  -0.368  -3.521
   37   1HE2  GLN   5          1HE2      GLN   5 -18.826  -1.368  -6.141
   38   2HE2  GLN   5          2HE2      GLN   5 -19.874  -0.495  -7.238
   39    H    GLU   6           H        GLU   6 -16.592   4.147  -3.703
   40    HA   GLU   6           HA       GLU   6 -15.530   3.828  -6.253
   41   1HB   GLU   6          1HB       GLU   6 -16.052   5.933  -4.602
   42   2HB   GLU   6          2HB       GLU   6 -14.272   5.931  -4.574
   43   1HG   GLU   6          1HG       GLU   6 -14.784   7.278  -6.438
   44   2HG   GLU   6          2HG       GLU   6 -14.446   5.688  -7.158
   45    H    THR   7           H        THR   7 -13.773   3.922  -3.109
   46    HA   THR   7           HA       THR   7 -11.300   3.122  -4.511
   47    HB   THR   7           HB       THR   7 -11.144   3.307  -1.606
   48    HG1  THR   7           1HG      THR   7 -12.217   5.486  -3.077
   49   1HG2  THR   7          1HG2      THR   7  -9.310   3.507  -3.356
   50   2HG2  THR   7          2HG2      THR   7  -9.989   5.097  -3.781
   51   3HG2  THR   7          3HG2      THR   7  -9.338   4.814  -2.148
   52    H    PHE   8           H        PHE   8 -11.973   2.125  -1.212
   53    HA   PHE   8           HA       PHE   8 -11.293  -0.120  -0.582
   54   1HB   PHE   8          1HB       PHE   8 -14.158  -0.465  -1.446
   55   2HB   PHE   8          2HB       PHE   8 -13.355  -1.041   0.025
   56    HD1  PHE   8           1HD      PHE   8 -13.713   2.334  -1.604
   57    HD2  PHE   8           2HD      PHE   8 -14.268  -0.070   1.913
   58    HE1  PHE   8           1HE      PHE   8 -14.538   4.323  -0.374
   59    HE2  PHE   8           2HE      PHE   8 -15.093   1.919   3.142
   60    HZ   PHE   8           HZ       PHE   8 -15.228   4.116   1.999
   61    H    SER   9           H        SER   9 -13.554  -0.398  -3.389
   62    HA   SER   9           HA       SER   9 -13.118  -2.893  -4.266
   63   1HB   SER   9          1HB       SER   9 -14.413  -1.064  -5.431
   64   2HB   SER   9          2HB       SER   9 -12.874  -0.499  -6.123
   65    HG   SER   9           HG       SER   9 -12.619  -2.577  -7.033
   66    H    ASP  10           H        ASP  10 -10.930  -0.198  -5.273
   67    HA   ASP  10           HA       ASP  10  -8.835  -2.245  -5.778
   68   1HB   ASP  10          1HB       ASP  10  -7.776  -0.508  -7.146
   69   2HB   ASP  10          2HB       ASP  10  -9.456  -0.770  -7.662
   70    H    LEU  11           H        LEU  11  -9.822   0.309  -3.651
   71    HA   LEU  11           HA       LEU  11  -7.243   1.155  -2.752
   72   1HB   LEU  11          1HB       LEU  11  -9.719   2.097  -2.401
   73   2HB   LEU  11          2HB       LEU  11  -9.608   1.129  -0.911
   74    HG   LEU  11           HG       LEU  11  -7.954   3.499  -1.781
   75   1HD1  LEU  11          1HD1      LEU  11  -9.884   2.838   0.260
   76   2HD1  LEU  11          2HD1      LEU  11  -8.337   3.248   1.038
   77   3HD1  LEU  11          3HD1      LEU  11  -9.109   4.406  -0.071
   78   1HD2  LEU  11          1HD2      LEU  11  -7.090   1.202   0.014
   79   2HD2  LEU  11          2HD2      LEU  11  -6.231   1.879  -1.391
   80   3HD2  LEU  11          3HD2      LEU  11  -6.364   2.825   0.112
   81    H    TRP  12           H        TRP  12  -9.655  -0.779  -0.894
   82    HA   TRP  12           HA       TRP  12  -7.902  -1.762   1.019
   83   1HB   TRP  12          1HB       TRP  12  -9.777  -2.746   1.701
   84   2HB   TRP  12          2HB       TRP  12 -10.562  -2.172   0.223
   85    HD1  TRP  12           HD       TRP  12 -11.710  -3.984  -1.077
   86    HE1  TRP  12           1HE      TRP  12 -11.494  -6.501  -1.398
   87    HE3  TRP  12           3HE      TRP  12  -7.578  -4.816   1.827
   88    HZ2  TRP  12           2HZ      TRP  12  -9.745  -8.628  -0.506
   89    HZ3  TRP  12           3HZ      TRP  12  -6.668  -7.097   2.067
   90    HH2  TRP  12           HH       TRP  12  -7.737  -9.009   0.910
   91    H    LYS  13           H        LYS  13  -8.522  -2.953  -2.287
   92    HA   LYS  13           HA       LYS  13  -6.969  -5.354  -1.987
   93   1HB   LYS  13          1HB       LYS  13  -8.726  -4.328  -3.857
   94   2HB   LYS  13          2HB       LYS  13  -7.158  -4.194  -4.690
   95   1HG   LYS  13          1HG       LYS  13  -7.882  -6.735  -3.221
   96   2HG   LYS  13          2HG       LYS  13  -8.515  -6.440  -4.858
   97   1HD   LYS  13          1HD       LYS  13  -5.592  -5.957  -4.398
   98   2HD   LYS  13          2HD       LYS  13  -6.148  -7.647  -4.443
   99   1HE   LYS  13          1HE       LYS  13  -7.344  -7.088  -6.611
  100   2HE   LYS  13          2HE       LYS  13  -6.511  -5.518  -6.585
  101   1HZ   LYS  13          1HZ       LYS  13  -4.486  -6.540  -6.836
  102   2HZ   LYS  13          2HZ       LYS  13  -5.036  -8.031  -6.396
  103   3HZ   LYS  13          3HZ       LYS  13  -5.461  -7.393  -7.856
  104    H    LEU  14           H        LEU  14  -6.277  -1.993  -2.900
  105    HA   LEU  14           HA       LEU  14  -3.716  -2.405  -4.039
  106   1HB   LEU  14          1HB       LEU  14  -5.365  -0.190  -3.092
  107   2HB   LEU  14          2HB       LEU  14  -3.645   0.065  -2.711
  108    HG   LEU  14           HG       LEU  14  -4.694   0.721  -5.103
  109   1HD1  LEU  14          1HD1      LEU  14  -2.217   0.649  -4.047
  110   2HD1  LEU  14          2HD1      LEU  14  -2.034  -0.652  -5.247
  111   3HD1  LEU  14          3HD1      LEU  14  -2.501   0.983  -5.772
  112   1HD2  LEU  14          1HD2      LEU  14  -4.987  -0.998  -6.551
  113   2HD2  LEU  14          2HD2      LEU  14  -3.481  -1.793  -6.034
  114   3HD2  LEU  14          3HD2      LEU  14  -4.984  -2.050  -5.115
  115    H    LEU  15           H        LEU  15  -4.733  -1.713  -0.656
  116    HA   LEU  15           HA       LEU  15  -2.075  -1.732   0.399
  117   1HB   LEU  15          1HB       LEU  15  -4.864  -1.709   1.423
  118   2HB   LEU  15          2HB       LEU  15  -3.647  -2.403   2.522
  119    HG   LEU  15           HG       LEU  15  -2.328  -0.400   2.474
  120   1HD1  LEU  15          1HD1      LEU  15  -3.044  -0.150  -0.110
  121   2HD1  LEU  15          2HD1      LEU  15  -4.177   1.028   0.596
  122   3HD1  LEU  15          3HD1      LEU  15  -2.424   1.224   0.837
  123   1HD2  LEU  15          1HD2      LEU  15  -4.718  -0.455   3.641
  124   2HD2  LEU  15          2HD2      LEU  15  -3.762   1.046   3.599
  125   3HD2  LEU  15          3HD2      LEU  15  -5.088   0.803   2.437
  126    H    LYS  16           H        LYS  16  -4.026  -4.208  -0.879
  127    HA   LYS  16           HA       LYS  16  -3.193  -6.338   0.896
  128   1HB   LYS  16          1HB       LYS  16  -5.158  -6.007  -1.013
  129   2HB   LYS  16          2HB       LYS  16  -3.989  -7.054  -1.853
  130   1HG   LYS  16          1HG       LYS  16  -3.956  -8.429   0.356
  131   2HG   LYS  16          2HG       LYS  16  -5.454  -7.554   0.753
  132   1HD   LYS  16          1HD       LYS  16  -6.569  -8.401  -1.202
  133   2HD   LYS  16          2HD       LYS  16  -5.048  -9.038  -1.871
  134   1HE   LYS  16          1HE       LYS  16  -5.056 -10.876  -0.502
  135   2HE   LYS  16          2HE       LYS  16  -5.795  -9.995   0.852
  136   1HZ   LYS  16          1HZ       LYS  16  -7.701 -10.052  -1.053
  137   2HZ   LYS  16          2HZ       LYS  16  -7.019 -11.549  -1.160
  138   3HZ   LYS  16          3HZ       LYS  16  -7.627 -11.021   0.279
  139    H    LYS  17           H        LYS  17  -1.266  -4.436  -0.759
  140    HA   LYS  17           HA       LYS  17   0.784  -6.437  -1.079
  141   1HB   LYS  17          1HB       LYS  17   0.241  -7.034  -3.194
  142   2HB   LYS  17          2HB       LYS  17  -0.849  -5.643  -3.407
  143   1HG   LYS  17          1HG       LYS  17   2.191  -5.449  -3.454
  144   2HG   LYS  17          2HG       LYS  17   1.181  -5.597  -4.912
  145   1HD   LYS  17          1HD       LYS  17  -0.028  -3.545  -3.419
  146   2HD   LYS  17          2HD       LYS  17   1.719  -3.248  -3.257
  147   1HE   LYS  17          1HE       LYS  17   1.220  -2.125  -5.247
  148   2HE   LYS  17          2HE       LYS  17   1.770  -3.707  -5.840
  149   1HZ   LYS  17          1HZ       LYS  17  -1.052  -3.212  -5.303
  150   2HZ   LYS  17          2HZ       LYS  17  -0.375  -2.744  -6.732
  151   3HZ   LYS  17          3HZ       LYS  17  -0.362  -4.334  -6.296
  152    H    TRP  18           H        TRP  18  -0.446  -3.152  -1.734
  153    HA   TRP  18           HA       TRP  18   2.193  -1.992  -1.970
  154   1HB   TRP  18          1HB       TRP  18  -0.274  -1.219  -2.712
  155   2HB   TRP  18          2HB       TRP  18  -0.168  -0.361  -1.169
  156    HD1  TRP  18           HD       TRP  18   0.717  -0.052  -4.722
  157    HE1  TRP  18           1HE      TRP  18   2.220   1.956  -5.159
  158    HE3  TRP  18           3HE      TRP  18   2.032   1.038   0.103
  159    HZ2  TRP  18           2HZ      TRP  18   3.807   3.817  -3.611
  160    HZ3  TRP  18           3HZ      TRP  18   3.539   2.932   0.581
  161    HH2  TRP  18           HH       TRP  18   4.433   4.328  -1.259
  162    H    LYS  19           H        LYS  19  -0.180  -2.510   0.633
  163    HA   LYS  19           HA       LYS  19   1.100  -0.835   2.562
  164   1HB   LYS  19          1HB       LYS  19  -1.271  -2.125   2.438
  165   2HB   LYS  19          2HB       LYS  19  -0.367  -3.274   3.453
  166   1HG   LYS  19          1HG       LYS  19  -0.099  -0.365   4.111
  167   2HG   LYS  19          2HG       LYS  19  -1.655  -1.142   4.487
  168   1HD   LYS  19          1HD       LYS  19   0.067  -3.043   5.410
  169   2HD   LYS  19          2HD       LYS  19   1.037  -1.576   5.689
  170   1HE   LYS  19          1HE       LYS  19  -0.216  -1.075   7.486
  171   2HE   LYS  19          2HE       LYS  19  -1.671  -1.026   6.467
  172   1HZ   LYS  19          1HZ       LYS  19  -1.321  -2.737   8.418
  173   2HZ   LYS  19          2HZ       LYS  19  -2.249  -3.059   7.094
  174   3HZ   LYS  19          3HZ       LYS  19  -0.706  -3.634   7.178
  175    H    MET  20           H        MET  20   1.603  -4.163   1.459
  176    HA   MET  20           HA       MET  20   3.064  -5.228   3.572
  177   1HB   MET  20          1HB       MET  20   2.491  -6.590   1.682
  178   2HB   MET  20          2HB       MET  20   3.379  -5.526   0.565
  179   1HG   MET  20          1HG       MET  20   5.257  -6.213   2.523
  180   2HG   MET  20          2HG       MET  20   4.354  -7.712   2.245
  181   1HE   MET  20          1HE       MET  20   5.051  -4.826  -0.395
  182   2HE   MET  20          2HE       MET  20   6.458  -4.844   0.695
  183   3HE   MET  20          3HE       MET  20   6.643  -5.337  -1.005
  184    H    ARG  21           H        ARG  21   4.396  -3.444   0.727
  185    HA   ARG  21           HA       ARG  21   7.015  -3.249   1.933
  186   1HB   ARG  21          1HB       ARG  21   7.293  -1.563  -0.018
  187   2HB   ARG  21          2HB       ARG  21   6.984  -3.268  -0.425
  188   1HG   ARG  21          1HG       ARG  21   4.451  -1.973  -0.040
  189   2HG   ARG  21          2HG       ARG  21   5.428  -0.958  -1.129
  190   1HD   ARG  21          1HD       ARG  21   5.924  -3.581  -1.988
  191   2HD   ARG  21          2HD       ARG  21   4.186  -3.563  -1.619
  192    HE   ARG  21           HE       ARG  21   4.686  -1.232  -3.080
  193   1HH1  ARG  21          2HH2      ARG  21   5.002  -4.725  -3.522
  194   2HH1  ARG  21          1HH2      ARG  21   4.747  -4.667  -5.252
  195   1HH2  ARG  21          2HH1      ARG  21   4.349  -1.155  -5.365
  196   2HH2  ARG  21          1HH1      ARG  21   4.374  -2.632  -6.302
  197    H    ARG  22           H        ARG  22   4.187  -1.089   1.547
  198    HA   ARG  22           HA       ARG  22   5.363   1.285   2.497
  199   1HB   ARG  22          1HB       ARG  22   3.115   1.074   1.427
  200   2HB   ARG  22          2HB       ARG  22   2.512   0.306   2.915
  201   1HG   ARG  22          1HG       ARG  22   3.889   2.679   3.700
  202   2HG   ARG  22          2HG       ARG  22   2.832   3.117   2.336
  203   1HD   ARG  22          1HD       ARG  22   1.708   3.285   4.581
  204   2HD   ARG  22          2HD       ARG  22   0.897   2.176   3.453
  205    HE   ARG  22           HE       ARG  22   2.526   0.477   4.791
  206   1HH1  ARG  22          2HH2      ARG  22   0.353   3.045   5.880
  207   2HH1  ARG  22          1HH2      ARG  22  -0.014   2.274   7.407
  208   1HH2  ARG  22          2HH1      ARG  22   2.041  -0.540   6.808
  209   2HH2  ARG  22          1HH1      ARG  22   0.949   0.230   7.936
  210    H    ASN  23           H        ASN  23   5.670  -1.489   4.038
  211    HA   ASN  23           HA       ASN  23   5.646  -0.181   6.689
  212   1HB   ASN  23          1HB       ASN  23   3.575  -1.827   5.977
  213   2HB   ASN  23          2HB       ASN  23   4.714  -2.991   6.687
  214   1HD2  ASN  23          1HD2      ASN  23   3.538  -3.396   8.574
  215   2HD2  ASN  23          2HD2      ASN  23   3.303  -2.189   9.820
  216    H    GLN  24           H        GLN  24   7.481  -1.377   4.412
  217    HA   GLN  24           HA       GLN  24   9.541  -2.258   6.212
  218   1HB   GLN  24          1HB       GLN  24   7.984  -4.304   4.622
  219   2HB   GLN  24          2HB       GLN  24   9.702  -4.562   5.009
  220   1HG   GLN  24          1HG       GLN  24   8.801  -3.784   7.444
  221   2HG   GLN  24          2HG       GLN  24   7.317  -4.523   6.805
  222   1HE2  GLN  24          1HE2      GLN  24   9.185  -5.403   8.994
  223   2HE2  GLN  24          2HE2      GLN  24   9.677  -7.024   8.552
  224    H    PHE  25           H        PHE  25   9.310  -3.820   3.093
  225    HA   PHE  25           HA       PHE  25  11.650  -2.998   2.011
  226   1HB   PHE  25          1HB       PHE  25  10.432  -4.503   0.730
  227   2HB   PHE  25          2HB       PHE  25   8.952  -3.531   0.802
  228    HD1  PHE  25           1HD      PHE  25   9.318  -1.052  -0.285
  229    HD2  PHE  25           2HD      PHE  25  11.463  -4.623  -1.330
  230    HE1  PHE  25           1HE      PHE  25   9.843  -0.086  -2.508
  231    HE2  PHE  25           2HE      PHE  25  11.988  -3.658  -3.553
  232    HZ   PHE  25           HZ       PHE  25  11.178  -1.389  -4.142
  233    H    TRP  26           H        TRP  26   8.665  -1.064   2.225
  234    HA   TRP  26           HA       TRP  26   9.325   1.048   0.524
  235   1HB   TRP  26          1HB       TRP  26   7.641   2.212   1.581
  236   2HB   TRP  26          2HB       TRP  26   7.223   0.541   1.985
  237    HD1  TRP  26           HD       TRP  26   7.123  -0.112   4.466
  238    HE1  TRP  26           1HE      TRP  26   7.404   1.108   6.684
  239    HE3  TRP  26           3HE      TRP  26   9.113   4.272   2.729
  240    HZ2  TRP  26           2HZ      TRP  26   8.373   3.674   7.605
  241    HZ3  TRP  26           3HZ      TRP  26   9.701   6.078   4.304
  242    HH2  TRP  26           HH       TRP  26   9.339   5.796   6.739
  243    H    VAL  27           H        VAL  27  10.216   0.554   3.972
  244    HA   VAL  27           HA       VAL  27  11.423   2.841   4.704
  245    HB   VAL  27           HB       VAL  27  13.007   1.534   5.988
  246   1HG1  VAL  27          1HG1      VAL  27  11.069  -0.581   6.117
  247   2HG1  VAL  27          2HG1      VAL  27  11.259   0.810   7.211
  248   3HG1  VAL  27          3HG1      VAL  27  10.205   0.939   5.782
  249   1HG2  VAL  27          1HG2      VAL  27  12.948  -1.057   5.379
  250   2HG2  VAL  27          2HG2      VAL  27  12.547  -0.438   3.759
  251   3HG2  VAL  27          3HG2      VAL  27  14.067   0.048   4.546
  252    H    LYS  28           H        LYS  28  12.697   0.558   2.267
  253    HA   LYS  28           HA       LYS  28  15.180   1.960   1.896
  254   1HB   LYS  28          1HB       LYS  28  13.688  -0.280   0.635
  255   2HB   LYS  28          2HB       LYS  28  14.803   0.603  -0.435
  256   1HG   LYS  28          1HG       LYS  28  16.120   0.237   2.083
  257   2HG   LYS  28          2HG       LYS  28  15.431  -1.332   1.600
  258   1HD   LYS  28          1HD       LYS  28  17.472  -1.387   0.476
  259   2HD   LYS  28          2HD       LYS  28  16.422  -0.675  -0.773
  260   1HE   LYS  28          1HE       LYS  28  17.511   1.334   1.072
  261   2HE   LYS  28          2HE       LYS  28  18.783   0.433   0.219
  262   1HZ   LYS  28          1HZ       LYS  28  17.388   2.499  -0.767
  263   2HZ   LYS  28          2HZ       LYS  28  18.264   1.420  -1.655
  264   3HZ   LYS  28          3HZ       LYS  28  16.640   1.205  -1.465
  265    H    VAL  29           H        VAL  29  11.964   2.042   0.330
  266    HA   VAL  29           HA       VAL  29  12.558   3.644  -1.877
  267    HB   VAL  29           HB       VAL  29  10.214   4.211  -1.881
  268   1HG1  VAL  29          1HG1      VAL  29   9.212   1.923  -1.244
  269   2HG1  VAL  29          2HG1      VAL  29  10.539   1.913  -2.430
  270   3HG1  VAL  29          3HG1      VAL  29  10.857   1.473  -0.734
  271   1HG2  VAL  29          1HG2      VAL  29   9.402   3.085   0.666
  272   2HG2  VAL  29          2HG2      VAL  29  10.596   4.380   0.927
  273   3HG2  VAL  29          3HG2      VAL  29   9.104   4.715   0.016
  274    H    GLN  30           H        GLN  30  12.919   4.382   1.439
  275    HA   GLN  30           HA       GLN  30  12.653   7.295   0.977
  276   1HB   GLN  30          1HB       GLN  30  12.368   7.496   3.248
  277   2HB   GLN  30          2HB       GLN  30  11.813   5.816   3.057
  278   1HG   GLN  30          1HG       GLN  30  14.456   5.356   3.318
  279   2HG   GLN  30          2HG       GLN  30  14.353   6.876   4.232
  280   1HE2  GLN  30          1HE2      GLN  30  15.096   4.612   5.590
  281   2HE2  GLN  30          2HE2      GLN  30  13.798   4.073   6.635
  282    H    ARG  31           H        ARG  31  14.999   4.714   1.405
  283    HA   ARG  31           HA       ARG  31  17.274   5.624   2.350
  284   1HB   ARG  31          1HB       ARG  31  16.882   3.649   0.738
  285   2HB   ARG  31          2HB       ARG  31  17.263   4.800  -0.566
  286   1HG   ARG  31          1HG       ARG  31  19.088   4.494   1.834
  287   2HG   ARG  31          2HG       ARG  31  19.214   3.397   0.438
  288   1HD   ARG  31          1HD       ARG  31  19.076   5.842  -0.805
  289   2HD   ARG  31          2HD       ARG  31  19.950   6.260   0.685
  290    HE   ARG  31           HE       ARG  31  21.035   3.882  -0.528
  291   1HH1  ARG  31          2HH2      ARG  31  20.912   7.407  -0.773
  292   2HH1  ARG  31          1HH2      ARG  31  22.468   7.543  -1.561
  293   1HH2  ARG  31          2HH1      ARG  31  23.089   4.062  -1.570
  294   2HH2  ARG  31          1HH1      ARG  31  23.709   5.636  -2.016
  295    H    GLY  32           H        GLY  32  16.098   6.771  -0.867
  296   1HA   GLY  32          1HA       GLY  32  16.322   9.402  -0.780
  297   2HA   GLY  32          2HA       GLY  32  18.050   8.986  -0.739
  Start of MODEL   16
    1    HA   PRO   1           HA       PRO   1 -18.346   1.080   4.369
    2   1HB   PRO   1          1HB       PRO   1 -17.673   2.371   6.672
    3   2HB   PRO   1          2HB       PRO   1 -18.640   0.860   6.683
    4   1HG   PRO   1          1HG       PRO   1 -15.644   1.127   7.059
    5   2HG   PRO   1          2HG       PRO   1 -16.802   0.265   8.124
    6   1HD   PRO   1          1HD       PRO   1 -15.376  -1.054   6.211
    7   2HD   PRO   1          2HD       PRO   1 -17.090  -1.471   6.515
    8    HA   PRO   2           HA       PRO   2 -14.479   3.107   2.765
    9   1HB   PRO   2          1HB       PRO   2 -15.294   3.387   0.181
   10   2HB   PRO   2          2HB       PRO   2 -14.670   1.829   0.811
   11   1HG   PRO   2          1HG       PRO   2 -17.568   2.684   0.570
   12   2HG   PRO   2          2HG       PRO   2 -16.825   1.172  -0.045
   13   1HD   PRO   2          1HD       PRO   2 -18.106   1.250   2.359
   14   2HD   PRO   2          2HD       PRO   2 -16.598   0.307   2.165
   15    H    LEU   3           H        LEU   3 -14.882   5.128   0.890
   16    HA   LEU   3           HA       LEU   3 -16.678   6.948   2.410
   17   1HB   LEU   3          1HB       LEU   3 -14.123   7.353   2.130
   18   2HB   LEU   3          2HB       LEU   3 -14.532   7.794   0.454
   19    HG   LEU   3           HG       LEU   3 -16.207   8.991   2.629
   20   1HD1  LEU   3          1HD1      LEU   3 -13.717   9.084   3.330
   21   2HD1  LEU   3          2HD1      LEU   3 -13.497  10.168   1.935
   22   3HD1  LEU   3          3HD1      LEU   3 -14.600  10.628   3.254
   23   1HD2  LEU   3          1HD2      LEU   3 -16.746  10.415   0.954
   24   2HD2  LEU   3          2HD2      LEU   3 -15.037  10.701   0.547
   25   3HD2  LEU   3          3HD2      LEU   3 -15.890   9.293  -0.130
   26    H    SER   4           H        SER   4 -15.387   6.801  -0.957
   27    HA   SER   4           HA       SER   4 -18.191   7.184  -1.898
   28   1HB   SER   4          1HB       SER   4 -15.895   8.876  -2.224
   29   2HB   SER   4          2HB       SER   4 -16.316   8.188  -3.810
   30    HG   SER   4           HG       SER   4 -17.538  10.128  -2.502
   31    H    GLN   5           H        GLN   5 -15.685   5.047  -1.670
   32    HA   GLN   5           HA       GLN   5 -15.487   2.976  -2.690
   33   1HB   GLN   5          1HB       GLN   5 -17.169   2.238  -4.015
   34   2HB   GLN   5          2HB       GLN   5 -17.939   3.801  -3.651
   35   1HG   GLN   5          1HG       GLN   5 -16.486   4.685  -5.649
   36   2HG   GLN   5          2HG       GLN   5 -16.371   2.969  -6.097
   37   1HE2  GLN   5          1HE2      GLN   5 -18.440   5.793  -5.877
   38   2HE2  GLN   5          2HE2      GLN   5 -19.839   5.096  -6.665
   39    H    GLU   6           H        GLU   6 -15.123   6.053  -4.319
   40    HA   GLU   6           HA       GLU   6 -13.865   5.647  -6.651
   41   1HB   GLU   6          1HB       GLU   6 -13.703   7.587  -4.549
   42   2HB   GLU   6          2HB       GLU   6 -12.054   7.274  -5.142
   43   1HG   GLU   6          1HG       GLU   6 -12.721   7.730  -7.426
   44   2HG   GLU   6          2HG       GLU   6 -14.431   7.834  -6.956
   45    H    THR   7           H        THR   7 -11.839   5.669  -3.666
   46    HA   THR   7           HA       THR   7  -9.926   3.901  -5.043
   47    HB   THR   7           HB       THR   7  -9.262   4.590  -2.299
   48    HG1  THR   7           1HG      THR   7 -10.005   6.672  -4.081
   49   1HG2  THR   7          1HG2      THR   7  -7.393   5.796  -3.621
   50   2HG2  THR   7          2HG2      THR   7  -7.531   4.034  -3.831
   51   3HG2  THR   7          3HG2      THR   7  -8.170   5.132  -5.078
   52    H    PHE   8           H        PHE   8 -10.417   3.852  -1.551
   53    HA   PHE   8           HA       PHE   8 -10.208   1.632  -0.513
   54   1HB   PHE   8          1HB       PHE   8 -13.166   2.025  -0.878
   55   2HB   PHE   8          2HB       PHE   8 -12.262   1.572   0.577
   56    HD1  PHE   8           1HD      PHE   8 -12.053   4.455  -1.834
   57    HD2  PHE   8           2HD      PHE   8 -12.496   3.161   2.238
   58    HE1  PHE   8           1HE      PHE   8 -12.072   6.819  -1.085
   59    HE2  PHE   8           2HE      PHE   8 -12.515   5.525   2.987
   60    HZ   PHE   8           HZ       PHE   8 -12.304   7.354   1.325
   61    H    SER   9           H        SER   9 -12.931   1.598  -2.891
   62    HA   SER   9           HA       SER   9 -13.427  -1.019  -3.206
   63   1HB   SER   9          1HB       SER   9 -14.268   0.931  -4.615
   64   2HB   SER   9          2HB       SER   9 -12.809   0.726  -5.614
   65    HG   SER   9           HG       SER   9 -13.484  -1.257  -6.212
   66    H    ASP  10           H        ASP  10 -10.726   0.581  -4.998
   67    HA   ASP  10           HA       ASP  10  -9.480  -2.103  -5.277
   68   1HB   ASP  10          1HB       ASP  10  -8.349  -1.242  -7.178
   69   2HB   ASP  10          2HB       ASP  10 -10.016  -0.641  -7.308
   70    H    LEU  11           H        LEU  11  -9.255   0.966  -3.678
   71    HA   LEU  11           HA       LEU  11  -6.424   1.032  -3.265
   72   1HB   LEU  11          1HB       LEU  11  -8.328   2.837  -2.915
   73   2HB   LEU  11          2HB       LEU  11  -8.383   2.150  -1.274
   74    HG   LEU  11           HG       LEU  11  -5.998   3.393  -2.697
   75   1HD1  LEU  11          1HD1      LEU  11  -7.872   4.132  -0.500
   76   2HD1  LEU  11          2HD1      LEU  11  -6.154   4.492  -0.209
   77   3HD1  LEU  11          3HD1      LEU  11  -6.976   5.172  -1.633
   78   1HD2  LEU  11          1HD2      LEU  11  -6.164   1.657  -0.211
   79   2HD2  LEU  11          2HD2      LEU  11  -5.082   1.479  -1.613
   80   3HD2  LEU  11          3HD2      LEU  11  -4.837   2.817  -0.464
   81    H    TRP  12           H        TRP  12  -8.979   0.390  -0.798
   82    HA   TRP  12           HA       TRP  12  -7.312  -0.767   1.104
   83   1HB   TRP  12          1HB       TRP  12  -9.252  -0.892   2.185
   84   2HB   TRP  12          2HB       TRP  12 -10.063  -0.367   0.703
   85    HD1  TRP  12           HD       TRP  12 -11.934  -1.877  -0.008
   86    HE1  TRP  12           1HE      TRP  12 -12.581  -4.327   0.246
   87    HE3  TRP  12           3HE      TRP  12  -7.828  -3.533   2.559
   88    HZ2  TRP  12           2HZ      TRP  12 -11.461  -6.723   1.421
   89    HZ3  TRP  12           3HZ      TRP  12  -7.654  -5.902   3.228
   90    HH2  TRP  12           HH       TRP  12  -9.457  -7.506   2.668
   91    H    LYS  13           H        LYS  13  -8.845  -2.238  -1.761
   92    HA   LYS  13           HA       LYS  13  -8.104  -4.934  -1.082
   93   1HB   LYS  13          1HB       LYS  13  -9.732  -3.692  -2.962
   94   2HB   LYS  13          2HB       LYS  13  -8.393  -4.336  -3.942
   95   1HG   LYS  13          1HG       LYS  13  -8.967  -6.376  -2.094
   96   2HG   LYS  13          2HG       LYS  13 -10.561  -5.762  -2.597
   97   1HD   LYS  13          1HD       LYS  13 -10.071  -6.141  -4.919
   98   2HD   LYS  13          2HD       LYS  13  -8.352  -6.444  -4.574
   99   1HE   LYS  13          1HE       LYS  13  -9.067  -8.627  -4.694
  100   2HE   LYS  13          2HE       LYS  13  -9.413  -8.325  -2.978
  101   1HZ   LYS  13          1HZ       LYS  13 -11.509  -7.566  -4.749
  102   2HZ   LYS  13          2HZ       LYS  13 -11.180  -9.182  -4.770
  103   3HZ   LYS  13          3HZ       LYS  13 -11.566  -8.437  -3.350
  104    H    LEU  14           H        LEU  14  -6.548  -2.230  -2.759
  105    HA   LEU  14           HA       LEU  14  -4.467  -3.780  -3.986
  106   1HB   LEU  14          1HB       LEU  14  -5.129  -0.920  -3.533
  107   2HB   LEU  14          2HB       LEU  14  -3.395  -1.288  -3.701
  108    HG   LEU  14           HG       LEU  14  -5.160  -0.939  -5.806
  109   1HD1  LEU  14          1HD1      LEU  14  -3.327  -2.070  -7.150
  110   2HD1  LEU  14          2HD1      LEU  14  -2.756  -0.813  -6.026
  111   3HD1  LEU  14          3HD1      LEU  14  -2.574  -2.533  -5.605
  112   1HD2  LEU  14          1HD2      LEU  14  -5.903  -3.381  -4.862
  113   2HD2  LEU  14          2HD2      LEU  14  -5.980  -2.934  -6.584
  114   3HD2  LEU  14          3HD2      LEU  14  -4.593  -3.863  -5.967
  115    H    LEU  15           H        LEU  15  -4.752  -1.957  -0.906
  116    HA   LEU  15           HA       LEU  15  -2.067  -2.359  -0.064
  117   1HB   LEU  15          1HB       LEU  15  -4.681  -1.682   1.271
  118   2HB   LEU  15          2HB       LEU  15  -3.258  -2.063   2.269
  119    HG   LEU  15           HG       LEU  15  -3.264  -0.003   0.025
  120   1HD1  LEU  15          1HD1      LEU  15  -3.596   0.303   3.037
  121   2HD1  LEU  15          2HD1      LEU  15  -3.217   1.648   1.935
  122   3HD1  LEU  15          3HD1      LEU  15  -4.759   0.773   1.775
  123   1HD2  LEU  15          1HD2      LEU  15  -1.206  -1.303   1.546
  124   2HD2  LEU  15          2HD2      LEU  15  -1.035   0.002   0.348
  125   3HD2  LEU  15          3HD2      LEU  15  -1.284   0.397   2.066
  126    H    LYS  16           H        LYS  16  -4.671  -4.550  -0.460
  127    HA   LYS  16           HA       LYS  16  -4.093  -6.352   1.694
  128   1HB   LYS  16          1HB       LYS  16  -6.046  -6.090  -0.263
  129   2HB   LYS  16          2HB       LYS  16  -5.168  -7.557  -0.760
  130   1HG   LYS  16          1HG       LYS  16  -5.466  -8.542   1.451
  131   2HG   LYS  16          2HG       LYS  16  -6.204  -7.041   2.059
  132   1HD   LYS  16          1HD       LYS  16  -8.141  -7.318   0.701
  133   2HD   LYS  16          2HD       LYS  16  -7.352  -8.553  -0.310
  134   1HE   LYS  16          1HE       LYS  16  -7.314 -10.123   1.551
  135   2HE   LYS  16          2HE       LYS  16  -7.943  -8.883   2.658
  136   1HZ   LYS  16          1HZ       LYS  16  -9.989  -9.047   1.783
  137   2HZ   LYS  16          2HZ       LYS  16  -9.476  -9.516   0.287
  138   3HZ   LYS  16          3HZ       LYS  16  -9.491 -10.599   1.531
  139    H    LYS  17           H        LYS  17  -1.904  -5.322  -0.322
  140    HA   LYS  17           HA       LYS  17  -0.309  -7.706  -0.186
  141   1HB   LYS  17          1HB       LYS  17  -0.338  -8.490  -2.349
  142   2HB   LYS  17          2HB       LYS  17  -2.018  -7.912  -2.241
  143   1HG   LYS  17          1HG       LYS  17  -1.026  -7.064  -4.302
  144   2HG   LYS  17          2HG       LYS  17  -1.259  -5.705  -3.176
  145   1HD   LYS  17          1HD       LYS  17   0.956  -5.276  -3.140
  146   2HD   LYS  17          2HD       LYS  17   1.326  -6.970  -2.737
  147   1HE   LYS  17          1HE       LYS  17   1.860  -7.473  -4.878
  148   2HE   LYS  17          2HE       LYS  17   0.440  -6.619  -5.519
  149   1HZ   LYS  17          1HZ       LYS  17   3.104  -5.769  -5.390
  150   2HZ   LYS  17          2HZ       LYS  17   1.823  -5.076  -6.165
  151   3HZ   LYS  17          3HZ       LYS  17   2.137  -4.699  -4.590
  152    H    TRP  18           H        TRP  18  -0.944  -4.480  -1.542
  153    HA   TRP  18           HA       TRP  18   1.809  -3.941  -2.203
  154   1HB   TRP  18          1HB       TRP  18  -0.571  -2.821  -2.836
  155   2HB   TRP  18          2HB       TRP  18  -0.056  -1.721  -1.549
  156    HD1  TRP  18           HD       TRP  18   0.069  -2.012  -5.119
  157    HE1  TRP  18           1HE      TRP  18   1.925  -0.627  -6.180
  158    HE3  TRP  18           3HE      TRP  18   2.865  -1.070  -0.937
  159    HZ2  TRP  18           2HZ      TRP  18   4.335   0.729  -5.327
  160    HZ3  TRP  18           3HZ      TRP  18   4.931   0.270  -1.100
  161    HH2  TRP  18           HH       TRP  18   5.678   1.174  -3.282
  162    H    LYS  19           H        LYS  19  -0.347  -3.067   0.544
  163    HA   LYS  19           HA       LYS  19   1.150  -1.418   2.058
  164   1HB   LYS  19          1HB       LYS  19  -0.080  -2.146   3.862
  165   2HB   LYS  19          2HB       LYS  19  -1.018  -2.912   2.557
  166   1HG   LYS  19          1HG       LYS  19  -0.660  -4.711   4.016
  167   2HG   LYS  19          2HG       LYS  19   0.688  -4.894   2.869
  168   1HD   LYS  19          1HD       LYS  19   1.880  -3.236   4.620
  169   2HD   LYS  19          2HD       LYS  19   0.713  -3.995   5.729
  170   1HE   LYS  19          1HE       LYS  19   2.076  -5.893   3.916
  171   2HE   LYS  19          2HE       LYS  19   3.166  -5.057   5.043
  172   1HZ   LYS  19          1HZ       LYS  19   0.775  -6.609   5.738
  173   2HZ   LYS  19          2HZ       LYS  19   2.345  -7.018   6.036
  174   3HZ   LYS  19          3HZ       LYS  19   1.665  -5.734   6.817
  175    H    MET  20           H        MET  20   1.782  -4.917   1.621
  176    HA   MET  20           HA       MET  20   3.688  -5.522   3.421
  177   1HB   MET  20          1HB       MET  20   3.530  -7.230   1.926
  178   2HB   MET  20          2HB       MET  20   3.309  -6.133   0.542
  179   1HG   MET  20          1HG       MET  20   5.902  -5.595   1.365
  180   2HG   MET  20          2HG       MET  20   5.763  -7.342   1.626
  181   1HE   MET  20          1HE       MET  20   5.142  -5.173  -2.411
  182   2HE   MET  20          2HE       MET  20   3.799  -5.344  -1.255
  183   3HE   MET  20          3HE       MET  20   5.247  -4.412  -0.805
  184    H    ARG  21           H        ARG  21   4.251  -3.479   0.517
  185    HA   ARG  21           HA       ARG  21   6.943  -2.818   1.554
  186   1HB   ARG  21          1HB       ARG  21   5.518  -2.524  -1.094
  187   2HB   ARG  21          2HB       ARG  21   6.965  -1.553  -0.732
  188   1HG   ARG  21          1HG       ARG  21   8.364  -3.384  -0.739
  189   2HG   ARG  21          2HG       ARG  21   7.105  -4.481  -0.123
  190   1HD   ARG  21          1HD       ARG  21   6.879  -5.225  -2.240
  191   2HD   ARG  21          2HD       ARG  21   6.128  -3.658  -2.611
  192    HE   ARG  21           HE       ARG  21   8.794  -3.108  -2.844
  193   1HH1  ARG  21          2HH2      ARG  21   6.696  -5.643  -4.136
  194   2HH1  ARG  21          1HH2      ARG  21   7.621  -5.850  -5.606
  195   1HH2  ARG  21          2HH1      ARG  21  10.017  -3.381  -4.786
  196   2HH2  ARG  21          1HH1      ARG  21   9.515  -4.560  -5.976
  197    H    ARG  22           H        ARG  22   3.836  -1.302   0.586
  198    HA   ARG  22           HA       ARG  22   4.634   1.372   1.184
  199   1HB   ARG  22          1HB       ARG  22   2.652   0.602  -0.212
  200   2HB   ARG  22          2HB       ARG  22   1.827   0.218   1.317
  201   1HG   ARG  22          1HG       ARG  22   1.126   2.385   1.222
  202   2HG   ARG  22          2HG       ARG  22   2.759   2.755   1.825
  203   1HD   ARG  22          1HD       ARG  22   1.754   2.804  -1.038
  204   2HD   ARG  22          2HD       ARG  22   2.456   4.137  -0.097
  205    HE   ARG  22           HE       ARG  22   4.225   1.835  -0.509
  206   1HH1  ARG  22          2HH2      ARG  22   3.102   4.984  -1.659
  207   2HH1  ARG  22          1HH2      ARG  22   4.544   5.309  -2.594
  208   1HH2  ARG  22          2HH1      ARG  22   6.130   2.265  -1.744
  209   2HH2  ARG  22          1HH1      ARG  22   6.270   3.759  -2.643
  210    H    ASN  23           H        ASN  23   5.002  -0.956   3.248
  211    HA   ASN  23           HA       ASN  23   4.180   0.706   5.551
  212   1HB   ASN  23          1HB       ASN  23   2.664  -1.471   4.784
  213   2HB   ASN  23          2HB       ASN  23   3.778  -2.183   5.971
  214   1HD2  ASN  23          1HD2      ASN  23   1.100   0.023   5.445
  215   2HD2  ASN  23          2HD2      ASN  23   0.788   0.384   7.130
  216    H    GLN  24           H        GLN  24   6.639  -0.432   3.912
  217    HA   GLN  24           HA       GLN  24   8.401  -0.541   6.171
  218   1HB   GLN  24          1HB       GLN  24   7.542  -3.125   4.861
  219   2HB   GLN  24          2HB       GLN  24   9.177  -2.955   5.543
  220   1HG   GLN  24          1HG       GLN  24   7.696  -1.910   7.575
  221   2HG   GLN  24          2HG       GLN  24   6.535  -3.081   6.914
  222   1HE2  GLN  24          1HE2      GLN  24   7.071  -5.335   6.886
  223   2HE2  GLN  24          2HE2      GLN  24   8.328  -5.977   7.922
  224    H    PHE  25           H        PHE  25   9.093  -2.690   3.509
  225    HA   PHE  25           HA       PHE  25  11.427  -1.673   2.655
  226   1HB   PHE  25          1HB       PHE  25  10.625  -3.577   1.550
  227   2HB   PHE  25          2HB       PHE  25   9.104  -2.792   1.093
  228    HD1  PHE  25           1HD      PHE  25   9.503  -0.569  -0.417
  229    HD2  PHE  25           2HD      PHE  25  12.148  -3.943  -0.145
  230    HE1  PHE  25           1HE      PHE  25  10.463   0.005  -2.630
  231    HE2  PHE  25           2HE      PHE  25  13.109  -3.368  -2.358
  232    HZ   PHE  25           HZ       PHE  25  12.266  -1.394  -3.601
  233    H    TRP  26           H        TRP  26   8.212  -0.330   1.817
  234    HA   TRP  26           HA       TRP  26   8.914   1.561  -0.074
  235   1HB   TRP  26          1HB       TRP  26   6.921   2.622   0.447
  236   2HB   TRP  26          2HB       TRP  26   6.645   0.975   1.030
  237    HD1  TRP  26           HD       TRP  26   6.022   0.672   3.488
  238    HE1  TRP  26           1HE      TRP  26   5.703   2.197   5.503
  239    HE3  TRP  26           3HE      TRP  26   7.966   4.991   1.548
  240    HZ2  TRP  26           2HZ      TRP  26   6.224   4.958   6.199
  241    HZ3  TRP  26           3HZ      TRP  26   8.037   7.044   2.914
  242    HH2  TRP  26           HH       TRP  26   7.172   7.045   5.236
  243    H    VAL  27           H        VAL  27   9.242   1.772   3.491
  244    HA   VAL  27           HA       VAL  27   9.954   4.378   3.881
  245    HB   VAL  27           HB       VAL  27  11.260   3.632   5.760
  246   1HG1  VAL  27          1HG1      VAL  27   9.632   1.283   5.967
  247   2HG1  VAL  27          2HG1      VAL  27   9.347   2.885   6.686
  248   3HG1  VAL  27          3HG1      VAL  27   8.703   2.508   5.071
  249   1HG2  VAL  27          1HG2      VAL  27  11.507   1.078   4.134
  250   2HG2  VAL  27          2HG2      VAL  27  12.808   2.106   4.781
  251   3HG2  VAL  27          3HG2      VAL  27  11.823   1.117   5.885
  252    H    LYS  28           H        LYS  28  12.101   1.777   2.626
  253    HA   LYS  28           HA       LYS  28  14.421   3.388   2.380
  254   1HB   LYS  28          1HB       LYS  28  13.443   0.872   1.001
  255   2HB   LYS  28          2HB       LYS  28  15.014   1.611   0.611
  256   1HG   LYS  28          1HG       LYS  28  15.850   0.457   2.369
  257   2HG   LYS  28          2HG       LYS  28  14.954   1.590   3.410
  258   1HD   LYS  28          1HD       LYS  28  12.945   0.069   3.201
  259   2HD   LYS  28          2HD       LYS  28  13.988  -1.098   2.354
  260   1HE   LYS  28          1HE       LYS  28  15.009  -0.018   4.945
  261   2HE   LYS  28          2HE       LYS  28  13.622  -1.126   5.036
  262   1HZ   LYS  28          1HZ       LYS  28  15.341  -2.265   3.281
  263   2HZ   LYS  28          2HZ       LYS  28  16.319  -1.689   4.476
  264   3HZ   LYS  28          3HZ       LYS  28  15.086  -2.720   4.845
  265    H    VAL  29           H        VAL  29  11.598   2.883   0.275
  266    HA   VAL  29           HA       VAL  29  12.523   3.922  -2.128
  267    HB   VAL  29           HB       VAL  29   9.824   4.311  -0.776
  268   1HG1  VAL  29          1HG1      VAL  29   9.796   5.871  -2.527
  269   2HG1  VAL  29          2HG1      VAL  29  10.874   4.891  -3.549
  270   3HG1  VAL  29          3HG1      VAL  29   9.176   4.406  -3.326
  271   1HG2  VAL  29          1HG2      VAL  29  10.689   2.305  -2.895
  272   2HG2  VAL  29          2HG2      VAL  29  10.694   1.944  -1.152
  273   3HG2  VAL  29          3HG2      VAL  29   9.164   2.330  -1.976
  274    H    GLN  30           H        GLN  30  12.350   5.483   0.921
  275    HA   GLN  30           HA       GLN  30  12.352   8.169  -0.350
  276   1HB   GLN  30          1HB       GLN  30  11.596   9.017   1.675
  277   2HB   GLN  30          2HB       GLN  30  10.846   7.402   1.687
  278   1HG   GLN  30          1HG       GLN  30  13.303   6.852   2.771
  279   2HG   GLN  30          2HG       GLN  30  13.033   8.504   3.367
  280   1HE2  GLN  30          1HE2      GLN  30  10.137   8.358   3.461
  281   2HE2  GLN  30          2HE2      GLN  30   9.714   7.301   4.791
  282    H    ARG  31           H        ARG  31  14.315   5.782   1.299
  283    HA   ARG  31           HA       ARG  31  16.333   6.869   2.574
  284   1HB   ARG  31          1HB       ARG  31  16.246   4.574   1.425
  285   2HB   ARG  31          2HB       ARG  31  16.981   5.375   0.015
  286   1HG   ARG  31          1HG       ARG  31  18.279   5.966   2.623
  287   2HG   ARG  31          2HG       ARG  31  18.417   4.278   2.074
  288   1HD   ARG  31          1HD       ARG  31  19.622   4.848   0.177
  289   2HD   ARG  31          2HD       ARG  31  18.908   6.473   0.082
  290    HE   ARG  31           HE       ARG  31  20.399   6.486   2.424
  291   1HH1  ARG  31          2HH2      ARG  31  20.997   5.846  -1.001
  292   2HH1  ARG  31          1HH2      ARG  31  22.655   6.403  -0.957
  293   1HH2  ARG  31          2HH1      ARG  31  22.589   7.221   2.483
  294   2HH2  ARG  31          1HH1      ARG  31  23.562   7.186   1.030
  295    H    GLY  32           H        GLY  32  16.897   8.997   2.476
  296   1HA   GLY  32          1HA       GLY  32  18.163   9.892  -0.062
  297   2HA   GLY  32          2HA       GLY  32  16.962  10.921   0.752
  Start of MODEL   17
    1    HA   PRO   1           HA       PRO   1 -21.908   4.238  -3.599
    2   1HB   PRO   1          1HB       PRO   1 -19.244   4.412  -4.144
    3   2HB   PRO   1          2HB       PRO   1 -20.360   3.458  -5.175
    4   1HG   PRO   1          1HG       PRO   1 -19.426   6.308  -5.623
    5   2HG   PRO   1          2HG       PRO   1 -19.365   4.947  -6.790
    6   1HD   PRO   1          1HD       PRO   1 -21.418   6.740  -6.804
    7   2HD   PRO   1          2HD       PRO   1 -21.732   4.999  -7.075
    8    HA   PRO   2           HA       PRO   2 -21.010   7.424  -0.681
    9   1HB   PRO   2          1HB       PRO   2 -19.970   5.951   1.362
   10   2HB   PRO   2          2HB       PRO   2 -21.682   5.784   0.851
   11   1HG   PRO   2          1HG       PRO   2 -19.333   4.067  -0.003
   12   2HG   PRO   2          2HG       PRO   2 -20.900   3.510   0.668
   13   1HD   PRO   2          1HD       PRO   2 -20.454   3.594  -2.019
   14   2HD   PRO   2          2HD       PRO   2 -22.040   4.079  -1.348
   15    H    LEU   3           H        LEU   3 -18.889   7.569   1.084
   16    HA   LEU   3           HA       LEU   3 -16.688   8.177  -0.758
   17   1HB   LEU   3          1HB       LEU   3 -17.324   8.776   2.139
   18   2HB   LEU   3          2HB       LEU   3 -15.699   9.067   1.473
   19    HG   LEU   3           HG       LEU   3 -16.964  10.309  -0.448
   20   1HD1  LEU   3          1HD1      LEU   3 -19.068  10.093   1.736
   21   2HD1  LEU   3          2HD1      LEU   3 -19.095  11.379   0.506
   22   3HD1  LEU   3          3HD1      LEU   3 -19.225   9.674   0.013
   23   1HD2  LEU   3          1HD2      LEU   3 -16.364  11.170   2.352
   24   2HD2  LEU   3          2HD2      LEU   3 -15.712  11.772   0.809
   25   3HD2  LEU   3          3HD2      LEU   3 -17.323  12.294   1.358
   26    H    SER   4           H        SER   4 -17.692   5.616   1.303
   27    HA   SER   4           HA       SER   4 -14.959   4.687   1.849
   28   1HB   SER   4          1HB       SER   4 -16.046   2.939   3.117
   29   2HB   SER   4          2HB       SER   4 -16.849   4.479   3.503
   30    HG   SER   4           HG       SER   4 -18.611   3.665   2.748
   31    H    GLN   5           H        GLN   5 -16.292   4.949  -0.941
   32    HA   GLN   5           HA       GLN   5 -15.764   2.133  -1.772
   33   1HB   GLN   5          1HB       GLN   5 -18.168   3.198  -1.978
   34   2HB   GLN   5          2HB       GLN   5 -17.460   4.031  -3.383
   35   1HG   GLN   5          1HG       GLN   5 -17.036   2.025  -4.523
   36   2HG   GLN   5          2HG       GLN   5 -17.078   1.056  -3.034
   37   1HE2  GLN   5          1HE2      GLN   5 -18.625   1.095  -5.750
   38   2HE2  GLN   5          2HE2      GLN   5 -20.298   0.956  -5.256
   39    H    GLU   6           H        GLU   6 -15.718   5.577  -2.846
   40    HA   GLU   6           HA       GLU   6 -14.395   5.600  -5.152
   41   1HB   GLU   6          1HB       GLU   6 -14.783   7.632  -3.870
   42   2HB   GLU   6          2HB       GLU   6 -13.567   7.146  -2.665
   43   1HG   GLU   6          1HG       GLU   6 -12.139   6.947  -5.011
   44   2HG   GLU   6          2HG       GLU   6 -13.209   8.323  -5.359
   45    H    THR   7           H        THR   7 -12.437   5.453  -2.118
   46    HA   THR   7           HA       THR   7 -10.282   4.166  -3.673
   47    HB   THR   7           HB       THR   7  -9.742   4.577  -0.845
   48    HG1  THR   7           1HG      THR   7 -10.631   6.443  -0.591
   49   1HG2  THR   7          1HG2      THR   7  -8.020   6.156  -1.955
   50   2HG2  THR   7          2HG2      THR   7  -7.937   4.431  -2.387
   51   3HG2  THR   7          3HG2      THR   7  -8.691   5.594  -3.505
   52    H    PHE   8           H        PHE   8 -10.874   3.619  -0.227
   53    HA   PHE   8           HA       PHE   8 -10.337   1.293   0.483
   54   1HB   PHE   8          1HB       PHE   8 -13.332   1.467   0.235
   55   2HB   PHE   8          2HB       PHE   8 -12.350   0.867   1.582
   56    HD1  PHE   8           1HD      PHE   8 -12.462   4.100  -0.343
   57    HD2  PHE   8           2HD      PHE   8 -12.638   2.150   3.481
   58    HE1  PHE   8           1HE      PHE   8 -12.643   6.307   0.774
   59    HE2  PHE   8           2HE      PHE   8 -12.820   4.357   4.598
   60    HZ   PHE   8           HZ       PHE   8 -12.822   6.435   3.244
   61    H    SER   9           H        SER   9 -13.109   1.334  -1.838
   62    HA   SER   9           HA       SER   9 -13.387  -1.249  -2.502
   63   1HB   SER   9          1HB       SER   9 -14.398   0.825  -3.622
   64   2HB   SER   9          2HB       SER   9 -12.967   0.820  -4.680
   65    HG   SER   9           HG       SER   9 -15.031  -0.457  -5.219
   66    H    ASP  10           H        ASP  10 -10.858   0.812  -4.057
   67    HA   ASP  10           HA       ASP  10  -9.401  -1.692  -4.726
   68   1HB   ASP  10          1HB       ASP  10  -8.204  -0.255  -6.362
   69   2HB   ASP  10          2HB       ASP  10  -9.959  -0.286  -6.639
   70    H    LEU  11           H        LEU  11  -9.379   1.190  -2.769
   71    HA   LEU  11           HA       LEU  11  -6.566   1.423  -2.360
   72   1HB   LEU  11          1HB       LEU  11  -8.591   3.004  -1.756
   73   2HB   LEU  11          2HB       LEU  11  -8.585   2.091  -0.228
   74    HG   LEU  11           HG       LEU  11  -6.314   3.707  -1.447
   75   1HD1  LEU  11          1HD1      LEU  11  -6.544   4.401   1.186
   76   2HD1  LEU  11          2HD1      LEU  11  -7.400   5.234  -0.134
   77   3HD1  LEU  11          3HD1      LEU  11  -8.232   3.978   0.814
   78   1HD2  LEU  11          1HD2      LEU  11  -6.248   1.872   0.987
   79   2HD2  LEU  11          2HD2      LEU  11  -5.495   1.508  -0.584
   80   3HD2  LEU  11          3HD2      LEU  11  -4.911   2.881   0.386
   81    H    TRP  12           H        TRP  12  -9.009   0.229   0.014
   82    HA   TRP  12           HA       TRP  12  -7.207  -1.021   1.729
   83   1HB   TRP  12          1HB       TRP  12  -9.106  -1.450   2.804
   84   2HB   TRP  12          2HB       TRP  12  -9.992  -0.810   1.412
   85    HD1  TRP  12           HD       TRP  12 -11.747  -2.372   0.539
   86    HE1  TRP  12           1HE      TRP  12 -12.175  -4.882   0.474
   87    HE3  TRP  12           3HE      TRP  12  -7.448  -3.983   2.801
   88    HZ2  TRP  12           2HZ      TRP  12 -10.823  -7.304   1.301
   89    HZ3  TRP  12           3HZ      TRP  12  -7.054  -6.394   3.145
   90    HH2  TRP  12           HH       TRP  12  -8.727  -8.064   2.403
   91    H    LYS  13           H        LYS  13  -8.686  -2.227  -1.287
   92    HA   LYS  13           HA       LYS  13  -7.717  -4.916  -0.991
   93   1HB   LYS  13          1HB       LYS  13  -9.501  -3.627  -2.638
   94   2HB   LYS  13          2HB       LYS  13  -8.117  -3.875  -3.731
   95   1HG   LYS  13          1HG       LYS  13  -8.396  -6.278  -2.241
   96   2HG   LYS  13          2HG       LYS  13 -10.037  -5.815  -2.750
   97   1HD   LYS  13          1HD       LYS  13  -9.492  -6.773  -4.737
   98   2HD   LYS  13          2HD       LYS  13  -8.541  -5.296  -5.023
   99   1HE   LYS  13          1HE       LYS  13  -7.166  -7.304  -3.347
  100   2HE   LYS  13          2HE       LYS  13  -7.523  -7.867  -4.994
  101   1HZ   LYS  13          1HZ       LYS  13  -5.673  -6.789  -5.467
  102   2HZ   LYS  13          2HZ       LYS  13  -6.597  -5.424  -5.422
  103   3HZ   LYS  13          3HZ       LYS  13  -5.702  -5.856  -4.107
  104    H    LEU  14           H        LEU  14  -6.377  -1.888  -2.221
  105    HA   LEU  14           HA       LEU  14  -4.227  -3.039  -3.718
  106   1HB   LEU  14          1HB       LEU  14  -5.143  -0.399  -2.852
  107   2HB   LEU  14          2HB       LEU  14  -3.370  -0.546  -2.788
  108    HG   LEU  14           HG       LEU  14  -4.563   0.158  -5.044
  109   1HD1  LEU  14          1HD1      LEU  14  -2.683  -1.996  -5.703
  110   2HD1  LEU  14          2HD1      LEU  14  -2.510  -0.236  -5.910
  111   3HD1  LEU  14          3HD1      LEU  14  -2.109  -0.993  -4.349
  112   1HD2  LEU  14          1HD2      LEU  14  -5.584  -2.485  -4.595
  113   2HD2  LEU  14          2HD2      LEU  14  -5.872  -1.415  -5.988
  114   3HD2  LEU  14          3HD2      LEU  14  -4.501  -2.550  -6.006
  115    H    LEU  15           H        LEU  15  -4.509  -1.802  -0.351
  116    HA   LEU  15           HA       LEU  15  -1.807  -2.240   0.376
  117   1HB   LEU  15          1HB       LEU  15  -4.426  -1.966   1.837
  118   2HB   LEU  15          2HB       LEU  15  -2.973  -2.470   2.734
  119    HG   LEU  15           HG       LEU  15  -3.357   0.070   1.101
  120   1HD1  LEU  15          1HD1      LEU  15  -4.253   0.124   3.393
  121   2HD1  LEU  15          2HD1      LEU  15  -2.703  -0.480   4.028
  122   3HD1  LEU  15          3HD1      LEU  15  -2.791   1.134   3.282
  123   1HD2  LEU  15          1HD2      LEU  15  -0.908   0.349   2.234
  124   2HD2  LEU  15          2HD2      LEU  15  -0.906  -1.409   1.954
  125   3HD2  LEU  15          3HD2      LEU  15  -1.147  -0.291   0.590
  126    H    LYS  16           H        LYS  16  -4.356  -4.448  -0.335
  127    HA   LYS  16           HA       LYS  16  -3.453  -6.596   1.383
  128   1HB   LYS  16          1HB       LYS  16  -5.713  -6.035  -0.163
  129   2HB   LYS  16          2HB       LYS  16  -4.933  -7.391  -1.014
  130   1HG   LYS  16          1HG       LYS  16  -4.680  -8.385   1.423
  131   2HG   LYS  16          2HG       LYS  16  -6.009  -7.264   1.803
  132   1HD   LYS  16          1HD       LYS  16  -7.449  -8.777   0.954
  133   2HD   LYS  16          2HD       LYS  16  -6.713  -8.513  -0.645
  134   1HE   LYS  16          1HE       LYS  16  -5.344 -10.335   1.326
  135   2HE   LYS  16          2HE       LYS  16  -6.757 -10.934   0.431
  136   1HZ   LYS  16          1HZ       LYS  16  -4.120 -10.344  -0.499
  137   2HZ   LYS  16          2HZ       LYS  16  -5.239 -11.407  -1.081
  138   3HZ   LYS  16          3HZ       LYS  16  -5.329  -9.811  -1.486
  139    H    LYS  17           H        LYS  17  -1.674  -5.113  -0.761
  140    HA   LYS  17           HA       LYS  17  -0.105  -7.452  -1.398
  141   1HB   LYS  17          1HB       LYS  17  -1.158  -7.957  -3.334
  142   2HB   LYS  17          2HB       LYS  17  -2.044  -6.413  -3.358
  143   1HG   LYS  17          1HG       LYS  17   0.891  -6.756  -4.108
  144   2HG   LYS  17          2HG       LYS  17  -0.451  -6.623  -5.270
  145   1HD   LYS  17          1HD       LYS  17  -0.766  -4.468  -3.448
  146   2HD   LYS  17          2HD       LYS  17   0.963  -4.516  -3.866
  147   1HE   LYS  17          1HE       LYS  17  -0.332  -4.989  -6.298
  148   2HE   LYS  17          2HE       LYS  17  -1.341  -3.755  -5.512
  149   1HZ   LYS  17          1HZ       LYS  17   0.171  -2.284  -6.005
  150   2HZ   LYS  17          2HZ       LYS  17   1.328  -3.101  -5.160
  151   3HZ   LYS  17          3HZ       LYS  17   1.093  -3.424  -6.760
  152    H    TRP  18           H        TRP  18  -0.800  -4.030  -1.421
  153    HA   TRP  18           HA       TRP  18   1.900  -3.360  -2.391
  154   1HB   TRP  18          1HB       TRP  18  -0.534  -2.160  -2.670
  155   2HB   TRP  18          2HB       TRP  18   0.119  -1.266  -1.290
  156    HD1  TRP  18           HD       TRP  18  -0.022  -1.120  -4.894
  157    HE1  TRP  18           1HE      TRP  18   1.752   0.407  -5.897
  158    HE3  TRP  18           3HE      TRP  18   3.026  -0.634  -0.811
  159    HZ2  TRP  18           2HZ      TRP  18   4.201   1.690  -5.040
  160    HZ3  TRP  18           3HZ      TRP  18   5.067   0.746  -0.942
  161    HH2  TRP  18           HH       TRP  18   5.668   1.912  -3.044
  162    H    LYS  19           H        LYS  19  -0.117  -3.119   0.569
  163    HA   LYS  19           HA       LYS  19   1.488  -1.700   2.264
  164   1HB   LYS  19          1HB       LYS  19  -0.726  -2.920   2.725
  165   2HB   LYS  19          2HB       LYS  19   0.268  -4.352   3.084
  166   1HG   LYS  19          1HG       LYS  19   1.420  -3.207   4.864
  167   2HG   LYS  19          2HG       LYS  19   0.713  -1.642   4.395
  168   1HD   LYS  19          1HD       LYS  19  -0.625  -2.318   6.220
  169   2HD   LYS  19          2HD       LYS  19  -1.583  -2.813   4.804
  170   1HE   LYS  19          1HE       LYS  19  -0.159  -5.053   5.068
  171   2HE   LYS  19          2HE       LYS  19  -0.027  -4.494   6.750
  172   1HZ   LYS  19          1HZ       LYS  19  -2.643  -4.438   5.541
  173   2HZ   LYS  19          2HZ       LYS  19  -2.020  -5.923   5.894
  174   3HZ   LYS  19          3HZ       LYS  19  -2.196  -4.799   7.087
  175    H    MET  20           H        MET  20   1.816  -5.234   1.602
  176    HA   MET  20           HA       MET  20   3.861  -6.010   3.149
  177   1HB   MET  20          1HB       MET  20   4.803  -7.147   0.975
  178   2HB   MET  20          2HB       MET  20   3.179  -7.579   1.562
  179   1HG   MET  20          1HG       MET  20   2.357  -6.962  -0.426
  180   2HG   MET  20          2HG       MET  20   2.806  -5.294  -0.034
  181   1HE   MET  20          1HE       MET  20   4.855  -4.251  -2.715
  182   2HE   MET  20          2HE       MET  20   3.183  -4.788  -3.010
  183   3HE   MET  20          3HE       MET  20   3.610  -4.013  -1.465
  184    H    ARG  21           H        ARG  21   4.221  -3.867   0.297
  185    HA   ARG  21           HA       ARG  21   7.085  -3.521   0.916
  186   1HB   ARG  21          1HB       ARG  21   5.258  -2.921  -1.387
  187   2HB   ARG  21          2HB       ARG  21   6.716  -1.921  -1.185
  188   1HG   ARG  21          1HG       ARG  21   8.024  -4.111  -0.962
  189   2HG   ARG  21          2HG       ARG  21   6.550  -4.939  -1.517
  190   1HD   ARG  21          1HD       ARG  21   8.252  -4.340  -3.332
  191   2HD   ARG  21          2HD       ARG  21   6.582  -3.805  -3.617
  192    HE   ARG  21           HE       ARG  21   8.293  -1.838  -2.282
  193   1HH1  ARG  21          2HH2      ARG  21   7.067  -3.136  -5.333
  194   2HH1  ARG  21          1HH2      ARG  21   7.366  -1.668  -6.236
  195   1HH2  ARG  21          2HH1      ARG  21   8.689   0.101  -3.475
  196   2HH2  ARG  21          1HH1      ARG  21   8.291   0.178  -5.176
  197    H    ARG  22           H        ARG  22   4.061  -1.592   0.617
  198    HA   ARG  22           HA       ARG  22   5.256   0.874   1.421
  199   1HB   ARG  22          1HB       ARG  22   3.131   0.772   0.211
  200   2HB   ARG  22          2HB       ARG  22   2.381  -0.115   1.560
  201   1HG   ARG  22          1HG       ARG  22   2.032   2.475   1.409
  202   2HG   ARG  22          2HG       ARG  22   2.435   1.757   2.987
  203   1HD   ARG  22          1HD       ARG  22   3.778   3.829   2.339
  204   2HD   ARG  22          2HD       ARG  22   4.732   2.403   2.800
  205    HE   ARG  22           HE       ARG  22   5.624   2.373   0.678
  206   1HH1  ARG  22          2HH2      ARG  22   2.566   4.148   0.661
  207   2HH1  ARG  22          1HH2      ARG  22   2.700   4.634  -1.014
  208   1HH2  ARG  22          2HH1      ARG  22   5.800   3.014  -1.536
  209   2HH2  ARG  22          1HH1      ARG  22   4.543   3.987  -2.266
  210    H    ASN  23           H        ASN  23   5.670  -1.675   3.121
  211    HA   ASN  23           HA       ASN  23   5.317  -0.282   5.692
  212   1HB   ASN  23          1HB       ASN  23   3.480  -2.228   4.845
  213   2HB   ASN  23          2HB       ASN  23   4.578  -3.089   5.945
  214   1HD2  ASN  23          1HD2      ASN  23   1.990  -2.834   6.750
  215   2HD2  ASN  23          2HD2      ASN  23   1.850  -1.649   8.030
  216    H    GLN  24           H        GLN  24   7.409  -1.405   3.647
  217    HA   GLN  24           HA       GLN  24   9.324  -2.171   5.663
  218   1HB   GLN  24          1HB       GLN  24   8.134  -4.268   3.830
  219   2HB   GLN  24          2HB       GLN  24   9.780  -4.427   4.490
  220   1HG   GLN  24          1HG       GLN  24   8.511  -3.806   6.768
  221   2HG   GLN  24          2HG       GLN  24   7.131  -4.508   5.897
  222   1HE2  GLN  24          1HE2      GLN  24   7.309  -6.719   5.089
  223   2HE2  GLN  24          2HE2      GLN  24   8.386  -7.850   5.882
  224    H    PHE  25           H        PHE  25   9.646  -3.708   2.567
  225    HA   PHE  25           HA       PHE  25  11.998  -2.651   1.774
  226   1HB   PHE  25          1HB       PHE  25  10.995  -4.298   0.417
  227   2HB   PHE  25          2HB       PHE  25   9.532  -3.330   0.167
  228    HD1  PHE  25           1HD      PHE  25  10.066  -0.916  -0.951
  229    HD2  PHE  25           2HD      PHE  25  12.443  -4.469  -1.373
  230    HE1  PHE  25           1HE      PHE  25  11.010  -0.033  -3.068
  231    HE2  PHE  25           2HE      PHE  25  13.387  -3.586  -3.489
  232    HZ   PHE  25           HZ       PHE  25  12.671  -1.368  -4.337
  233    H    TRP  26           H        TRP  26   8.799  -1.084   1.284
  234    HA   TRP  26           HA       TRP  26   9.467   1.099  -0.228
  235   1HB   TRP  26          1HB       TRP  26   7.573   2.120   0.620
  236   2HB   TRP  26          2HB       TRP  26   7.259   0.411   0.956
  237    HD1  TRP  26           HD       TRP  26   6.817  -0.262   3.379
  238    HE1  TRP  26           1HE      TRP  26   6.734   0.927   5.630
  239    HE3  TRP  26           3HE      TRP  26   8.819   4.238   1.989
  240    HZ2  TRP  26           2HZ      TRP  26   7.447   3.516   6.707
  241    HZ3  TRP  26           3HZ      TRP  26   9.101   6.038   3.652
  242    HH2  TRP  26           HH       TRP  26   8.422   5.695   6.010
  243    H    VAL  27           H        VAL  27  10.063   0.662   3.282
  244    HA   VAL  27           HA       VAL  27  10.948   3.130   4.051
  245    HB   VAL  27           HB       VAL  27  12.360   2.002   5.658
  246   1HG1  VAL  27          1HG1      VAL  27  10.588  -0.216   5.711
  247   2HG1  VAL  27          2HG1      VAL  27  10.430   1.317   6.601
  248   3HG1  VAL  27          3HG1      VAL  27   9.672   1.135   5.001
  249   1HG2  VAL  27          1HG2      VAL  27  12.585  -0.598   5.260
  250   2HG2  VAL  27          2HG2      VAL  27  12.339  -0.161   3.552
  251   3HG2  VAL  27          3HG2      VAL  27  13.714   0.519   4.455
  252    H    LYS  28           H        LYS  28  12.795   0.710   2.146
  253    HA   LYS  28           HA       LYS  28  15.204   2.226   2.019
  254   1HB   LYS  28          1HB       LYS  28  13.993   0.029   0.317
  255   2HB   LYS  28          2HB       LYS  28  15.578   0.748  -0.052
  256   1HG   LYS  28          1HG       LYS  28  14.877  -0.355   2.693
  257   2HG   LYS  28          2HG       LYS  28  15.612  -1.354   1.417
  258   1HD   LYS  28          1HD       LYS  28  17.605  -0.597   2.187
  259   2HD   LYS  28          2HD       LYS  28  17.182   0.946   1.405
  260   1HE   LYS  28          1HE       LYS  28  16.997   1.961   3.403
  261   2HE   LYS  28          2HE       LYS  28  15.827   0.741   3.953
  262   1HZ   LYS  28          1HZ       LYS  28  18.658   0.094   3.912
  263   2HZ   LYS  28          2HZ       LYS  28  18.061   1.018   5.140
  264   3HZ   LYS  28          3HZ       LYS  28  17.460  -0.495   4.879
  265    H    VAL  29           H        VAL  29  12.235   2.168   0.047
  266    HA   VAL  29           HA       VAL  29  13.017   3.550  -2.209
  267    HB   VAL  29           HB       VAL  29  10.479   3.863  -0.560
  268   1HG1  VAL  29          1HG1      VAL  29  10.045   5.568  -1.990
  269   2HG1  VAL  29          2HG1      VAL  29  11.438   5.163  -3.021
  270   3HG1  VAL  29          3HG1      VAL  29   9.889   4.314  -3.243
  271   1HG2  VAL  29          1HG2      VAL  29   9.577   2.166  -2.000
  272   2HG2  VAL  29          2HG2      VAL  29  10.992   2.236  -3.078
  273   3HG2  VAL  29          3HG2      VAL  29  11.154   1.558  -1.439
  274    H    GLN  30           H        GLN  30  13.160   4.622   1.060
  275    HA   GLN  30           HA       GLN  30  13.218   7.471   0.255
  276   1HB   GLN  30          1HB       GLN  30  12.647   7.947   2.411
  277   2HB   GLN  30          2HB       GLN  30  12.092   6.255   2.414
  278   1HG   GLN  30          1HG       GLN  30  14.404   5.589   3.193
  279   2HG   GLN  30          2HG       GLN  30  14.780   7.316   3.368
  280   1HE2  GLN  30          1HE2      GLN  30  15.135   6.917   5.657
  281   2HE2  GLN  30          2HE2      GLN  30  13.770   6.787   6.746
  282    H    ARG  31           H        ARG  31  15.223   4.887   1.714
  283    HA   ARG  31           HA       ARG  31  17.460   5.045   2.421
  284   1HB   ARG  31          1HB       ARG  31  17.475   4.042   0.203
  285   2HB   ARG  31          2HB       ARG  31  17.450   5.649  -0.561
  286   1HG   ARG  31          1HG       ARG  31  19.736   5.027  -0.615
  287   2HG   ARG  31          2HG       ARG  31  19.617   6.106   0.796
  288   1HD   ARG  31          1HD       ARG  31  19.381   3.078   0.965
  289   2HD   ARG  31          2HD       ARG  31  20.908   3.956   1.197
  290    HE   ARG  31           HE       ARG  31  18.687   3.758   3.068
  291   1HH1  ARG  31          2HH2      ARG  31  21.454   5.682   1.998
  292   2HH1  ARG  31          1HH2      ARG  31  21.676   6.472   3.543
  293   1HH2  ARG  31          2HH1      ARG  31  18.981   4.801   5.109
  294   2HH2  ARG  31          1HH1      ARG  31  20.266   5.970   5.316
  295    H    GLY  32           H        GLY  32  17.307   6.944   3.803
  296   1HA   GLY  32          1HA       GLY  32  19.156   8.997   3.008
  297   2HA   GLY  32          2HA       GLY  32  17.484   9.602   3.005
  Start of MODEL   18
    1    HA   PRO   1           HA       PRO   1 -17.651  -1.371   3.281
    2   1HB   PRO   1          1HB       PRO   1 -17.943  -0.020   5.629
    3   2HB   PRO   1          2HB       PRO   1 -18.384  -1.752   5.473
    4   1HG   PRO   1          1HG       PRO   1 -15.777  -0.606   6.512
    5   2HG   PRO   1          2HG       PRO   1 -16.831  -1.815   7.315
    6   1HD   PRO   1          1HD       PRO   1 -14.677  -2.573   5.826
    7   2HD   PRO   1          2HD       PRO   1 -16.206  -3.499   5.746
    8    HA   PRO   2           HA       PRO   2 -14.503   1.822   2.310
    9   1HB   PRO   2          1HB       PRO   2 -15.335   2.287  -0.243
   10   2HB   PRO   2          2HB       PRO   2 -14.375   0.834   0.189
   11   1HG   PRO   2          1HG       PRO   2 -17.390   1.040  -0.054
   12   2HG   PRO   2          2HG       PRO   2 -16.314  -0.160  -0.843
   13   1HD   PRO   2          1HD       PRO   2 -17.603  -0.725   1.492
   14   2HD   PRO   2          2HD       PRO   2 -15.917  -1.265   1.232
   15    H    LEU   3           H        LEU   3 -15.342   3.951   0.719
   16    HA   LEU   3           HA       LEU   3 -17.527   5.074   2.396
   17   1HB   LEU   3          1HB       LEU   3 -15.130   6.081   2.305
   18   2HB   LEU   3          2HB       LEU   3 -15.601   6.664   0.691
   19    HG   LEU   3           HG       LEU   3 -16.182   8.439   2.166
   20   1HD1  LEU   3          1HD1      LEU   3 -18.762   6.844   2.038
   21   2HD1  LEU   3          2HD1      LEU   3 -18.542   8.605   1.903
   22   3HD1  LEU   3          3HD1      LEU   3 -18.013   7.538   0.580
   23   1HD2  LEU   3          1HD2      LEU   3 -17.771   6.612   3.967
   24   2HD2  LEU   3          2HD2      LEU   3 -16.009   6.743   4.184
   25   3HD2  LEU   3          3HD2      LEU   3 -17.034   8.191   4.329
   26    H    SER   4           H        SER   4 -16.178   5.658  -0.902
   27    HA   SER   4           HA       SER   4 -18.982   5.568  -1.911
   28   1HB   SER   4          1HB       SER   4 -17.489   7.844  -1.733
   29   2HB   SER   4          2HB       SER   4 -17.014   7.266  -3.348
   30    HG   SER   4           HG       SER   4 -18.884   7.877  -4.026
   31    H    GLN   5           H        GLN   5 -16.063   4.027  -1.857
   32    HA   GLN   5           HA       GLN   5 -15.380   2.224  -3.140
   33   1HB   GLN   5          1HB       GLN   5 -17.923   2.450  -4.003
   34   2HB   GLN   5          2HB       GLN   5 -17.079   2.948  -5.489
   35   1HG   GLN   5          1HG       GLN   5 -15.757   0.896  -5.477
   36   2HG   GLN   5          2HG       GLN   5 -16.459   0.416  -3.916
   37   1HE2  GLN   5          1HE2      GLN   5 -19.096   0.767  -4.094
   38   2HE2  GLN   5          2HE2      GLN   5 -19.792  -0.136  -5.423
   39    H    GLU   6           H        GLU   6 -15.721   5.500  -4.330
   40    HA   GLU   6           HA       GLU   6 -14.370   5.713  -6.639
   41   1HB   GLU   6          1HB       GLU   6 -14.423   7.285  -4.136
   42   2HB   GLU   6          2HB       GLU   6 -13.007   7.597  -5.169
   43   1HG   GLU   6          1HG       GLU   6 -14.481   8.000  -7.097
   44   2HG   GLU   6          2HG       GLU   6 -15.907   7.635  -6.101
   45    H    THR   7           H        THR   7 -12.460   5.789  -3.577
   46    HA   THR   7           HA       THR   7 -10.155   4.730  -5.078
   47    HB   THR   7           HB       THR   7  -9.777   5.175  -2.215
   48    HG1  THR   7           1HG      THR   7 -11.036   6.846  -2.099
   49   1HG2  THR   7          1HG2      THR   7  -7.849   6.248  -2.971
   50   2HG2  THR   7          2HG2      THR   7  -8.183   5.153  -4.334
   51   3HG2  THR   7          3HG2      THR   7  -8.645   6.869  -4.437
   52    H    PHE   8           H        PHE   8 -10.664   4.067  -1.655
   53    HA   PHE   8           HA       PHE   8  -9.956   1.829  -0.924
   54   1HB   PHE   8          1HB       PHE   8 -12.920   1.582  -1.359
   55   2HB   PHE   8          2HB       PHE   8 -11.951   1.143   0.057
   56    HD1  PHE   8           1HD      PHE   8 -12.395   4.313  -1.923
   57    HD2  PHE   8           2HD      PHE   8 -12.564   2.380   1.910
   58    HE1  PHE   8           1HE      PHE   8 -12.971   6.477  -0.857
   59    HE2  PHE   8           2HE      PHE   8 -13.140   4.544   2.975
   60    HZ   PHE   8           HZ       PHE   8 -13.344   6.593   1.592
   61    H    SER   9           H        SER   9 -12.574   1.511  -3.397
   62    HA   SER   9           HA       SER   9 -12.445  -1.074  -4.091
   63   1HB   SER   9          1HB       SER   9 -13.695   0.819  -5.257
   64   2HB   SER   9          2HB       SER   9 -12.216   1.088  -6.211
   65    HG   SER   9           HG       SER   9 -12.358  -1.179  -6.768
   66    H    ASP  10           H        ASP  10 -10.174   1.333  -5.545
   67    HA   ASP  10           HA       ASP  10  -8.407  -0.886  -6.341
   68   1HB   ASP  10          1HB       ASP  10  -9.070   1.676  -7.374
   69   2HB   ASP  10          2HB       ASP  10  -7.361   1.748  -6.891
   70    H    LEU  11           H        LEU  11  -8.531   1.922  -4.143
   71    HA   LEU  11           HA       LEU  11  -5.830   1.875  -3.305
   72   1HB   LEU  11          1HB       LEU  11  -8.274   3.204  -2.613
   73   2HB   LEU  11          2HB       LEU  11  -7.532   2.590  -1.116
   74    HG   LEU  11           HG       LEU  11  -5.360   3.617  -1.817
   75   1HD1  LEU  11          1HD1      LEU  11  -5.118   4.171  -3.991
   76   2HD1  LEU  11          2HD1      LEU  11  -6.857   3.934  -4.289
   77   3HD1  LEU  11          3HD1      LEU  11  -6.258   5.511  -3.721
   78   1HD2  LEU  11          1HD2      LEU  11  -6.363   6.084  -1.760
   79   2HD2  LEU  11          2HD2      LEU  11  -7.877   5.217  -1.407
   80   3HD2  LEU  11          3HD2      LEU  11  -6.469   5.023  -0.335
   81    H    TRP  12           H        TRP  12  -8.584   0.799  -1.250
   82    HA   TRP  12           HA       TRP  12  -7.235  -0.666   0.601
   83   1HB   TRP  12          1HB       TRP  12  -9.900  -0.586  -0.480
   84   2HB   TRP  12          2HB       TRP  12  -9.458  -2.267  -0.153
   85    HD1  TRP  12           HD       TRP  12 -11.233   0.325   1.437
   86    HE1  TRP  12           1HE      TRP  12 -11.196   0.214   3.982
   87    HE3  TRP  12           3HE      TRP  12  -7.280  -2.868   2.049
   88    HZ2  TRP  12           2HZ      TRP  12  -9.644  -1.098   6.042
   89    HZ3  TRP  12           3HZ      TRP  12  -6.553  -3.524   4.314
   90    HH2  TRP  12           HH       TRP  12  -7.720  -2.650   6.316
   91    H    LYS  13           H        LYS  13  -8.570  -2.161  -2.407
   92    HA   LYS  13           HA       LYS  13  -7.368  -4.653  -2.147
   93   1HB   LYS  13          1HB       LYS  13  -8.985  -3.531  -3.966
   94   2HB   LYS  13          2HB       LYS  13  -7.456  -3.401  -4.866
   95   1HG   LYS  13          1HG       LYS  13  -7.693  -5.572  -5.438
   96   2HG   LYS  13          2HG       LYS  13  -7.447  -5.990  -3.725
   97   1HD   LYS  13          1HD       LYS  13 -10.060  -5.226  -3.659
   98   2HD   LYS  13          2HD       LYS  13  -9.963  -5.860  -5.319
   99   1HE   LYS  13          1HE       LYS  13  -9.306  -8.007  -4.590
  100   2HE   LYS  13          2HE       LYS  13  -8.811  -7.412  -2.991
  101   1HZ   LYS  13          1HZ       LYS  13 -10.787  -8.283  -2.484
  102   2HZ   LYS  13          2HZ       LYS  13 -11.329  -6.790  -2.931
  103   3HZ   LYS  13          3HZ       LYS  13 -11.441  -8.057  -3.981
  104    H    LEU  14           H        LEU  14  -6.017  -1.638  -3.542
  105    HA   LEU  14           HA       LEU  14  -3.583  -2.762  -4.466
  106   1HB   LEU  14          1HB       LEU  14  -4.568  -0.018  -3.728
  107   2HB   LEU  14          2HB       LEU  14  -2.827  -0.264  -4.002
  108    HG   LEU  14           HG       LEU  14  -4.832   0.101  -5.966
  109   1HD1  LEU  14          1HD1      LEU  14  -2.614  -0.918  -7.292
  110   2HD1  LEU  14          2HD1      LEU  14  -2.827   0.776  -6.788
  111   3HD1  LEU  14          3HD1      LEU  14  -1.927  -0.355  -5.749
  112   1HD2  LEU  14          1HD2      LEU  14  -5.024  -1.930  -7.143
  113   2HD2  LEU  14          2HD2      LEU  14  -3.642  -2.663  -6.294
  114   3HD2  LEU  14          3HD2      LEU  14  -5.190  -2.439  -5.445
  115    H    LEU  15           H        LEU  15  -4.463  -1.201  -1.345
  116    HA   LEU  15           HA       LEU  15  -1.844  -1.569  -0.207
  117   1HB   LEU  15          1HB       LEU  15  -4.567  -1.029   1.042
  118   2HB   LEU  15          2HB       LEU  15  -3.016  -0.963   1.914
  119    HG   LEU  15           HG       LEU  15  -3.987   0.809  -0.350
  120   1HD1  LEU  15          1HD1      LEU  15  -4.010   2.455   1.233
  121   2HD1  LEU  15          2HD1      LEU  15  -4.102   1.091   2.373
  122   3HD1  LEU  15          3HD1      LEU  15  -2.532   1.853   2.022
  123   1HD2  LEU  15          1HD2      LEU  15  -1.154   0.334   0.655
  124   2HD2  LEU  15          2HD2      LEU  15  -1.757   0.180  -1.013
  125   3HD2  LEU  15          3HD2      LEU  15  -1.637   1.786  -0.254
  126    H    LYS  16           H        LYS  16  -4.404  -3.704  -0.924
  127    HA   LYS  16           HA       LYS  16  -4.055  -5.482   1.343
  128   1HB   LYS  16          1HB       LYS  16  -6.002  -5.109  -0.554
  129   2HB   LYS  16          2HB       LYS  16  -5.183  -6.563  -1.171
  130   1HG   LYS  16          1HG       LYS  16  -5.483  -7.706   0.950
  131   2HG   LYS  16          2HG       LYS  16  -6.115  -6.226   1.709
  132   1HD   LYS  16          1HD       LYS  16  -7.777  -6.460  -0.464
  133   2HD   LYS  16          2HD       LYS  16  -7.464  -8.170  -0.082
  134   1HE   LYS  16          1HE       LYS  16  -7.960  -7.514   2.372
  135   2HE   LYS  16          2HE       LYS  16  -8.648  -6.021   1.698
  136   1HZ   LYS  16          1HZ       LYS  16 -10.312  -7.160   0.711
  137   2HZ   LYS  16          2HZ       LYS  16  -9.486  -8.586   0.627
  138   3HZ   LYS  16          3HZ       LYS  16 -10.109  -8.077   2.067
  139    H    LYS  17           H        LYS  17  -1.806  -4.609  -0.712
  140    HA   LYS  17           HA       LYS  17  -0.389  -7.122  -0.547
  141   1HB   LYS  17          1HB       LYS  17  -1.198  -7.966  -2.491
  142   2HB   LYS  17          2HB       LYS  17  -1.836  -6.392  -3.022
  143   1HG   LYS  17          1HG       LYS  17   1.121  -7.125  -3.040
  144   2HG   LYS  17          2HG       LYS  17   0.051  -7.273  -4.455
  145   1HD   LYS  17          1HD       LYS  17  -0.438  -4.687  -3.474
  146   2HD   LYS  17          2HD       LYS  17   1.324  -4.892  -3.328
  147   1HE   LYS  17          1HE       LYS  17   0.243  -5.959  -5.848
  148   2HE   LYS  17          2HE       LYS  17  -0.050  -4.218  -5.652
  149   1HZ   LYS  17          1HZ       LYS  17   2.005  -4.353  -6.614
  150   2HZ   LYS  17          2HZ       LYS  17   2.377  -4.150  -5.020
  151   3HZ   LYS  17          3HZ       LYS  17   2.493  -5.644  -5.710
  152    H    TRP  18           H        TRP  18  -0.705  -3.829  -1.876
  153    HA   TRP  18           HA       TRP  18   2.129  -3.518  -2.347
  154   1HB   TRP  18          1HB       TRP  18  -0.068  -2.246  -3.225
  155   2HB   TRP  18          2HB       TRP  18   0.346  -1.174  -1.880
  156    HD1  TRP  18           HD       TRP  18   0.978  -1.632  -5.425
  157    HE1  TRP  18           1HE      TRP  18   2.981  -0.290  -6.246
  158    HE3  TRP  18           3HE      TRP  18   3.065  -0.449  -0.903
  159    HZ2  TRP  18           2HZ      TRP  18   5.223   1.129  -5.090
  160    HZ3  TRP  18           3HZ      TRP  18   5.131   0.897  -0.804
  161    HH2  TRP  18           HH       TRP  18   6.220   1.691  -2.882
  162    H    LYS  19           H        LYS  19  -0.166  -2.564   0.243
  163    HA   LYS  19           HA       LYS  19   1.287  -0.950   1.852
  164   1HB   LYS  19          1HB       LYS  19  -0.947  -1.891   2.391
  165   2HB   LYS  19          2HB       LYS  19  -0.179  -3.444   2.797
  166   1HG   LYS  19          1HG       LYS  19   1.330  -1.928   4.365
  167   2HG   LYS  19          2HG       LYS  19  -0.045  -0.805   4.248
  168   1HD   LYS  19          1HD       LYS  19  -0.533  -3.721   4.869
  169   2HD   LYS  19          2HD       LYS  19  -0.009  -2.615   6.161
  170   1HE   LYS  19          1HE       LYS  19  -2.181  -2.036   6.371
  171   2HE   LYS  19          2HE       LYS  19  -1.994  -1.178   4.827
  172   1HZ   LYS  19          1HZ       LYS  19  -2.394  -3.761   4.147
  173   2HZ   LYS  19          2HZ       LYS  19  -3.436  -3.529   5.404
  174   3HZ   LYS  19          3HZ       LYS  19  -3.509  -2.548   4.080
  175    H    MET  20           H        MET  20   1.759  -4.498   1.549
  176    HA   MET  20           HA       MET  20   3.556  -5.096   3.472
  177   1HB   MET  20          1HB       MET  20   3.470  -6.914   2.138
  178   2HB   MET  20          2HB       MET  20   3.116  -5.935   0.695
  179   1HG   MET  20          1HG       MET  20   5.785  -5.341   1.397
  180   2HG   MET  20          2HG       MET  20   5.630  -7.097   1.572
  181   1HE   MET  20          1HE       MET  20   3.663  -4.733  -0.546
  182   2HE   MET  20          2HE       MET  20   5.157  -4.081  -1.260
  183   3HE   MET  20          3HE       MET  20   4.074  -5.098  -2.239
  184    H    ARG  21           H        ARG  21   4.311  -3.255   0.483
  185    HA   ARG  21           HA       ARG  21   7.042  -2.761   1.482
  186   1HB   ARG  21          1HB       ARG  21   5.573  -2.293  -1.122
  187   2HB   ARG  21          2HB       ARG  21   7.129  -1.496  -0.786
  188   1HG   ARG  21          1HG       ARG  21   8.306  -3.511  -0.740
  189   2HG   ARG  21          2HG       ARG  21   6.862  -4.463  -0.316
  190   1HD   ARG  21          1HD       ARG  21   6.055  -3.527  -2.710
  191   2HD   ARG  21          2HD       ARG  21   7.810  -3.501  -2.988
  192    HE   ARG  21           HE       ARG  21   7.436  -5.989  -1.949
  193   1HH1  ARG  21          2HH2      ARG  21   5.821  -4.167  -4.512
  194   2HH1  ARG  21          1HH2      ARG  21   5.402  -5.586  -5.445
  195   1HH2  ARG  21          2HH1      ARG  21   6.882  -7.864  -3.181
  196   2HH2  ARG  21          1HH1      ARG  21   6.007  -7.694  -4.686
  197    H    ARG  22           H        ARG  22   4.047  -0.990   0.582
  198    HA   ARG  22           HA       ARG  22   5.056   1.603   1.192
  199   1HB   ARG  22          1HB       ARG  22   3.031   1.140  -0.175
  200   2HB   ARG  22          2HB       ARG  22   2.197   0.563   1.288
  201   1HG   ARG  22          1HG       ARG  22   3.337   3.083   1.950
  202   2HG   ARG  22          2HG       ARG  22   2.566   3.281   0.358
  203   1HD   ARG  22          1HD       ARG  22   0.989   3.719   2.238
  204   2HD   ARG  22          2HD       ARG  22   0.470   2.359   1.219
  205    HE   ARG  22           HE       ARG  22   1.861   1.069   3.147
  206   1HH1  ARG  22          2HH2      ARG  22  -0.577   3.626   3.286
  207   2HH1  ARG  22          1HH2      ARG  22  -1.208   3.129   4.841
  208   1HH2  ARG  22          2HH1      ARG  22   1.028   0.413   5.200
  209   2HH2  ARG  22          1HH1      ARG  22  -0.292   1.297   5.932
  210    H    ASN  23           H        ASN  23   5.300  -0.767   3.228
  211    HA   ASN  23           HA       ASN  23   4.701   0.935   5.565
  212   1HB   ASN  23          1HB       ASN  23   2.968  -1.105   4.811
  213   2HB   ASN  23          2HB       ASN  23   4.011  -1.879   6.024
  214   1HD2  ASN  23          1HD2      ASN  23   1.895  -1.941   7.239
  215   2HD2  ASN  23          2HD2      ASN  23   1.477  -0.544   8.208
  216    H    GLN  24           H        GLN  24   6.992  -0.402   3.858
  217    HA   GLN  24           HA       GLN  24   8.771  -0.761   6.083
  218   1HB   GLN  24          1HB       GLN  24   7.659  -3.194   4.676
  219   2HB   GLN  24          2HB       GLN  24   9.307  -3.206   5.350
  220   1HG   GLN  24          1HG       GLN  24   7.954  -2.123   7.442
  221   2HG   GLN  24          2HG       GLN  24   6.668  -3.129   6.739
  222   1HE2  GLN  24          1HE2      GLN  24   8.036  -3.483   9.318
  223   2HE2  GLN  24          2HE2      GLN  24   8.807  -5.054   9.259
  224    H    PHE  25           H        PHE  25   9.233  -2.854   3.333
  225    HA   PHE  25           HA       PHE  25  11.639  -1.995   2.484
  226   1HB   PHE  25          1HB       PHE  25  10.715  -3.801   1.328
  227   2HB   PHE  25          2HB       PHE  25   9.222  -2.925   0.948
  228    HD1  PHE  25           1HD      PHE  25   9.685  -0.680  -0.509
  229    HD2  PHE  25           2HD      PHE  25  12.160  -4.189  -0.429
  230    HE1  PHE  25           1HE      PHE  25  10.600  -0.085  -2.736
  231    HE2  PHE  25           2HE      PHE  25  13.075  -3.595  -2.656
  232    HZ   PHE  25           HZ       PHE  25  12.295  -1.543  -3.809
  233    H    TRP  26           H        TRP  26   8.532  -0.363   1.811
  234    HA   TRP  26           HA       TRP  26   9.354   1.511  -0.074
  235   1HB   TRP  26          1HB       TRP  26   7.441   2.687   0.484
  236   2HB   TRP  26          2HB       TRP  26   7.055   1.053   1.042
  237    HD1  TRP  26           HD       TRP  26   6.449   0.747   3.506
  238    HE1  TRP  26           1HE      TRP  26   6.251   2.256   5.548
  239    HE3  TRP  26           3HE      TRP  26   8.640   4.964   1.607
  240    HZ2  TRP  26           2HZ      TRP  26   6.954   4.967   6.279
  241    HZ3  TRP  26           3HZ      TRP  26   8.857   6.987   3.003
  242    HH2  TRP  26           HH       TRP  26   8.022   7.005   5.335
  243    H    VAL  27           H        VAL  27   9.709   1.597   3.494
  244    HA   VAL  27           HA       VAL  27  10.607   4.126   3.963
  245    HB   VAL  27           HB       VAL  27  11.871   3.231   5.800
  246   1HG1  VAL  27          1HG1      VAL  27   9.937   2.546   6.728
  247   2HG1  VAL  27          2HG1      VAL  27   9.246   2.306   5.106
  248   3HG1  VAL  27          3HG1      VAL  27  10.102   0.971   5.915
  249   1HG2  VAL  27          1HG2      VAL  27  13.323   1.655   4.765
  250   2HG2  VAL  27          2HG2      VAL  27  12.276   0.678   5.823
  251   3HG2  VAL  27          3HG2      VAL  27  11.964   0.738   4.071
  252    H    LYS  28           H        LYS  28  12.541   1.440   2.558
  253    HA   LYS  28           HA       LYS  28  14.966   2.908   2.344
  254   1HB   LYS  28          1HB       LYS  28  13.811   0.486   0.944
  255   2HB   LYS  28          2HB       LYS  28  15.402   1.148   0.496
  256   1HG   LYS  28          1HG       LYS  28  16.261  -0.058   2.204
  257   2HG   LYS  28          2HG       LYS  28  15.439   1.076   3.303
  258   1HD   LYS  28          1HD       LYS  28  13.665  -0.371   3.691
  259   2HD   LYS  28          2HD       LYS  28  13.839  -1.176   2.113
  260   1HE   LYS  28          1HE       LYS  28  15.782  -1.438   4.443
  261   2HE   LYS  28          2HE       LYS  28  14.547  -2.637   4.003
  262   1HZ   LYS  28          1HZ       LYS  28  15.807  -2.297   1.712
  263   2HZ   LYS  28          2HZ       LYS  28  17.057  -2.053   2.760
  264   3HZ   LYS  28          3HZ       LYS  28  16.199  -3.461   2.812
  265    H    VAL  29           H        VAL  29  12.124   2.574   0.214
  266    HA   VAL  29           HA       VAL  29  13.059   3.629  -2.156
  267    HB   VAL  29           HB       VAL  29  10.424   4.175  -0.735
  268   1HG1  VAL  29          1HG1      VAL  29  10.752   5.824  -2.493
  269   2HG1  VAL  29          2HG1      VAL  29  11.302   4.567  -3.626
  270   3HG1  VAL  29          3HG1      VAL  29   9.607   4.596  -3.084
  271   1HG2  VAL  29          1HG2      VAL  29   9.599   2.289  -1.979
  272   2HG2  VAL  29          2HG2      VAL  29  11.089   2.195  -2.948
  273   3HG2  VAL  29          3HG2      VAL  29  11.122   1.767  -1.220
  274    H    GLN  30           H        GLN  30  12.987   5.153   0.935
  275    HA   GLN  30           HA       GLN  30  13.121   7.860  -0.253
  276   1HB   GLN  30          1HB       GLN  30  12.426   8.627   1.778
  277   2HB   GLN  30          2HB       GLN  30  11.866   6.950   1.985
  278   1HG   GLN  30          1HG       GLN  30  14.126   6.408   2.980
  279   2HG   GLN  30          2HG       GLN  30  14.498   8.145   2.935
  280   1HE2  GLN  30          1HE2      GLN  30  14.674   7.184   5.377
  281   2HE2  GLN  30          2HE2      GLN  30  13.266   7.541   6.353
  282    H    ARG  31           H        ARG  31  15.023   5.509   1.667
  283    HA   ARG  31           HA       ARG  31  17.216   5.754   2.466
  284   1HB   ARG  31          1HB       ARG  31  17.415   4.470   0.436
  285   2HB   ARG  31          2HB       ARG  31  17.327   5.938  -0.567
  286   1HG   ARG  31          1HG       ARG  31  19.523   6.430  -0.239
  287   2HG   ARG  31          2HG       ARG  31  19.446   6.023   1.492
  288   1HD   ARG  31          1HD       ARG  31  19.755   3.705   1.074
  289   2HD   ARG  31          2HD       ARG  31  19.379   3.882  -0.653
  290    HE   ARG  31           HE       ARG  31  21.699   5.429   0.131
  291   1HH1  ARG  31          2HH2      ARG  31  20.527   2.208  -0.738
  292   2HH1  ARG  31          1HH2      ARG  31  22.078   1.652  -1.325
  293   1HH2  ARG  31          2HH1      ARG  31  23.748   4.694  -0.644
  294   2HH2  ARG  31          1HH1      ARG  31  23.915   3.070  -1.272
  295    H    GLY  32           H        GLY  32  16.869   7.856   3.550
  296   1HA   GLY  32          1HA       GLY  32  18.787   9.807   2.575
  297   2HA   GLY  32          2HA       GLY  32  17.105  10.379   2.505
  Start of MODEL   19
    1    HA   PRO   1           HA       PRO   1 -10.786  10.285   2.939
    2   1HB   PRO   1          1HB       PRO   1 -13.157   8.957   3.134
    3   2HB   PRO   1          2HB       PRO   1 -12.240   9.472   4.587
    4   1HG   PRO   1          1HG       PRO   1 -14.531  10.935   3.245
    5   2HG   PRO   1          2HG       PRO   1 -14.383  10.504   4.980
    6   1HD   PRO   1          1HD       PRO   1 -13.669  12.969   4.063
    7   2HD   PRO   1          2HD       PRO   1 -12.686  12.146   5.311
    8    HA   PRO   2           HA       PRO   2 -11.973  10.161  -1.299
    9   1HB   PRO   2          1HB       PRO   2 -12.201   7.510  -1.887
   10   2HB   PRO   2          2HB       PRO   2 -10.640   8.236  -1.382
   11   1HG   PRO   2          1HG       PRO   2 -12.654   6.803   0.374
   12   2HG   PRO   2          2HG       PRO   2 -10.896   6.470   0.239
   13   1HD   PRO   2          1HD       PRO   2 -11.894   8.060   2.215
   14   2HD   PRO   2          2HD       PRO   2 -10.359   8.484   1.398
   15    H    LEU   3           H        LEU   3 -14.131   9.635   1.129
   16    HA   LEU   3           HA       LEU   3 -16.434   9.989   1.030
   17   1HB   LEU   3          1HB       LEU   3 -15.788  10.471  -1.587
   18   2HB   LEU   3          2HB       LEU   3 -16.802   9.016  -1.746
   19    HG   LEU   3           HG       LEU   3 -18.160  10.571   0.139
   20   1HD1  LEU   3          1HD1      LEU   3 -16.747  12.509  -0.359
   21   2HD1  LEU   3          2HD1      LEU   3 -17.047  12.311  -2.102
   22   3HD1  LEU   3          3HD1      LEU   3 -18.379  12.779  -1.018
   23   1HD2  LEU   3          1HD2      LEU   3 -19.409  11.163  -2.242
   24   2HD2  LEU   3          2HD2      LEU   3 -18.442   9.738  -2.691
   25   3HD2  LEU   3          3HD2      LEU   3 -19.609   9.636  -1.350
   26    H    SER   4           H        SER   4 -14.553   7.284   0.521
   27    HA   SER   4           HA       SER   4 -14.919   5.106   1.178
   28   1HB   SER   4          1HB       SER   4 -16.898   6.391   2.517
   29   2HB   SER   4          2HB       SER   4 -17.874   5.378   1.427
   30    HG   SER   4           HG       SER   4 -15.820   4.521   3.191
   31    H    GLN   5           H        GLN   5 -15.097   3.334  -0.113
   32    HA   GLN   5           HA       GLN   5 -16.002   1.964  -1.771
   33   1HB   GLN   5          1HB       GLN   5 -18.118   3.589  -1.403
   34   2HB   GLN   5          2HB       GLN   5 -17.613   4.154  -3.014
   35   1HG   GLN   5          1HG       GLN   5 -17.409   1.414  -3.274
   36   2HG   GLN   5          2HG       GLN   5 -18.811   1.576  -2.195
   37   1HE2  GLN   5          1HE2      GLN   5 -19.453   0.505  -4.526
   38   2HE2  GLN   5          2HE2      GLN   5 -20.211   1.654  -5.608
   39    H    GLU   6           H        GLU   6 -15.284   5.393  -2.528
   40    HA   GLU   6           HA       GLU   6 -14.532   5.149  -5.195
   41   1HB   GLU   6          1HB       GLU   6 -13.752   6.912  -2.903
   42   2HB   GLU   6          2HB       GLU   6 -12.747   6.968  -4.371
   43   1HG   GLU   6          1HG       GLU   6 -15.778   7.259  -4.340
   44   2HG   GLU   6          2HG       GLU   6 -14.638   8.621  -4.391
   45    H    THR   7           H        THR   7 -12.610   4.462  -2.241
   46    HA   THR   7           HA       THR   7 -10.409   3.467  -3.949
   47    HB   THR   7           HB       THR   7  -9.950   3.190  -1.112
   48    HG1  THR   7           1HG      THR   7 -10.814   5.738  -2.026
   49   1HG2  THR   7          1HG2      THR   7  -8.236   3.463  -2.882
   50   2HG2  THR   7          2HG2      THR   7  -8.847   5.101  -3.217
   51   3HG2  THR   7          3HG2      THR   7  -8.094   4.735  -1.646
   52    H    PHE   8           H        PHE   8 -10.930   2.144  -0.760
   53    HA   PHE   8           HA       PHE   8 -10.673  -0.243  -0.478
   54   1HB   PHE   8          1HB       PHE   8 -13.612   0.078  -1.072
   55   2HB   PHE   8          2HB       PHE   8 -12.829  -0.875   0.201
   56    HD1  PHE   8           1HD      PHE   8 -12.599   2.728  -0.861
   57    HD2  PHE   8           2HD      PHE   8 -13.394  -0.075   2.295
   58    HE1  PHE   8           1HE      PHE   8 -12.901   4.606   0.731
   59    HE2  PHE   8           2HE      PHE   8 -13.696   1.802   3.887
   60    HZ   PHE   8           HZ       PHE   8 -13.450   4.143   3.105
   61    H    SER   9           H        SER   9 -13.149   0.291  -3.057
   62    HA   SER   9           HA       SER   9 -13.278  -2.096  -4.271
   63   1HB   SER   9          1HB       SER   9 -14.275   0.078  -5.074
   64   2HB   SER   9          2HB       SER   9 -12.706   0.451  -5.829
   65    HG   SER   9           HG       SER   9 -13.482  -0.665  -7.424
   66    H    ASP  10           H        ASP  10 -10.679   0.259  -5.144
   67    HA   ASP  10           HA       ASP  10  -9.055  -2.066  -6.046
   68   1HB   ASP  10          1HB       ASP  10  -9.634   0.527  -7.159
   69   2HB   ASP  10          2HB       ASP  10  -7.893   0.414  -6.823
   70    H    LEU  11           H        LEU  11  -9.442   0.258  -3.563
   71    HA   LEU  11           HA       LEU  11  -6.679   0.672  -2.895
   72   1HB   LEU  11          1HB       LEU  11  -8.843   1.974  -2.191
   73   2HB   LEU  11          2HB       LEU  11  -8.938   0.756  -0.896
   74    HG   LEU  11           HG       LEU  11  -7.183   3.064  -1.120
   75   1HD1  LEU  11          1HD1      LEU  11  -6.724   2.428   1.256
   76   2HD1  LEU  11          2HD1      LEU  11  -8.463   2.470   0.882
   77   3HD1  LEU  11          3HD1      LEU  11  -7.614   0.909   0.993
   78   1HD2  LEU  11          1HD2      LEU  11  -5.531   1.589  -2.084
   79   2HD2  LEU  11          2HD2      LEU  11  -5.106   1.809  -0.370
   80   3HD2  LEU  11          3HD2      LEU  11  -5.905   0.310  -0.904
   81    H    TRP  12           H        TRP  12  -9.052  -0.950  -0.753
   82    HA   TRP  12           HA       TRP  12  -7.355  -2.422   0.771
   83   1HB   TRP  12          1HB       TRP  12 -10.118  -2.547  -0.006
   84   2HB   TRP  12          2HB       TRP  12  -9.470  -4.192   0.069
   85    HD1  TRP  12           HD       TRP  12 -11.286  -1.984   2.139
   86    HE1  TRP  12           1HE      TRP  12 -10.944  -2.373   4.633
   87    HE3  TRP  12           3HE      TRP  12  -7.021  -4.807   1.938
   88    HZ2  TRP  12           2HZ      TRP  12  -9.053  -3.741   6.344
   89    HZ3  TRP  12           3HZ      TRP  12  -5.981  -5.634   4.017
   90    HH2  TRP  12           HH       TRP  12  -6.981  -5.111   6.222
   91    H    LYS  13           H        LYS  13  -8.834  -3.733  -2.255
   92    HA   LYS  13           HA       LYS  13  -7.451  -6.109  -2.426
   93   1HB   LYS  13          1HB       LYS  13  -8.979  -4.434  -4.158
   94   2HB   LYS  13          2HB       LYS  13  -7.511  -4.915  -5.042
   95   1HG   LYS  13          1HG       LYS  13  -7.977  -7.304  -4.252
   96   2HG   LYS  13          2HG       LYS  13  -9.570  -6.718  -3.716
   97   1HD   LYS  13          1HD       LYS  13 -10.140  -6.026  -5.974
   98   2HD   LYS  13          2HD       LYS  13  -8.496  -6.391  -6.548
   99   1HE   LYS  13          1HE       LYS  13  -9.760  -8.658  -5.165
  100   2HE   LYS  13          2HE       LYS  13 -10.668  -8.133  -6.600
  101   1HZ   LYS  13          1HZ       LYS  13  -7.800  -8.401  -6.833
  102   2HZ   LYS  13          2HZ       LYS  13  -8.691  -9.786  -6.753
  103   3HZ   LYS  13          3HZ       LYS  13  -8.984  -8.685  -7.946
  104    H    LEU  14           H        LEU  14  -6.338  -2.868  -3.517
  105    HA   LEU  14           HA       LEU  14  -3.867  -3.719  -4.602
  106   1HB   LEU  14          1HB       LEU  14  -5.046  -1.157  -3.596
  107   2HB   LEU  14          2HB       LEU  14  -3.281  -1.227  -3.810
  108    HG   LEU  14           HG       LEU  14  -5.113  -0.696  -5.820
  109   1HD1  LEU  14          1HD1      LEU  14  -2.321  -1.908  -5.945
  110   2HD1  LEU  14          2HD1      LEU  14  -3.159  -1.196  -7.344
  111   3HD1  LEU  14          3HD1      LEU  14  -2.744  -0.179  -5.943
  112   1HD2  LEU  14          1HD2      LEU  14  -5.483  -2.589  -7.135
  113   2HD2  LEU  14          2HD2      LEU  14  -4.116  -3.478  -6.422
  114   3HD2  LEU  14          3HD2      LEU  14  -5.624  -3.274  -5.498
  115    H    LEU  15           H        LEU  15  -4.747  -2.579  -1.304
  116    HA   LEU  15           HA       LEU  15  -2.070  -2.912  -0.284
  117   1HB   LEU  15          1HB       LEU  15  -4.672  -1.982   0.644
  118   2HB   LEU  15          2HB       LEU  15  -3.878  -3.007   1.863
  119    HG   LEU  15           HG       LEU  15  -1.968  -1.611   1.962
  120   1HD1  LEU  15          1HD1      LEU  15  -2.410   0.416   0.006
  121   2HD1  LEU  15          2HD1      LEU  15  -1.111  -0.800   0.043
  122   3HD1  LEU  15          3HD1      LEU  15  -2.632  -1.149  -0.813
  123   1HD2  LEU  15          1HD2      LEU  15  -3.099   0.816   1.879
  124   2HD2  LEU  15          2HD2      LEU  15  -4.586  -0.155   1.750
  125   3HD2  LEU  15          3HD2      LEU  15  -3.508  -0.359   3.152
  126    H    LYS  16           H        LYS  16  -4.518  -5.096  -1.175
  127    HA   LYS  16           HA       LYS  16  -4.037  -7.074   0.894
  128   1HB   LYS  16          1HB       LYS  16  -6.027  -6.614  -0.951
  129   2HB   LYS  16          2HB       LYS  16  -5.147  -7.972  -1.693
  130   1HG   LYS  16          1HG       LYS  16  -5.294  -9.215   0.461
  131   2HG   LYS  16          2HG       LYS  16  -6.230  -7.870   1.155
  132   1HD   LYS  16          1HD       LYS  16  -8.089  -8.860   0.342
  133   2HD   LYS  16          2HD       LYS  16  -7.502  -8.465  -1.291
  134   1HE   LYS  16          1HE       LYS  16  -6.379 -10.888   0.087
  135   2HE   LYS  16          2HE       LYS  16  -8.026 -10.983  -0.573
  136   1HZ   LYS  16          1HZ       LYS  16  -5.758 -11.347  -1.952
  137   2HZ   LYS  16          2HZ       LYS  16  -7.239 -11.030  -2.607
  138   3HZ   LYS  16          3HZ       LYS  16  -6.167  -9.801  -2.357
  139    H    LYS  17           H        LYS  17  -1.872  -5.875  -1.081
  140    HA   LYS  17           HA       LYS  17  -0.320  -8.308  -1.193
  141   1HB   LYS  17          1HB       LYS  17  -1.115  -8.998  -3.202
  142   2HB   LYS  17          2HB       LYS  17  -1.851  -7.418  -3.562
  143   1HG   LYS  17          1HG       LYS  17   1.141  -7.972  -3.695
  144   2HG   LYS  17          2HG       LYS  17   0.054  -8.039  -5.102
  145   1HD   LYS  17          1HD       LYS  17  -0.561  -5.598  -3.857
  146   2HD   LYS  17          2HD       LYS  17   1.212  -5.714  -3.756
  147   1HE   LYS  17          1HE       LYS  17   0.582  -6.630  -6.336
  148   2HE   LYS  17          2HE       LYS  17  -0.492  -5.237  -6.082
  149   1HZ   LYS  17          1HZ       LYS  17   2.244  -5.260  -6.590
  150   2HZ   LYS  17          2HZ       LYS  17   1.224  -3.970  -6.465
  151   3HZ   LYS  17          3HZ       LYS  17   1.986  -4.552  -5.123
  152    H    TRP  18           H        TRP  18  -0.839  -4.922  -2.180
  153    HA   TRP  18           HA       TRP  18   1.967  -4.409  -2.651
  154   1HB   TRP  18          1HB       TRP  18  -0.304  -3.183  -3.384
  155   2HB   TRP  18          2HB       TRP  18   0.058  -2.230  -1.938
  156    HD1  TRP  18           HD       TRP  18   0.689  -2.294  -5.513
  157    HE1  TRP  18           1HE      TRP  18   2.600  -0.756  -6.199
  158    HE3  TRP  18           3HE      TRP  18   2.731  -1.437  -0.899
  159    HZ2  TRP  18           2HZ      TRP  18   4.758   0.678  -4.910
  160    HZ3  TRP  18           3HZ      TRP  18   4.710   0.018  -0.668
  161    HH2  TRP  18           HH       TRP  18   5.734   1.080  -2.658
  162    H    LYS  19           H        LYS  19  -0.334  -3.855   0.047
  163    HA   LYS  19           HA       LYS  19   1.048  -2.321   1.792
  164   1HB   LYS  19          1HB       LYS  19  -1.117  -3.447   2.260
  165   2HB   LYS  19          2HB       LYS  19  -0.249  -4.983   2.501
  166   1HG   LYS  19          1HG       LYS  19   1.092  -3.020   4.075
  167   2HG   LYS  19          2HG       LYS  19  -0.651  -2.817   4.373
  168   1HD   LYS  19          1HD       LYS  19  -0.289  -5.594   4.335
  169   2HD   LYS  19          2HD       LYS  19   1.144  -4.984   5.197
  170   1HE   LYS  19          1HE       LYS  19  -0.719  -3.444   6.374
  171   2HE   LYS  19          2HE       LYS  19  -1.754  -4.821   5.938
  172   1HZ   LYS  19          1HZ       LYS  19  -0.731  -6.124   7.390
  173   2HZ   LYS  19          2HZ       LYS  19   0.765  -5.472   7.145
  174   3HZ   LYS  19          3HZ       LYS  19  -0.316  -4.709   8.130
  175    H    MET  20           H        MET  20   1.750  -5.766   1.079
  176    HA   MET  20           HA       MET  20   3.596  -6.473   2.918
  177   1HB   MET  20          1HB       MET  20   3.649  -8.117   1.378
  178   2HB   MET  20          2HB       MET  20   3.178  -7.005   0.070
  179   1HG   MET  20          1HG       MET  20   5.815  -6.293   0.819
  180   2HG   MET  20          2HG       MET  20   5.792  -8.062   0.732
  181   1HE   MET  20          1HE       MET  20   4.966  -4.713  -1.591
  182   2HE   MET  20          2HE       MET  20   3.984  -5.670  -2.726
  183   3HE   MET  20          3HE       MET  20   3.555  -5.623  -0.999
  184    H    ARG  21           H        ARG  21   4.194  -4.219   0.189
  185    HA   ARG  21           HA       ARG  21   6.885  -3.654   1.272
  186   1HB   ARG  21          1HB       ARG  21   5.430  -2.927  -1.291
  187   2HB   ARG  21          2HB       ARG  21   7.007  -2.233  -0.846
  188   1HG   ARG  21          1HG       ARG  21   6.882  -5.166  -0.542
  189   2HG   ARG  21          2HG       ARG  21   6.639  -4.614  -2.217
  190   1HD   ARG  21          1HD       ARG  21   8.870  -4.354  -2.373
  191   2HD   ARG  21          2HD       ARG  21   8.731  -3.017  -1.211
  192    HE   ARG  21           HE       ARG  21   8.886  -4.997   0.521
  193   1HH1  ARG  21          2HH2      ARG  21  10.583  -4.662  -2.562
  194   2HH1  ARG  21          1HH2      ARG  21  11.979  -5.584  -2.050
  195   1HH2  ARG  21          2HH1      ARG  21  10.730  -6.215   1.197
  196   2HH2  ARG  21          1HH1      ARG  21  12.063  -6.469   0.093
  197    H    ARG  22           H        ARG  22   3.759  -2.056   0.534
  198    HA   ARG  22           HA       ARG  22   4.562   0.546   1.384
  199   1HB   ARG  22          1HB       ARG  22   2.580   0.059  -0.036
  200   2HB   ARG  22          2HB       ARG  22   1.796  -0.726   1.356
  201   1HG   ARG  22          1HG       ARG  22   2.715   1.792   2.289
  202   2HG   ARG  22          2HG       ARG  22   1.960   2.097   0.706
  203   1HD   ARG  22          1HD       ARG  22   0.334   2.206   2.610
  204   2HD   ARG  22          2HD       ARG  22  -0.080   0.969   1.404
  205    HE   ARG  22           HE       ARG  22   1.367  -0.475   3.185
  206   1HH1  ARG  22          2HH2      ARG  22  -1.268   1.851   3.570
  207   2HH1  ARG  22          1HH2      ARG  22  -1.901   1.101   5.019
  208   1HH2  ARG  22          2HH1      ARG  22   0.531  -1.465   5.098
  209   2HH2  ARG  22          1HH1      ARG  22  -0.875  -0.790   5.889
  210    H    ASN  23           H        ASN  23   5.112  -1.887   3.199
  211    HA   ASN  23           HA       ASN  23   4.252  -0.520   5.673
  212   1HB   ASN  23          1HB       ASN  23   2.837  -2.691   4.742
  213   2HB   ASN  23          2HB       ASN  23   4.042  -3.462   5.796
  214   1HD2  ASN  23          1HD2      ASN  23   3.305  -3.780   7.813
  215   2HD2  ASN  23          2HD2      ASN  23   2.245  -2.700   8.694
  216    H    GLN  24           H        GLN  24   6.737  -1.248   3.901
  217    HA   GLN  24           HA       GLN  24   8.541  -1.550   6.118
  218   1HB   GLN  24          1HB       GLN  24   9.488  -3.759   4.985
  219   2HB   GLN  24          2HB       GLN  24   8.197  -3.838   6.207
  220   1HG   GLN  24          1HG       GLN  24   6.506  -4.114   4.562
  221   2HG   GLN  24          2HG       GLN  24   7.581  -3.586   3.249
  222   1HE2  GLN  24          1HE2      GLN  24   9.144  -5.025   2.396
  223   2HE2  GLN  24          2HE2      GLN  24   9.093  -6.744   2.725
  224    H    PHE  25           H        PHE  25   9.463  -3.193   3.207
  225    HA   PHE  25           HA       PHE  25  11.646  -1.762   2.536
  226   1HB   PHE  25          1HB       PHE  25  11.092  -3.653   1.235
  227   2HB   PHE  25          2HB       PHE  25   9.519  -2.983   0.772
  228    HD1  PHE  25           1HD      PHE  25   9.732  -0.598  -0.493
  229    HD2  PHE  25           2HD      PHE  25  12.741  -3.662  -0.381
  230    HE1  PHE  25           1HE      PHE  25  10.729   0.305  -2.577
  231    HE2  PHE  25           2HE      PHE  25  13.738  -2.758  -2.464
  232    HZ   PHE  25           HZ       PHE  25  12.732  -0.775  -3.562
  233    H    TRP  26           H        TRP  26   8.283  -0.859   1.637
  234    HA   TRP  26           HA       TRP  26   8.684   1.308   0.021
  235   1HB   TRP  26          1HB       TRP  26   6.567   2.006   0.626
  236   2HB   TRP  26          2HB       TRP  26   6.538   0.301   1.098
  237    HD1  TRP  26           HD       TRP  26   6.043  -0.253   3.547
  238    HE1  TRP  26           1HE      TRP  26   5.535   1.077   5.659
  239    HE3  TRP  26           3HE      TRP  26   7.237   4.429   1.859
  240    HZ2  TRP  26           2HZ      TRP  26   5.631   3.838   6.522
  241    HZ3  TRP  26           3HZ      TRP  26   7.016   6.381   3.352
  242    HH2  TRP  26           HH       TRP  26   6.217   6.104   5.680
  243    H    VAL  27           H        VAL  27   9.018   1.230   3.592
  244    HA   VAL  27           HA       VAL  27   9.381   3.863   4.217
  245    HB   VAL  27           HB       VAL  27  10.811   3.126   6.021
  246   1HG1  VAL  27          1HG1      VAL  27   8.962   2.151   6.865
  247   2HG1  VAL  27          2HG1      VAL  27   8.393   1.742   5.229
  248   3HG1  VAL  27          3HG1      VAL  27   9.465   0.622   6.104
  249   1HG2  VAL  27          1HG2      VAL  27  11.353   0.828   4.130
  250   2HG2  VAL  27          2HG2      VAL  27  12.512   1.850   5.015
  251   3HG2  VAL  27          3HG2      VAL  27  11.565   0.619   5.885
  252    H    LYS  28           H        LYS  28  11.806   1.695   2.693
  253    HA   LYS  28           HA       LYS  28  13.908   3.611   2.624
  254   1HB   LYS  28          1HB       LYS  28  13.264   1.127   1.008
  255   2HB   LYS  28          2HB       LYS  28  14.732   2.093   0.724
  256   1HG   LYS  28          1HG       LYS  28  15.423   1.785   3.057
  257   2HG   LYS  28          2HG       LYS  28  13.917   0.905   3.411
  258   1HD   LYS  28          1HD       LYS  28  14.533  -0.893   1.914
  259   2HD   LYS  28          2HD       LYS  28  15.929   0.025   1.302
  260   1HE   LYS  28          1HE       LYS  28  16.040  -0.139   4.193
  261   2HE   LYS  28          2HE       LYS  28  15.864  -1.766   3.503
  262   1HZ   LYS  28          1HZ       LYS  28  17.682  -0.551   1.929
  263   2HZ   LYS  28          2HZ       LYS  28  18.080  -0.018   3.438
  264   3HZ   LYS  28          3HZ       LYS  28  18.004  -1.636   3.129
  265    H    VAL  29           H        VAL  29  11.196   2.879   0.428
  266    HA   VAL  29           HA       VAL  29  11.932   4.234  -1.860
  267    HB   VAL  29           HB       VAL  29   9.230   4.184  -0.460
  268   1HG1  VAL  29          1HG1      VAL  29   8.560   4.416  -3.015
  269   2HG1  VAL  29          2HG1      VAL  29   8.940   5.864  -2.053
  270   3HG1  VAL  29          3HG1      VAL  29  10.162   5.178  -3.150
  271   1HG2  VAL  29          1HG2      VAL  29   8.788   2.253  -1.823
  272   2HG2  VAL  29          2HG2      VAL  29  10.275   2.502  -2.770
  273   3HG2  VAL  29          3HG2      VAL  29  10.379   1.985  -1.070
  274    H    GLN  30           H        GLN  30  11.560   5.523   1.312
  275    HA   GLN  30           HA       GLN  30  11.202   8.276   0.279
  276   1HB   GLN  30          1HB       GLN  30  10.355   8.798   2.340
  277   2HB   GLN  30          2HB       GLN  30  10.044   7.047   2.393
  278   1HG   GLN  30          1HG       GLN  30  11.157   7.469   4.429
  279   2HG   GLN  30          2HG       GLN  30  12.446   6.864   3.367
  280   1HE2  GLN  30          1HE2      GLN  30  13.319   8.243   5.492
  281   2HE2  GLN  30          2HE2      GLN  30  13.831   9.859   5.053
  282    H    ARG  31           H        ARG  31  13.474   6.162   2.044
  283    HA   ARG  31           HA       ARG  31  15.560   6.753   2.963
  284   1HB   ARG  31          1HB       ARG  31  16.042   5.688   0.859
  285   2HB   ARG  31          2HB       ARG  31  15.694   7.183  -0.043
  286   1HG   ARG  31          1HG       ARG  31  17.696   7.604   2.058
  287   2HG   ARG  31          2HG       ARG  31  18.203   6.360   0.889
  288   1HD   ARG  31          1HD       ARG  31  17.105   8.300  -0.748
  289   2HD   ARG  31          2HD       ARG  31  17.865   9.272   0.530
  290    HE   ARG  31           HE       ARG  31  19.594   7.166  -0.482
  291   1HH1  ARG  31          2HH2      ARG  31  18.394  10.454  -0.981
  292   2HH1  ARG  31          1HH2      ARG  31  19.794  10.973  -1.893
  293   1HH2  ARG  31          2HH1      ARG  31  21.442   7.851  -1.688
  294   2HH2  ARG  31          1HH1      ARG  31  21.531   9.488  -2.296
  295    H    GLY  32           H        GLY  32  15.085   8.608   4.262
  296   1HA   GLY  32          1HA       GLY  32  16.280  11.069   3.152
  297   2HA   GLY  32          2HA       GLY  32  14.616  11.170   3.771
  Start of MODEL   20
    1    HA   PRO   1           HA       PRO   1 -22.748   7.086  -3.339
    2   1HB   PRO   1          1HB       PRO   1 -20.060   7.264  -2.931
    3   2HB   PRO   1          2HB       PRO   1 -20.817   7.769  -4.477
    4   1HG   PRO   1          1HG       PRO   1 -20.091   9.536  -2.122
    5   2HG   PRO   1          2HG       PRO   1 -19.637   9.773  -3.842
    6   1HD   PRO   1          1HD       PRO   1 -21.800  11.027  -2.757
    7   2HD   PRO   1          2HD       PRO   1 -21.874  10.367  -4.419
    8    HA   PRO   2           HA       PRO   2 -22.556   5.996   0.922
    9   1HB   PRO   2          1HB       PRO   2 -21.028   3.740   0.979
   10   2HB   PRO   2          2HB       PRO   2 -22.600   3.796   0.117
   11   1HG   PRO   2          1HG       PRO   2 -19.839   4.205  -1.067
   12   2HG   PRO   2          2HG       PRO   2 -21.112   3.079  -1.640
   13   1HD   PRO   2          1HD       PRO   2 -20.794   5.549  -2.748
   14   2HD   PRO   2          2HD       PRO   2 -22.432   4.887  -2.462
   15    H    LEU   3           H        LEU   3 -20.052   7.460  -0.627
   16    HA   LEU   3           HA       LEU   3 -18.304   8.689   0.243
   17   1HB   LEU   3          1HB       LEU   3 -19.735   7.909   2.572
   18   2HB   LEU   3          2HB       LEU   3 -18.017   7.564   2.886
   19    HG   LEU   3           HG       LEU   3 -18.279  10.100   1.504
   20   1HD1  LEU   3          1HD1      LEU   3 -20.320  10.688   2.384
   21   2HD1  LEU   3          2HD1      LEU   3 -20.194   9.525   3.725
   22   3HD1  LEU   3          3HD1      LEU   3 -19.322  11.074   3.806
   23   1HD2  LEU   3          1HD2      LEU   3 -16.379   9.263   2.927
   24   2HD2  LEU   3          2HD2      LEU   3 -16.963  10.876   3.402
   25   3HD2  LEU   3          3HD2      LEU   3 -17.426   9.446   4.355
   26    H    SER   4           H        SER   4 -18.587   5.396  -0.142
   27    HA   SER   4           HA       SER   4 -15.645   5.031   0.184
   28   1HB   SER   4          1HB       SER   4 -16.066   2.705   0.735
   29   2HB   SER   4          2HB       SER   4 -17.032   3.730   1.823
   30    HG   SER   4           HG       SER   4 -18.600   2.520   1.115
   31    H    GLN   5           H        GLN   5 -15.942   2.340  -1.074
   32    HA   GLN   5           HA       GLN   5 -15.902   1.393  -3.159
   33   1HB   GLN   5          1HB       GLN   5 -18.125   1.855  -3.651
   34   2HB   GLN   5          2HB       GLN   5 -17.895   3.617  -3.536
   35   1HG   GLN   5          1HG       GLN   5 -16.604   3.608  -5.625
   36   2HG   GLN   5          2HG       GLN   5 -16.745   1.840  -5.727
   37   1HE2  GLN   5          1HE2      GLN   5 -17.677   3.990  -7.599
   38   2HE2  GLN   5          2HE2      GLN   5 -19.397   3.723  -7.792
   39    H    GLU   6           H        GLU   6 -15.851   4.983  -3.591
   40    HA   GLU   6           HA       GLU   6 -14.330   5.353  -5.758
   41   1HB   GLU   6          1HB       GLU   6 -14.319   6.647  -3.061
   42   2HB   GLU   6          2HB       GLU   6 -13.012   7.085  -4.186
   43   1HG   GLU   6          1HG       GLU   6 -15.909   7.048  -5.071
   44   2HG   GLU   6          2HG       GLU   6 -15.208   8.471  -4.270
   45    H    THR   7           H        THR   7 -12.738   4.819  -2.556
   46    HA   THR   7           HA       THR   7 -10.289   4.003  -3.971
   47    HB   THR   7           HB       THR   7 -10.243   3.755  -1.069
   48    HG1  THR   7           1HG      THR   7 -10.989   6.262  -2.175
   49   1HG2  THR   7          1HG2      THR   7  -8.327   5.195  -1.322
   50   2HG2  THR   7          2HG2      THR   7  -8.335   4.096  -2.722
   51   3HG2  THR   7          3HG2      THR   7  -8.897   5.774  -2.905
   52    H    PHE   8           H        PHE   8 -11.101   2.585  -0.876
   53    HA   PHE   8           HA       PHE   8 -10.614   0.233  -0.566
   54   1HB   PHE   8          1HB       PHE   8 -13.465   0.242  -1.546
   55   2HB   PHE   8          2HB       PHE   8 -12.758  -0.635  -0.178
   56    HD1  PHE   8           1HD      PHE   8 -12.817   2.982  -1.218
   57    HD2  PHE   8           2HD      PHE   8 -13.650   0.074   1.832
   58    HE1  PHE   8           1HE      PHE   8 -13.532   4.795   0.315
   59    HE2  PHE   8           2HE      PHE   8 -14.365   1.887   3.365
   60    HZ   PHE   8           HZ       PHE   8 -14.307   4.248   2.606
   61    H    SER   9           H        SER   9 -12.767   0.542  -3.453
   62    HA   SER   9           HA       SER   9 -12.474  -1.828  -4.675
   63   1HB   SER   9          1HB       SER   9 -13.580   0.257  -5.591
   64   2HB   SER   9          2HB       SER   9 -11.975   0.778  -6.157
   65    HG   SER   9           HG       SER   9 -13.548  -0.661  -7.506
   66    H    ASP  10           H        ASP  10 -10.059   0.810  -5.196
   67    HA   ASP  10           HA       ASP  10  -8.093  -1.298  -5.922
   68   1HB   ASP  10          1HB       ASP  10  -8.738   1.357  -6.922
   69   2HB   ASP  10          2HB       ASP  10  -7.027   1.250  -6.454
   70    H    LEU  11           H        LEU  11  -8.995   0.997  -3.491
   71    HA   LEU  11           HA       LEU  11  -6.406   1.539  -2.406
   72   1HB   LEU  11          1HB       LEU  11  -8.837   2.577  -1.996
   73   2HB   LEU  11          2HB       LEU  11  -8.834   1.409  -0.653
   74    HG   LEU  11           HG       LEU  11  -7.026   3.774  -1.138
   75   1HD1  LEU  11          1HD1      LEU  11  -8.154   4.493   0.675
   76   2HD1  LEU  11          2HD1      LEU  11  -9.053   2.957   0.734
   77   3HD1  LEU  11          3HD1      LEU  11  -7.511   3.120   1.609
   78   1HD2  LEU  11          1HD2      LEU  11  -6.323   1.159   0.223
   79   2HD2  LEU  11          2HD2      LEU  11  -5.355   2.113  -0.927
   80   3HD2  LEU  11          3HD2      LEU  11  -5.583   2.693   0.740
   81    H    TRP  12           H        TRP  12  -8.999  -0.473  -0.908
   82    HA   TRP  12           HA       TRP  12  -7.360  -1.831   0.882
   83   1HB   TRP  12          1HB       TRP  12  -9.318  -2.745   1.406
   84   2HB   TRP  12          2HB       TRP  12 -10.028  -1.923   0.010
   85    HD1  TRP  12           HD       TRP  12 -11.286  -3.457  -1.523
   86    HE1  TRP  12           1HE      TRP  12 -11.249  -5.919  -2.176
   87    HE3  TRP  12           3HE      TRP  12  -7.272  -4.971   1.269
   88    HZ2  TRP  12           2HZ      TRP  12  -9.673  -8.269  -1.566
   89    HZ3  TRP  12           3HZ      TRP  12  -6.534  -7.325   1.207
   90    HH2  TRP  12           HH       TRP  12  -7.720  -8.982  -0.201
   91    H    LYS  13           H        LYS  13  -8.022  -2.524  -2.558
   92    HA   LYS  13           HA       LYS  13  -6.659  -5.051  -2.579
   93   1HB   LYS  13          1HB       LYS  13  -8.222  -3.509  -4.344
   94   2HB   LYS  13          2HB       LYS  13  -6.631  -3.652  -5.129
   95   1HG   LYS  13          1HG       LYS  13  -6.879  -6.193  -4.304
   96   2HG   LYS  13          2HG       LYS  13  -8.610  -5.789  -4.401
   97   1HD   LYS  13          1HD       LYS  13  -8.569  -5.868  -6.657
   98   2HD   LYS  13          2HD       LYS  13  -7.171  -4.768  -6.722
   99   1HE   LYS  13          1HE       LYS  13  -5.971  -7.045  -5.817
  100   2HE   LYS  13          2HE       LYS  13  -7.270  -7.741  -6.809
  101   1HZ   LYS  13          1HZ       LYS  13  -6.477  -6.671  -8.668
  102   2HZ   LYS  13          2HZ       LYS  13  -5.534  -5.619  -7.818
  103   3HZ   LYS  13          3HZ       LYS  13  -5.107  -7.209  -7.924
  104    H    LEU  14           H        LEU  14  -5.678  -1.669  -2.927
  105    HA   LEU  14           HA       LEU  14  -3.077  -2.246  -4.030
  106   1HB   LEU  14          1HB       LEU  14  -4.549   0.115  -2.944
  107   2HB   LEU  14          2HB       LEU  14  -2.771   0.194  -2.927
  108    HG   LEU  14           HG       LEU  14  -4.424   0.739  -5.116
  109   1HD1  LEU  14          1HD1      LEU  14  -2.128   1.549  -4.773
  110   2HD1  LEU  14          2HD1      LEU  14  -1.493  -0.095  -5.020
  111   3HD1  LEU  14          3HD1      LEU  14  -2.267   0.771  -6.368
  112   1HD2  LEU  14          1HD2      LEU  14  -4.474  -1.954  -5.052
  113   2HD2  LEU  14          2HD2      LEU  14  -4.430  -1.044  -6.581
  114   3HD2  LEU  14          3HD2      LEU  14  -2.932  -1.735  -5.914
  115    H    LEU  15           H        LEU  15  -4.398  -1.699  -0.748
  116    HA   LEU  15           HA       LEU  15  -1.843  -1.745   0.559
  117   1HB   LEU  15          1HB       LEU  15  -4.659  -1.514   1.257
  118   2HB   LEU  15          2HB       LEU  15  -3.811  -2.603   2.380
  119    HG   LEU  15           HG       LEU  15  -1.986  -0.806   2.521
  120   1HD1  LEU  15          1HD1      LEU  15  -2.751   0.392   0.445
  121   2HD1  LEU  15          2HD1      LEU  15  -4.211   0.900   1.327
  122   3HD1  LEU  15          3HD1      LEU  15  -2.608   1.458   1.864
  123   1HD2  LEU  15          1HD2      LEU  15  -4.277   0.629   3.596
  124   2HD2  LEU  15          2HD2      LEU  15  -4.455  -1.121   3.866
  125   3HD2  LEU  15          3HD2      LEU  15  -3.008  -0.272   4.460
  126    H    LYS  16           H        LYS  16  -3.614  -4.146  -1.044
  127    HA   LYS  16           HA       LYS  16  -3.061  -6.370   0.706
  128   1HB   LYS  16          1HB       LYS  16  -4.651  -5.920  -1.510
  129   2HB   LYS  16          2HB       LYS  16  -3.350  -6.939  -2.172
  130   1HG   LYS  16          1HG       LYS  16  -4.440  -7.759   0.482
  131   2HG   LYS  16          2HG       LYS  16  -5.535  -7.950  -0.909
  132   1HD   LYS  16          1HD       LYS  16  -2.887  -8.830  -1.657
  133   2HD   LYS  16          2HD       LYS  16  -3.366  -9.638  -0.146
  134   1HE   LYS  16          1HE       LYS  16  -5.620 -10.099  -1.299
  135   2HE   LYS  16          2HE       LYS  16  -4.820  -9.616  -2.810
  136   1HZ   LYS  16          1HZ       LYS  16  -3.093 -11.312  -2.098
  137   2HZ   LYS  16          2HZ       LYS  16  -4.262 -11.903  -1.096
  138   3HZ   LYS  16          3HZ       LYS  16  -4.518 -11.858  -2.724
  139    H    LYS  17           H        LYS  17  -0.866  -4.400  -0.415
  140    HA   LYS  17           HA       LYS  17   1.199  -6.412  -0.526
  141   1HB   LYS  17          1HB       LYS  17   1.194  -6.778  -2.745
  142   2HB   LYS  17          2HB       LYS  17  -0.015  -5.500  -3.017
  143   1HG   LYS  17          1HG       LYS  17   2.963  -5.017  -2.584
  144   2HG   LYS  17          2HG       LYS  17   2.155  -5.031  -4.170
  145   1HD   LYS  17          1HD       LYS  17   0.596  -3.323  -2.544
  146   2HD   LYS  17          2HD       LYS  17   2.288  -2.900  -2.191
  147   1HE   LYS  17          1HE       LYS  17   1.797  -3.363  -5.052
  148   2HE   LYS  17          2HE       LYS  17   0.812  -2.040  -4.392
  149   1HZ   LYS  17          1HZ       LYS  17   2.591  -0.806  -4.502
  150   2HZ   LYS  17          2HZ       LYS  17   3.336  -1.750  -3.373
  151   3HZ   LYS  17          3HZ       LYS  17   3.536  -2.070  -4.979
  152    H    TRP  18           H        TRP  18   0.037  -3.093  -0.804
  153    HA   TRP  18           HA       TRP  18   2.721  -1.965  -0.511
  154   1HB   TRP  18          1HB       TRP  18   0.410  -1.076  -1.633
  155   2HB   TRP  18          2HB       TRP  18   0.304  -0.310  -0.042
  156    HD1  TRP  18           HD       TRP  18   1.553   0.321  -3.376
  157    HE1  TRP  18           1HE      TRP  18   3.251   2.219  -3.454
  158    HE3  TRP  18           3HE      TRP  18   2.602   0.672   1.622
  159    HZ2  TRP  18           2HZ      TRP  18   4.873   3.714  -1.581
  160    HZ3  TRP  18           3HZ      TRP  18   4.226   2.342   2.435
  161    HH2  TRP  18           HH       TRP  18   5.368   3.867   0.851
  162    H    LYS  19           H        LYS  19  -0.262  -2.349   1.456
  163    HA   LYS  19           HA       LYS  19   0.371  -0.972   3.733
  164   1HB   LYS  19          1HB       LYS  19  -1.632  -2.538   3.167
  165   2HB   LYS  19          2HB       LYS  19  -0.643  -3.814   3.916
  166   1HG   LYS  19          1HG       LYS  19  -0.621  -2.728   6.018
  167   2HG   LYS  19          2HG       LYS  19  -1.106  -1.166   5.316
  168   1HD   LYS  19          1HD       LYS  19  -3.240  -1.693   5.832
  169   2HD   LYS  19          2HD       LYS  19  -3.153  -2.967   4.592
  170   1HE   LYS  19          1HE       LYS  19  -1.973  -3.529   7.297
  171   2HE   LYS  19          2HE       LYS  19  -3.743  -3.533   7.137
  172   1HZ   LYS  19          1HZ       LYS  19  -3.218  -5.009   5.128
  173   2HZ   LYS  19          2HZ       LYS  19  -1.783  -5.278   5.895
  174   3HZ   LYS  19          3HZ       LYS  19  -3.202  -5.657   6.645
  175    H    MET  20           H        MET  20   1.442  -4.336   2.982
  176    HA   MET  20           HA       MET  20   3.024  -4.655   5.309
  177   1HB   MET  20          1HB       MET  20   4.171  -6.428   3.912
  178   2HB   MET  20          2HB       MET  20   2.398  -6.565   3.984
  179   1HG   MET  20          1HG       MET  20   2.271  -6.390   1.759
  180   2HG   MET  20          2HG       MET  20   3.066  -4.808   1.828
  181   1HE   MET  20          1HE       MET  20   6.767  -6.321   2.272
  182   2HE   MET  20          2HE       MET  20   6.212  -4.788   1.559
  183   3HE   MET  20          3HE       MET  20   5.538  -5.343   3.110
  184    H    ARG  21           H        ARG  21   3.906  -3.595   1.980
  185    HA   ARG  21           HA       ARG  21   6.656  -3.215   2.460
  186   1HB   ARG  21          1HB       ARG  21   4.772  -1.709   0.601
  187   2HB   ARG  21          2HB       ARG  21   6.549  -1.715   0.493
  188   1HG   ARG  21          1HG       ARG  21   6.621  -4.021  -0.065
  189   2HG   ARG  21          2HG       ARG  21   4.951  -4.293   0.487
  190   1HD   ARG  21          1HD       ARG  21   5.443  -4.091  -2.086
  191   2HD   ARG  21          2HD       ARG  21   4.019  -3.278  -1.401
  192    HE   ARG  21           HE       ARG  21   5.858  -1.316  -1.216
  193   1HH1  ARG  21          2HH2      ARG  21   5.070  -3.556  -3.835
  194   2HH1  ARG  21          1HH2      ARG  21   5.525  -2.444  -5.107
  195   1HH2  ARG  21          2HH1      ARG  21   6.459   0.153  -2.896
  196   2HH2  ARG  21          1HH1      ARG  21   6.317  -0.330  -4.571
  197    H    ARG  22           H        ARG  22   3.830  -1.211   3.214
  198    HA   ARG  22           HA       ARG  22   5.247   1.205   3.761
  199   1HB   ARG  22          1HB       ARG  22   2.804   1.073   3.387
  200   2HB   ARG  22          2HB       ARG  22   2.626   0.160   4.905
  201   1HG   ARG  22          1HG       ARG  22   2.230   2.296   5.704
  202   2HG   ARG  22          2HG       ARG  22   4.001   2.247   5.878
  203   1HD   ARG  22          1HD       ARG  22   2.763   3.166   3.283
  204   2HD   ARG  22          2HD       ARG  22   2.868   4.286   4.658
  205    HE   ARG  22           HE       ARG  22   5.386   2.957   4.120
  206   1HH1  ARG  22          2HH2      ARG  22   3.241   5.599   3.163
  207   2HH1  ARG  22          1HH2      ARG  22   4.527   6.589   2.510
  208   1HH2  ARG  22          2HH1      ARG  22   7.085   4.264   3.258
  209   2HH2  ARG  22          1HH1      ARG  22   6.719   5.828   2.564
  210    H    ASN  23           H        ASN  23   6.083  -1.567   5.008
  211    HA   ASN  23           HA       ASN  23   6.836  -0.374   7.591
  212   1HB   ASN  23          1HB       ASN  23   4.603  -1.991   7.476
  213   2HB   ASN  23          2HB       ASN  23   5.891  -3.155   7.855
  214   1HD2  ASN  23          1HD2      ASN  23   7.407  -2.523   9.670
  215   2HD2  ASN  23          2HD2      ASN  23   6.712  -1.693  11.046
  216    H    GLN  24           H        GLN  24   7.898  -1.483   4.856
  217    HA   GLN  24           HA       GLN  24  10.330  -2.568   5.977
  218   1HB   GLN  24          1HB       GLN  24   8.363  -4.383   4.550
  219   2HB   GLN  24          2HB       GLN  24  10.108  -4.730   4.605
  220   1HG   GLN  24          1HG       GLN  24   9.773  -4.258   7.203
  221   2HG   GLN  24          2HG       GLN  24   8.089  -4.690   6.835
  222   1HE2  GLN  24          1HE2      GLN  24   7.917  -6.699   7.758
  223   2HE2  GLN  24          2HE2      GLN  24   8.913  -8.070   7.318
  224    H    PHE  25           H        PHE  25   9.259  -3.757   2.873
  225    HA   PHE  25           HA       PHE  25  11.291  -2.833   1.335
  226   1HB   PHE  25          1HB       PHE  25   9.701  -4.228   0.318
  227   2HB   PHE  25          2HB       PHE  25   8.351  -3.162   0.746
  228    HD1  PHE  25           1HD      PHE  25   8.694  -0.646  -0.263
  229    HD2  PHE  25           2HD      PHE  25  10.274  -4.282  -1.916
  230    HE1  PHE  25           1HE      PHE  25   8.832   0.429  -2.494
  231    HE2  PHE  25           2HE      PHE  25  10.413  -3.207  -4.147
  232    HZ   PHE  25           HZ       PHE  25   9.692  -0.852  -4.436
  233    H    TRP  26           H        TRP  26   8.456  -0.944   2.409
  234    HA   TRP  26           HA       TRP  26   8.721   1.330   0.843
  235   1HB   TRP  26          1HB       TRP  26   7.429   2.401   2.437
  236   2HB   TRP  26          2HB       TRP  26   7.052   0.697   2.729
  237    HD1  TRP  26           HD       TRP  26   7.469  -0.229   5.072
  238    HE1  TRP  26           1HE      TRP  26   8.386   0.678   7.268
  239    HE3  TRP  26           3HE      TRP  26   9.353   4.221   3.385
  240    HZ2  TRP  26           2HZ      TRP  26   9.770   3.045   8.193
  241    HZ3  TRP  26           3HZ      TRP  26  10.462   5.773   4.951
  242    HH2  TRP  26           HH       TRP  26  10.678   5.202   7.351
  243    H    VAL  27           H        VAL  27  10.551   0.418   3.787
  244    HA   VAL  27           HA       VAL  27  11.949   2.690   4.364
  245    HB   VAL  27           HB       VAL  27  13.718   1.268   5.180
  246   1HG1  VAL  27          1HG1      VAL  27  11.842  -0.830   5.654
  247   2HG1  VAL  27          2HG1      VAL  27  12.247   0.535   6.722
  248   3HG1  VAL  27          3HG1      VAL  27  10.914   0.686   5.551
  249   1HG2  VAL  27          1HG2      VAL  27  12.650  -0.630   3.076
  250   2HG2  VAL  27          2HG2      VAL  27  14.324  -0.087   3.346
  251   3HG2  VAL  27          3HG2      VAL  27  13.570  -1.242   4.471
  252    H    LYS  28           H        LYS  28  12.634   0.411   1.672
  253    HA   LYS  28           HA       LYS  28  14.959   1.769   0.740
  254   1HB   LYS  28          1HB       LYS  28  12.968  -0.156  -0.474
  255   2HB   LYS  28          2HB       LYS  28  14.276   0.550  -1.452
  256   1HG   LYS  28          1HG       LYS  28  15.619  -1.077  -0.640
  257   2HG   LYS  28          2HG       LYS  28  15.528  -0.252   0.934
  258   1HD   LYS  28          1HD       LYS  28  13.198  -1.576   1.062
  259   2HD   LYS  28          2HD       LYS  28  14.052  -2.672  -0.050
  260   1HE   LYS  28          1HE       LYS  28  15.381  -1.688   2.483
  261   2HE   LYS  28          2HE       LYS  28  14.272  -3.075   2.521
  262   1HZ   LYS  28          1HZ       LYS  28  15.674  -4.018   0.733
  263   2HZ   LYS  28          2HZ       LYS  28  16.770  -2.819   1.016
  264   3HZ   LYS  28          3HZ       LYS  28  16.407  -3.901   2.206
  265    H    VAL  29           H        VAL  29  11.473   2.145   0.095
  266    HA   VAL  29           HA       VAL  29  11.477   3.746  -2.152
  267    HB   VAL  29           HB       VAL  29   9.809   4.010   0.380
  268   1HG1  VAL  29          1HG1      VAL  29   9.664   5.301  -2.348
  269   2HG1  VAL  29          2HG1      VAL  29   8.166   4.950  -1.454
  270   3HG1  VAL  29          3HG1      VAL  29   9.395   6.024  -0.744
  271   1HG2  VAL  29          1HG2      VAL  29   9.845   1.795  -0.894
  272   2HG2  VAL  29          2HG2      VAL  29   8.249   2.568  -0.743
  273   3HG2  VAL  29          3HG2      VAL  29   9.150   2.678  -2.274
  274    H    GLN  30           H        GLN  30  12.964   4.393   0.887
  275    HA   GLN  30           HA       GLN  30  13.014   7.310   0.384
  276   1HB   GLN  30          1HB       GLN  30  13.360   7.546   2.625
  277   2HB   GLN  30          2HB       GLN  30  12.681   5.902   2.692
  278   1HG   GLN  30          1HG       GLN  30  15.033   5.011   2.438
  279   2HG   GLN  30          2HG       GLN  30  15.623   6.679   2.603
  280   1HE2  GLN  30          1HE2      GLN  30  16.199   4.420   4.367
  281   2HE2  GLN  30          2HE2      GLN  30  15.578   4.842   5.948
  282    H    ARG  31           H        ARG  31  15.139   4.445   0.698
  283    HA   ARG  31           HA       ARG  31  17.477   4.367   0.476
  284   1HB   ARG  31          1HB       ARG  31  16.602   3.644  -1.650
  285   2HB   ARG  31          2HB       ARG  31  16.337   5.324  -2.175
  286   1HG   ARG  31          1HG       ARG  31  18.572   5.687  -2.606
  287   2HG   ARG  31          2HG       ARG  31  19.109   4.582  -1.318
  288   1HD   ARG  31          1HD       ARG  31  18.305   2.657  -2.723
  289   2HD   ARG  31          2HD       ARG  31  17.955   3.811  -4.028
  290    HE   ARG  31           HE       ARG  31  20.206   3.877  -4.530
  291   1HH1  ARG  31          2HH2      ARG  31  19.735   2.617  -1.261
  292   2HH1  ARG  31          1HH2      ARG  31  21.421   2.214  -1.026
  293   1HH2  ARG  31          2HH1      ARG  31  22.433   3.344  -4.220
  294   2HH2  ARG  31          1HH1      ARG  31  22.959   2.628  -2.713
  295    H    GLY  32           H        GLY  32  17.835   6.194   2.037
  296   1HA   GLY  32          1HA       GLY  32  19.478   8.226   0.729
  297   2HA   GLY  32          2HA       GLY  32  18.042   8.858   1.567
  Start of MODEL   21
    1    HA   PRO   1           HA       PRO   1 -12.398  10.808   2.980
    2   1HB   PRO   1          1HB       PRO   1 -14.860   9.719   3.395
    3   2HB   PRO   1          2HB       PRO   1 -13.975  10.578   4.697
    4   1HG   PRO   1          1HG       PRO   1 -16.099  11.717   2.857
    5   2HG   PRO   1          2HG       PRO   1 -16.058  11.792   4.649
    6   1HD   PRO   1          1HD       PRO   1 -15.135  13.850   3.119
    7   2HD   PRO   1          2HD       PRO   1 -14.267  13.367   4.608
    8    HA   PRO   2           HA       PRO   2 -13.294   9.779  -1.208
    9   1HB   PRO   2          1HB       PRO   2 -13.030   7.067  -1.191
   10   2HB   PRO   2          2HB       PRO   2 -11.643   8.154  -0.860
   11   1HG   PRO   2          1HG       PRO   2 -13.443   6.802   1.170
   12   2HG   PRO   2          2HG       PRO   2 -11.650   6.769   1.113
   13   1HD   PRO   2          1HD       PRO   2 -12.991   8.547   2.685
   14   2HD   PRO   2          2HD       PRO   2 -11.522   9.051   1.795
   15    H    LEU   3           H        LEU   3 -15.412   9.370   1.297
   16    HA   LEU   3           HA       LEU   3 -17.731   9.249   1.163
   17   1HB   LEU   3          1HB       LEU   3 -17.090   9.374  -1.516
   18   2HB   LEU   3          2HB       LEU   3 -17.893   7.790  -1.398
   19    HG   LEU   3           HG       LEU   3 -19.503   9.651  -1.845
   20   1HD1  LEU   3          1HD1      LEU   3 -19.941   7.523  -0.372
   21   2HD1  LEU   3          2HD1      LEU   3 -19.972   8.680   0.980
   22   3HD1  LEU   3          3HD1      LEU   3 -21.134   8.844  -0.358
   23   1HD2  LEU   3          1HD2      LEU   3 -18.043  11.258  -0.384
   24   2HD2  LEU   3          2HD2      LEU   3 -19.813  11.436  -0.338
   25   3HD2  LEU   3          3HD2      LEU   3 -18.969  10.591   0.982
   26    H    SER   4           H        SER   4 -15.388   6.812   0.864
   27    HA   SER   4           HA       SER   4 -15.340   4.725   1.841
   28   1HB   SER   4          1HB       SER   4 -18.311   4.781   2.341
   29   2HB   SER   4          2HB       SER   4 -17.013   4.050   3.315
   30    HG   SER   4           HG       SER   4 -16.565   5.947   4.178
   31    H    GLN   5           H        GLN   5 -15.199   2.893   0.675
   32    HA   GLN   5           HA       GLN   5 -15.952   1.156  -0.690
   33   1HB   GLN   5          1HB       GLN   5 -18.328   2.131  -0.114
   34   2HB   GLN   5          2HB       GLN   5 -18.214   2.849  -1.739
   35   1HG   GLN   5          1HG       GLN   5 -17.320   0.202  -2.057
   36   2HG   GLN   5          2HG       GLN   5 -18.715   0.078  -0.963
   37   1HE2  GLN   5          1HE2      GLN   5 -17.620   0.750  -4.209
   38   2HE2  GLN   5          2HE2      GLN   5 -19.196   0.994  -4.930
   39    H    GLU   6           H        GLU   6 -16.024   4.554  -1.757
   40    HA   GLU   6           HA       GLU   6 -15.692   4.236  -4.503
   41   1HB   GLU   6          1HB       GLU   6 -14.513   6.261  -2.569
   42   2HB   GLU   6          2HB       GLU   6 -14.403   6.413  -4.339
   43   1HG   GLU   6          1HG       GLU   6 -17.046   5.917  -4.119
   44   2HG   GLU   6          2HG       GLU   6 -16.775   6.675  -2.534
   45    H    THR   7           H        THR   7 -13.153   4.283  -1.945
   46    HA   THR   7           HA       THR   7 -11.170   3.420  -3.956
   47    HB   THR   7           HB       THR   7 -10.244   3.613  -1.193
   48    HG1  THR   7           1HG      THR   7 -10.592   5.967  -1.248
   49   1HG2  THR   7          1HG2      THR   7  -8.451   4.550  -2.252
   50   2HG2  THR   7          2HG2      THR   7  -9.237   3.937  -3.726
   51   3HG2  THR   7          3HG2      THR   7  -9.471   5.631  -3.232
   52    H    PHE   8           H        PHE   8 -10.989   2.451  -0.578
   53    HA   PHE   8           HA       PHE   8 -10.202   0.189  -0.139
   54   1HB   PHE   8          1HB       PHE   8 -13.195  -0.110  -0.192
   55   2HB   PHE   8          2HB       PHE   8 -12.032  -0.659   1.028
   56    HD1  PHE   8           1HD      PHE   8 -12.785   2.677  -0.544
   57    HD2  PHE   8           2HD      PHE   8 -12.404   0.374   3.062
   58    HE1  PHE   8           1HE      PHE   8 -13.238   4.710   0.803
   59    HE2  PHE   8           2HE      PHE   8 -12.856   2.406   4.408
   60    HZ   PHE   8           HZ       PHE   8 -13.274   4.575   3.279
   61    H    SER   9           H        SER   9 -13.146  -0.042  -2.223
   62    HA   SER   9           HA       SER   9 -13.023  -2.548  -3.163
   63   1HB   SER   9          1HB       SER   9 -14.535  -0.678  -3.952
   64   2HB   SER   9          2HB       SER   9 -13.227  -0.173  -5.049
   65    HG   SER   9           HG       SER   9 -14.679  -1.600  -6.069
   66    H    ASP  10           H        ASP  10 -11.129   0.084  -4.761
   67    HA   ASP  10           HA       ASP  10  -9.410  -1.961  -5.995
   68   1HB   ASP  10          1HB       ASP  10 -10.114   0.870  -6.453
   69   2HB   ASP  10          2HB       ASP  10  -8.395   0.497  -6.705
   70    H    LEU  11           H        LEU  11  -9.317   0.627  -3.546
   71    HA   LEU  11           HA       LEU  11  -6.517   0.685  -3.146
   72   1HB   LEU  11          1HB       LEU  11  -8.828   1.869  -2.030
   73   2HB   LEU  11          2HB       LEU  11  -7.999   1.056  -0.681
   74    HG   LEU  11           HG       LEU  11  -5.859   2.153  -1.402
   75   1HD1  LEU  11          1HD1      LEU  11  -6.611   4.309  -2.911
   76   2HD1  LEU  11          2HD1      LEU  11  -5.914   2.818  -3.587
   77   3HD1  LEU  11          3HD1      LEU  11  -7.679   3.049  -3.576
   78   1HD2  LEU  11          1HD2      LEU  11  -6.692   3.416   0.318
   79   2HD2  LEU  11          2HD2      LEU  11  -6.958   4.611  -0.975
   80   3HD2  LEU  11          3HD2      LEU  11  -8.297   3.569  -0.437
   81    H    TRP  12           H        TRP  12  -8.833  -0.734  -0.787
   82    HA   TRP  12           HA       TRP  12  -7.127  -2.274   0.664
   83   1HB   TRP  12          1HB       TRP  12  -9.937  -2.259   0.050
   84   2HB   TRP  12          2HB       TRP  12  -9.373  -3.933   0.135
   85    HD1  TRP  12           HD       TRP  12 -10.963  -1.600   2.240
   86    HE1  TRP  12           1HE      TRP  12 -10.492  -1.934   4.721
   87    HE3  TRP  12           3HE      TRP  12  -6.832  -4.600   1.879
   88    HZ2  TRP  12           2HZ      TRP  12  -8.559  -3.331   6.360
   89    HZ3  TRP  12           3HZ      TRP  12  -5.705  -5.411   3.919
   90    HH2  TRP  12           HH       TRP  12  -6.553  -4.787   6.161
   91    H    LYS  13           H        LYS  13  -8.881  -3.571  -2.218
   92    HA   LYS  13           HA       LYS  13  -7.553  -6.003  -2.403
   93   1HB   LYS  13          1HB       LYS  13  -9.520  -5.008  -3.782
   94   2HB   LYS  13          2HB       LYS  13  -8.248  -4.368  -4.851
   95   1HG   LYS  13          1HG       LYS  13  -7.950  -7.224  -4.064
   96   2HG   LYS  13          2HG       LYS  13  -9.338  -6.859  -5.116
   97   1HD   LYS  13          1HD       LYS  13  -7.562  -5.450  -6.475
   98   2HD   LYS  13          2HD       LYS  13  -6.389  -6.502  -5.648
   99   1HE   LYS  13          1HE       LYS  13  -7.341  -8.475  -6.579
  100   2HE   LYS  13          2HE       LYS  13  -8.814  -7.621  -7.085
  101   1HZ   LYS  13          1HZ       LYS  13  -7.454  -7.953  -8.951
  102   2HZ   LYS  13          2HZ       LYS  13  -7.391  -6.344  -8.594
  103   3HZ   LYS  13          3HZ       LYS  13  -6.122  -7.325  -8.208
  104    H    LEU  14           H        LEU  14  -6.565  -2.802  -3.683
  105    HA   LEU  14           HA       LEU  14  -4.265  -3.710  -5.079
  106   1HB   LEU  14          1HB       LEU  14  -5.238  -1.095  -3.956
  107   2HB   LEU  14          2HB       LEU  14  -3.554  -1.219  -4.521
  108    HG   LEU  14           HG       LEU  14  -5.860  -0.808  -6.106
  109   1HD1  LEU  14          1HD1      LEU  14  -2.948  -1.460  -6.588
  110   2HD1  LEU  14          2HD1      LEU  14  -4.065  -1.299  -7.964
  111   3HD1  LEU  14          3HD1      LEU  14  -3.818   0.071  -6.855
  112   1HD2  LEU  14          1HD2      LEU  14  -4.630  -3.472  -6.849
  113   2HD2  LEU  14          2HD2      LEU  14  -6.037  -3.393  -5.763
  114   3HD2  LEU  14          3HD2      LEU  14  -6.152  -2.746  -7.417
  115    H    LEU  15           H        LEU  15  -4.711  -2.468  -1.732
  116    HA   LEU  15           HA       LEU  15  -1.932  -2.761  -1.045
  117   1HB   LEU  15          1HB       LEU  15  -4.416  -1.864   0.189
  118   2HB   LEU  15          2HB       LEU  15  -3.458  -2.859   1.312
  119    HG   LEU  15           HG       LEU  15  -1.633  -1.401   1.257
  120   1HD1  LEU  15          1HD1      LEU  15  -0.911  -0.981  -0.858
  121   2HD1  LEU  15          2HD1      LEU  15  -2.564  -0.979  -1.518
  122   3HD1  LEU  15          3HD1      LEU  15  -1.913   0.485  -0.743
  123   1HD2  LEU  15          1HD2      LEU  15  -3.325  -0.160   2.371
  124   2HD2  LEU  15          2HD2      LEU  15  -2.633   0.988   1.200
  125   3HD2  LEU  15          3HD2      LEU  15  -4.185   0.189   0.853
  126    H    LYS  16           H        LYS  16  -4.503  -4.980  -1.504
  127    HA   LYS  16           HA       LYS  16  -3.802  -6.918   0.489
  128   1HB   LYS  16          1HB       LYS  16  -5.888  -6.574  -1.228
  129   2HB   LYS  16          2HB       LYS  16  -4.977  -7.845  -2.079
  130   1HG   LYS  16          1HG       LYS  16  -5.135  -8.312   0.820
  131   2HG   LYS  16          2HG       LYS  16  -6.737  -8.242   0.049
  132   1HD   LYS  16          1HD       LYS  16  -6.282 -10.054  -1.365
  133   2HD   LYS  16          2HD       LYS  16  -4.519  -9.837  -1.240
  134   1HE   LYS  16          1HE       LYS  16  -5.983 -10.428   1.296
  135   2HE   LYS  16          2HE       LYS  16  -5.869 -11.753   0.117
  136   1HZ   LYS  16          1HZ       LYS  16  -3.419 -10.391   0.456
  137   2HZ   LYS  16          2HZ       LYS  16  -3.971 -11.014   1.880
  138   3HZ   LYS  16          3HZ       LYS  16  -3.755 -12.001   0.576
  139    H    LYS  17           H        LYS  17  -1.761  -5.690  -1.618
  140    HA   LYS  17           HA       LYS  17  -0.121  -8.069  -1.713
  141   1HB   LYS  17          1HB       LYS  17  -0.943  -8.846  -3.676
  142   2HB   LYS  17          2HB       LYS  17  -1.779  -7.316  -4.038
  143   1HG   LYS  17          1HG       LYS  17   1.221  -7.779  -4.326
  144   2HG   LYS  17          2HG       LYS  17   0.051  -7.811  -5.667
  145   1HD   LYS  17          1HD       LYS  17  -0.446  -5.412  -4.221
  146   2HD   LYS  17          2HD       LYS  17   1.320  -5.529  -4.413
  147   1HE   LYS  17          1HE       LYS  17   0.299  -6.345  -6.892
  148   2HE   LYS  17          2HE       LYS  17  -0.746  -4.987  -6.417
  149   1HZ   LYS  17          1HZ       LYS  17   1.089  -4.135  -7.561
  150   2HZ   LYS  17          2HZ       LYS  17   1.319  -3.755  -5.973
  151   3HZ   LYS  17          3HZ       LYS  17   2.175  -4.986  -6.659
  152    H    TRP  18           H        TRP  18  -0.791  -4.696  -2.166
  153    HA   TRP  18           HA       TRP  18   2.002  -4.111  -2.923
  154   1HB   TRP  18          1HB       TRP  18  -0.419  -2.975  -3.578
  155   2HB   TRP  18          2HB       TRP  18   0.165  -1.892  -2.307
  156    HD1  TRP  18           HD       TRP  18   0.201  -2.188  -5.874
  157    HE1  TRP  18           1HE      TRP  18   2.094  -0.890  -6.978
  158    HE3  TRP  18           3HE      TRP  18   3.134  -1.380  -1.757
  159    HZ2  TRP  18           2HZ      TRP  18   4.584   0.352  -6.181
  160    HZ3  TRP  18           3HZ      TRP  18   5.255  -0.137  -1.969
  161    HH2  TRP  18           HH       TRP  18   5.993   0.733  -4.168
  162    H    LYS  19           H        LYS  19  -0.363  -3.463  -0.293
  163    HA   LYS  19           HA       LYS  19   1.019  -1.852   1.400
  164   1HB   LYS  19          1HB       LYS  19  -1.215  -3.211   1.686
  165   2HB   LYS  19          2HB       LYS  19  -0.169  -4.387   2.519
  166   1HG   LYS  19          1HG       LYS  19   0.563  -1.795   3.465
  167   2HG   LYS  19          2HG       LYS  19  -1.214  -1.884   3.508
  168   1HD   LYS  19          1HD       LYS  19  -0.023  -4.383   4.423
  169   2HD   LYS  19          2HD       LYS  19   0.584  -3.005   5.371
  170   1HE   LYS  19          1HE       LYS  19  -1.346  -3.172   6.541
  171   2HE   LYS  19          2HE       LYS  19  -2.115  -2.429   5.122
  172   1HZ   LYS  19          1HZ       LYS  19  -3.077  -4.556   5.946
  173   2HZ   LYS  19          2HZ       LYS  19  -2.732  -4.498   4.334
  174   3HZ   LYS  19          3HZ       LYS  19  -1.737  -5.319   5.362
  175    H    MET  20           H        MET  20   1.478  -5.427   1.196
  176    HA   MET  20           HA       MET  20   3.313  -5.996   3.047
  177   1HB   MET  20          1HB       MET  20   4.590  -7.227   1.063
  178   2HB   MET  20          2HB       MET  20   2.963  -7.741   1.570
  179   1HG   MET  20          1HG       MET  20   2.136  -7.245  -0.447
  180   2HG   MET  20          2HG       MET  20   2.706  -5.575  -0.296
  181   1HE   MET  20          1HE       MET  20   3.310  -5.206  -3.028
  182   2HE   MET  20          2HE       MET  20   4.116  -4.509  -1.602
  183   3HE   MET  20          3HE       MET  20   5.087  -5.137  -2.955
  184    H    ARG  21           H        ARG  21   3.996  -4.045   0.123
  185    HA   ARG  21           HA       ARG  21   6.721  -3.513   1.160
  186   1HB   ARG  21          1HB       ARG  21   5.359  -3.074  -1.518
  187   2HB   ARG  21          2HB       ARG  21   6.964  -2.410  -1.127
  188   1HG   ARG  21          1HG       ARG  21   6.241  -5.358  -0.879
  189   2HG   ARG  21          2HG       ARG  21   7.027  -4.647  -2.309
  190   1HD   ARG  21          1HD       ARG  21   8.870  -3.820  -0.845
  191   2HD   ARG  21          2HD       ARG  21   8.098  -4.616   0.543
  192    HE   ARG  21           HE       ARG  21   8.782  -6.280  -1.810
  193   1HH1  ARG  21          2HH2      ARG  21   9.445  -5.235   1.502
  194   2HH1  ARG  21          1HH2      ARG  21  10.481  -6.596   1.870
  195   1HH2  ARG  21          2HH1      ARG  21  10.150  -8.078  -1.324
  196   2HH2  ARG  21          1HH1      ARG  21  10.883  -8.217   0.258
  197    H    ARG  22           H        ARG  22   3.725  -1.861   0.059
  198    HA   ARG  22           HA       ARG  22   4.678   0.772   0.682
  199   1HB   ARG  22          1HB       ARG  22   2.791   0.152  -0.896
  200   2HB   ARG  22          2HB       ARG  22   1.799  -0.190   0.542
  201   1HG   ARG  22          1HG       ARG  22   1.251   2.018   0.425
  202   2HG   ARG  22          2HG       ARG  22   2.850   2.282   1.161
  203   1HD   ARG  22          1HD       ARG  22   2.052   2.455  -1.756
  204   2HD   ARG  22          2HD       ARG  22   2.847   3.683  -0.749
  205    HE   ARG  22           HE       ARG  22   4.408   1.243  -1.053
  206   1HH1  ARG  22          2HH2      ARG  22   3.561   4.380  -2.449
  207   2HH1  ARG  22          1HH2      ARG  22   5.043   4.524  -3.368
  208   1HH2  ARG  22          2HH1      ARG  22   6.365   1.435  -2.267
  209   2HH2  ARG  22          1HH1      ARG  22   6.641   2.845  -3.264
  210    H    ASN  23           H        ASN  23   4.808  -1.475   2.790
  211    HA   ASN  23           HA       ASN  23   3.818   0.224   4.991
  212   1HB   ASN  23          1HB       ASN  23   2.339  -1.964   4.100
  213   2HB   ASN  23          2HB       ASN  23   3.274  -2.616   5.464
  214   1HD2  ASN  23          1HD2      ASN  23   2.618  -2.180   7.518
  215   2HD2  ASN  23          2HD2      ASN  23   1.369  -1.029   7.941
  216    H    GLN  24           H        GLN  24   6.389  -0.935   3.613
  217    HA   GLN  24           HA       GLN  24   7.875  -1.195   6.071
  218   1HB   GLN  24          1HB       GLN  24   7.271  -3.649   4.402
  219   2HB   GLN  24          2HB       GLN  24   8.745  -3.532   5.392
  220   1HG   GLN  24          1HG       GLN  24   6.973  -2.732   7.240
  221   2HG   GLN  24          2HG       GLN  24   5.873  -3.703   6.238
  222   1HE2  GLN  24          1HE2      GLN  24   5.586  -5.354   7.771
  223   2HE2  GLN  24          2HE2      GLN  24   6.865  -6.469   8.200
  224    H    PHE  25           H        PHE  25   8.987  -3.117   3.407
  225    HA   PHE  25           HA       PHE  25  11.364  -1.945   2.937
  226   1HB   PHE  25          1HB       PHE  25  10.796  -3.849   1.671
  227   2HB   PHE  25          2HB       PHE  25   9.348  -3.081   0.996
  228    HD1  PHE  25           1HD      PHE  25   9.913  -0.802  -0.356
  229    HD2  PHE  25           2HD      PHE  25  12.600  -4.098   0.251
  230    HE1  PHE  25           1HE      PHE  25  11.207  -0.115  -2.357
  231    HE2  PHE  25           2HE      PHE  25  13.894  -3.411  -1.750
  232    HZ   PHE  25           HZ       PHE  25  13.198  -1.420  -3.054
  233    H    TRP  26           H        TRP  26   8.252  -0.796   1.541
  234    HA   TRP  26           HA       TRP  26   9.083   1.225  -0.103
  235   1HB   TRP  26          1HB       TRP  26   6.981   2.157   0.167
  236   2HB   TRP  26          2HB       TRP  26   6.721   0.482   0.673
  237    HD1  TRP  26           HD       TRP  26   5.820   0.072   3.031
  238    HE1  TRP  26           1HE      TRP  26   5.143   1.523   5.012
  239    HE3  TRP  26           3HE      TRP  26   7.702   4.554   1.428
  240    HZ2  TRP  26           2HZ      TRP  26   5.383   4.294   5.813
  241    HZ3  TRP  26           3HZ      TRP  26   7.459   6.573   2.825
  242    HH2  TRP  26           HH       TRP  26   6.305   6.461   5.015
  243    H    VAL  27           H        VAL  27   8.905   1.329   3.478
  244    HA   VAL  27           HA       VAL  27   9.420   3.952   4.031
  245    HB   VAL  27           HB       VAL  27  10.520   3.199   6.049
  246   1HG1  VAL  27          1HG1      VAL  27   8.941   0.837   6.064
  247   2HG1  VAL  27          2HG1      VAL  27   8.485   2.449   6.665
  248   3HG1  VAL  27          3HG1      VAL  27   8.111   1.986   4.987
  249   1HG2  VAL  27          1HG2      VAL  27  12.209   1.717   5.382
  250   2HG2  VAL  27          2HG2      VAL  27  11.020   0.613   6.115
  251   3HG2  VAL  27          3HG2      VAL  27  11.110   0.776   4.345
  252    H    LYS  28           H        LYS  28  11.818   1.504   2.953
  253    HA   LYS  28           HA       LYS  28  14.079   3.228   3.102
  254   1HB   LYS  28          1HB       LYS  28  13.432   0.713   1.538
  255   2HB   LYS  28          2HB       LYS  28  15.003   1.538   1.395
  256   1HG   LYS  28          1HG       LYS  28  13.770   0.628   4.029
  257   2HG   LYS  28          2HG       LYS  28  14.991  -0.294   3.120
  258   1HD   LYS  28          1HD       LYS  28  16.250   2.087   3.191
  259   2HD   LYS  28          2HD       LYS  28  15.276   2.254   4.672
  260   1HE   LYS  28          1HE       LYS  28  16.471   0.671   5.780
  261   2HE   LYS  28          2HE       LYS  28  16.557  -0.392   4.359
  262   1HZ   LYS  28          1HZ       LYS  28  18.676   0.232   4.469
  263   2HZ   LYS  28          2HZ       LYS  28  18.146   1.531   3.602
  264   3HZ   LYS  28          3HZ       LYS  28  18.372   1.663   5.231
  265    H    VAL  29           H        VAL  29  11.633   2.610   0.583
  266    HA   VAL  29           HA       VAL  29  12.793   3.757  -1.640
  267    HB   VAL  29           HB       VAL  29   9.939   4.029  -0.619
  268   1HG1  VAL  29          1HG1      VAL  29   9.934   4.065  -3.407
  269   2HG1  VAL  29          2HG1      VAL  29   9.703   5.475  -2.348
  270   3HG1  VAL  29          3HG1      VAL  29  11.321   5.098  -2.985
  271   1HG2  VAL  29          1HG2      VAL  29  11.100   2.149  -2.709
  272   2HG2  VAL  29          2HG2      VAL  29  10.951   1.708  -0.990
  273   3HG2  VAL  29          3HG2      VAL  29   9.494   2.078  -1.944
  274    H    GLN  30           H        GLN  30  12.122   5.261   1.388
  275    HA   GLN  30           HA       GLN  30  12.172   7.970   0.194
  276   1HB   GLN  30          1HB       GLN  30  11.108   8.671   2.086
  277   2HB   GLN  30          2HB       GLN  30  10.671   6.950   2.218
  278   1HG   GLN  30          1HG       GLN  30  12.798   6.611   3.555
  279   2HG   GLN  30          2HG       GLN  30  12.995   8.377   3.567
  280   1HE2  GLN  30          1HE2      GLN  30  12.856   8.253   5.921
  281   2HE2  GLN  30          2HE2      GLN  30  11.290   8.127   6.692
  282    H    ARG  31           H        ARG  31  13.971   5.808   2.410
  283    HA   ARG  31           HA       ARG  31  15.980   6.262   3.536
  284   1HB   ARG  31          1HB       ARG  31  16.621   5.013   1.581
  285   2HB   ARG  31          2HB       ARG  31  16.534   6.464   0.554
  286   1HG   ARG  31          1HG       ARG  31  18.529   7.315   1.347
  287   2HG   ARG  31          2HG       ARG  31  18.333   6.569   2.952
  288   1HD   ARG  31          1HD       ARG  31  18.783   4.339   1.949
  289   2HD   ARG  31          2HD       ARG  31  19.026   5.112   0.368
  290    HE   ARG  31           HE       ARG  31  20.710   6.180   2.505
  291   1HH1  ARG  31          2HH2      ARG  31  20.335   3.759  -0.045
  292   2HH1  ARG  31          1HH2      ARG  31  22.054   3.490  -0.231
  293   1HH2  ARG  31          2HH1      ARG  31  22.980   5.824   2.259
  294   2HH2  ARG  31          1HH1      ARG  31  23.562   4.668   1.083
  295    H    GLY  32           H        GLY  32  15.297   8.306   4.548
  296   1HA   GLY  32          1HA       GLY  32  16.483  10.694   3.216
  297   2HA   GLY  32          2HA       GLY  32  15.182  10.730   4.428
  Start of MODEL   22
    1    HA   PRO   1           HA       PRO   1 -21.884   7.571   1.841
    2   1HB   PRO   1          1HB       PRO   1 -19.918   7.853  -0.023
    3   2HB   PRO   1          2HB       PRO   1 -21.543   7.228  -0.451
    4   1HG   PRO   1          1HG       PRO   1 -20.548  10.081  -0.699
    5   2HG   PRO   1          2HG       PRO   1 -21.327   9.086  -1.972
    6   1HD   PRO   1          1HD       PRO   1 -22.764  10.841  -0.461
    7   2HD   PRO   1          2HD       PRO   1 -23.446   9.242  -0.890
    8    HA   PRO   2           HA       PRO   2 -18.791   9.582   4.245
    9   1HB   PRO   2          1HB       PRO   2 -16.627   7.930   4.136
   10   2HB   PRO   2          2HB       PRO   2 -18.179   7.408   4.869
   11   1HG   PRO   2          1HG       PRO   2 -17.219   6.899   2.038
   12   2HG   PRO   2          2HG       PRO   2 -17.825   5.689   3.216
   13   1HD   PRO   2          1HD       PRO   2 -19.463   6.783   1.333
   14   2HD   PRO   2          2HD       PRO   2 -20.058   6.495   2.996
   15    H    LEU   3           H        LEU   3 -18.728   9.612   0.956
   16    HA   LEU   3           HA       LEU   3 -17.671  11.028  -0.515
   17   1HB   LEU   3          1HB       LEU   3 -16.933  12.080   2.081
   18   2HB   LEU   3          2HB       LEU   3 -15.559  12.208   0.957
   19    HG   LEU   3           HG       LEU   3 -17.585  12.988  -0.684
   20   1HD1  LEU   3          1HD1      LEU   3 -18.523  13.274   2.117
   21   2HD1  LEU   3          2HD1      LEU   3 -18.675  14.744   1.125
   22   3HD1  LEU   3          3HD1      LEU   3 -19.454  13.232   0.601
   23   1HD2  LEU   3          1HD2      LEU   3 -15.925  14.545  -0.698
   24   2HD2  LEU   3          2HD2      LEU   3 -16.914  15.377   0.526
   25   3HD2  LEU   3          3HD2      LEU   3 -15.575  14.319   1.032
   26    H    SER   4           H        SER   4 -16.458   8.393   1.026
   27    HA   SER   4           HA       SER   4 -13.878   8.477  -0.459
   28   1HB   SER   4          1HB       SER   4 -13.082   6.821   1.093
   29   2HB   SER   4          2HB       SER   4 -13.857   8.107   2.050
   30    HG   SER   4           HG       SER   4 -14.402   5.700   2.354
   31    H    GLN   5           H        GLN   5 -13.795   5.467  -0.041
   32    HA   GLN   5           HA       GLN   5 -14.663   3.536  -1.013
   33   1HB   GLN   5          1HB       GLN   5 -16.803   3.502  -1.770
   34   2HB   GLN   5          2HB       GLN   5 -16.872   5.163  -1.135
   35   1HG   GLN   5          1HG       GLN   5 -17.591   5.498  -3.322
   36   2HG   GLN   5          2HG       GLN   5 -15.845   5.782  -3.491
   37   1HE2  GLN   5          1HE2      GLN   5 -17.958   2.853  -3.303
   38   2HE2  GLN   5          2HE2      GLN   5 -17.318   2.092  -4.744
   39    H    GLU   6           H        GLU   6 -13.955   6.503  -2.791
   40    HA   GLU   6           HA       GLU   6 -13.583   5.630  -5.375
   41   1HB   GLU   6          1HB       GLU   6 -12.171   7.606  -3.608
   42   2HB   GLU   6          2HB       GLU   6 -11.471   7.237  -5.202
   43   1HG   GLU   6          1HG       GLU   6 -13.351   8.028  -6.357
   44   2HG   GLU   6          2HG       GLU   6 -14.419   7.837  -4.949
   45    H    THR   7           H        THR   7 -10.924   5.682  -2.927
   46    HA   THR   7           HA       THR   7  -9.492   3.665  -4.519
   47    HB   THR   7           HB       THR   7  -8.273   4.379  -1.975
   48    HG1  THR   7           1HG      THR   7  -8.997   6.486  -3.738
   49   1HG2  THR   7          1HG2      THR   7  -6.578   5.343  -3.690
   50   2HG2  THR   7          2HG2      THR   7  -6.898   3.592  -3.739
   51   3HG2  THR   7          3HG2      THR   7  -7.662   4.671  -4.931
   52    H    PHE   8           H        PHE   8  -9.306   3.770  -1.001
   53    HA   PHE   8           HA       PHE   8  -9.132   1.615   0.130
   54   1HB   PHE   8          1HB       PHE   8 -12.080   2.229   0.161
   55   2HB   PHE   8          2HB       PHE   8 -11.027   1.723   1.493
   56    HD1  PHE   8           1HD      PHE   8 -10.907   4.531  -1.011
   57    HD2  PHE   8           2HD      PHE   8 -10.887   3.357   3.121
   58    HE1  PHE   8           1HE      PHE   8 -10.618   6.901  -0.339
   59    HE2  PHE   8           2HE      PHE   8 -10.597   5.727   3.793
   60    HZ   PHE   8           HZ       PHE   8 -10.463   7.499   2.063
   61    H    SER   9           H        SER   9 -12.188   1.647  -1.801
   62    HA   SER   9           HA       SER   9 -12.871  -0.943  -1.894
   63   1HB   SER   9          1HB       SER   9 -13.843   0.957  -3.253
   64   2HB   SER   9          2HB       SER   9 -12.542   0.689  -4.438
   65    HG   SER   9           HG       SER   9 -13.685  -0.883  -5.182
   66    H    ASP  10           H        ASP  10 -10.421   0.388  -4.195
   67    HA   ASP  10           HA       ASP  10  -9.390  -2.377  -4.522
   68   1HB   ASP  10          1HB       ASP  10  -9.945  -0.256  -6.322
   69   2HB   ASP  10          2HB       ASP  10  -8.176  -0.414  -6.260
   70    H    LEU  11           H        LEU  11  -8.716   0.731  -3.120
   71    HA   LEU  11           HA       LEU  11  -5.857   0.576  -3.111
   72   1HB   LEU  11          1HB       LEU  11  -7.589   2.535  -2.578
   73   2HB   LEU  11          2HB       LEU  11  -7.371   1.946  -0.912
   74    HG   LEU  11           HG       LEU  11  -5.225   2.929  -2.834
   75   1HD1  LEU  11          1HD1      LEU  11  -4.863   4.195  -0.444
   76   2HD1  LEU  11          2HD1      LEU  11  -5.876   4.841  -1.757
   77   3HD1  LEU  11          3HD1      LEU  11  -6.625   3.950  -0.411
   78   1HD2  LEU  11          1HD2      LEU  11  -4.803   1.790  -0.046
   79   2HD2  LEU  11          2HD2      LEU  11  -4.614   0.815  -1.523
   80   3HD2  LEU  11          3HD2      LEU  11  -3.567   2.229  -1.249
   81    H    TRP  12           H        TRP  12  -8.113   0.222  -0.312
   82    HA   TRP  12           HA       TRP  12  -6.291  -0.953   1.432
   83   1HB   TRP  12          1HB       TRP  12  -8.086  -0.907   2.745
   84   2HB   TRP  12          2HB       TRP  12  -9.043  -0.394   1.348
   85    HD1  TRP  12           HD       TRP  12 -11.073  -1.810   0.944
   86    HE1  TRP  12           1HE      TRP  12 -11.826  -4.200   1.399
   87    HE3  TRP  12           3HE      TRP  12  -6.785  -3.615   3.079
   88    HZ2  TRP  12           2HZ      TRP  12 -10.712  -6.611   2.550
   89    HZ3  TRP  12           3HZ      TRP  12  -6.669  -5.959   3.841
   90    HH2  TRP  12           HH       TRP  12  -8.618  -7.467   3.585
   91    H    LYS  13           H        LYS  13  -8.246  -2.443  -1.152
   92    HA   LYS  13           HA       LYS  13  -7.570  -5.150  -0.428
   93   1HB   LYS  13          1HB       LYS  13  -9.382  -3.906  -2.126
   94   2HB   LYS  13          2HB       LYS  13  -8.224  -4.658  -3.250
   95   1HG   LYS  13          1HG       LYS  13  -8.456  -6.767  -1.745
   96   2HG   LYS  13          2HG       LYS  13  -9.917  -5.975  -1.107
   97   1HD   LYS  13          1HD       LYS  13 -11.095  -6.383  -3.004
   98   2HD   LYS  13          2HD       LYS  13  -9.738  -5.902  -4.050
   99   1HE   LYS  13          1HE       LYS  13  -8.658  -8.084  -3.673
  100   2HE   LYS  13          2HE       LYS  13  -9.983  -8.565  -2.592
  101   1HZ   LYS  13          1HZ       LYS  13 -10.267  -9.430  -4.793
  102   2HZ   LYS  13          2HZ       LYS  13 -11.477  -8.367  -4.438
  103   3HZ   LYS  13          3HZ       LYS  13 -10.250  -7.915  -5.442
  104    H    LEU  14           H        LEU  14  -6.099  -2.608  -2.391
  105    HA   LEU  14           HA       LEU  14  -4.317  -4.302  -3.860
  106   1HB   LEU  14          1HB       LEU  14  -4.780  -1.428  -3.423
  107   2HB   LEU  14          2HB       LEU  14  -3.063  -1.841  -3.647
  108    HG   LEU  14           HG       LEU  14  -4.791  -1.438  -5.715
  109   1HD1  LEU  14          1HD1      LEU  14  -2.899  -3.624  -6.290
  110   2HD1  LEU  14          2HD1      LEU  14  -2.942  -1.960  -6.921
  111   3HD1  LEU  14          3HD1      LEU  14  -2.173  -2.296  -5.352
  112   1HD2  LEU  14          1HD2      LEU  14  -5.973  -3.284  -6.325
  113   2HD2  LEU  14          2HD2      LEU  14  -4.647  -4.388  -5.886
  114   3HD2  LEU  14          3HD2      LEU  14  -5.758  -3.787  -4.631
  115    H    LEU  15           H        LEU  15  -4.007  -2.418  -0.813
  116    HA   LEU  15           HA       LEU  15  -1.286  -3.009  -0.326
  117   1HB   LEU  15          1HB       LEU  15  -3.645  -2.328   1.449
  118   2HB   LEU  15          2HB       LEU  15  -2.019  -2.612   2.116
  119    HG   LEU  15           HG       LEU  15  -2.832  -0.517   0.061
  120   1HD1  LEU  15          1HD1      LEU  15  -2.098   1.060   1.765
  121   2HD1  LEU  15          2HD1      LEU  15  -3.272  -0.060   2.499
  122   3HD1  LEU  15          3HD1      LEU  15  -1.531  -0.269   2.805
  123   1HD2  LEU  15          1HD2      LEU  15  -0.300   0.106   0.459
  124   2HD2  LEU  15          2HD2      LEU  15  -0.147  -1.611   0.904
  125   3HD2  LEU  15          3HD2      LEU  15  -0.721  -1.160  -0.719
  126    H    LYS  16           H        LYS  16  -4.079  -5.030  -0.299
  127    HA   LYS  16           HA       LYS  16  -3.226  -6.907   1.700
  128   1HB   LYS  16          1HB       LYS  16  -5.534  -6.468   0.327
  129   2HB   LYS  16          2HB       LYS  16  -4.885  -7.855  -0.579
  130   1HG   LYS  16          1HG       LYS  16  -4.681  -8.061   2.381
  131   2HG   LYS  16          2HG       LYS  16  -6.336  -8.086   1.729
  132   1HD   LYS  16          1HD       LYS  16  -5.185  -9.771  -0.028
  133   2HD   LYS  16          2HD       LYS  16  -4.099 -10.045   1.356
  134   1HE   LYS  16          1HE       LYS  16  -6.429 -10.149   2.674
  135   2HE   LYS  16          2HE       LYS  16  -7.029 -10.626   1.071
  136   1HZ   LYS  16          1HZ       LYS  16  -6.403 -12.607   1.837
  137   2HZ   LYS  16          2HZ       LYS  16  -4.932 -12.155   1.245
  138   3HZ   LYS  16          3HZ       LYS  16  -5.250 -12.018   2.857
  139    H    LYS  17           H        LYS  17  -1.447  -5.994  -0.757
  140    HA   LYS  17           HA       LYS  17  -0.038  -8.500  -0.949
  141   1HB   LYS  17          1HB       LYS  17  -1.292  -9.336  -2.651
  142   2HB   LYS  17          2HB       LYS  17  -1.993  -7.749  -3.049
  143   1HG   LYS  17          1HG       LYS  17   0.871  -8.564  -3.695
  144   2HG   LYS  17          2HG       LYS  17  -0.482  -8.674  -4.846
  145   1HD   LYS  17          1HD       LYS  17  -0.651  -6.075  -3.772
  146   2HD   LYS  17          2HD       LYS  17   1.086  -6.344  -4.052
  147   1HE   LYS  17          1HE       LYS  17   0.283  -7.319  -6.358
  148   2HE   LYS  17          2HE       LYS  17  -1.199  -6.396  -6.027
  149   1HZ   LYS  17          1HZ       LYS  17   1.343  -5.478  -6.838
  150   2HZ   LYS  17          2HZ       LYS  17  -0.112  -4.702  -6.854
  151   3HZ   LYS  17          3HZ       LYS  17   0.816  -4.685  -5.491
  152    H    TRP  18           H        TRP  18  -0.644  -5.177  -2.036
  153    HA   TRP  18           HA       TRP  18   1.978  -4.843  -3.215
  154   1HB   TRP  18          1HB       TRP  18  -0.403  -3.521  -3.355
  155   2HB   TRP  18          2HB       TRP  18   0.486  -2.480  -2.235
  156    HD1  TRP  18           HD       TRP  18  -0.143  -2.899  -5.773
  157    HE1  TRP  18           1HE      TRP  18   1.542  -1.664  -7.229
  158    HE3  TRP  18           3HE      TRP  18   3.439  -1.956  -2.240
  159    HZ2  TRP  18           2HZ      TRP  18   4.134  -0.416  -6.911
  160    HZ3  TRP  18           3HZ      TRP  18   5.499  -0.744  -2.854
  161    HH2  TRP  18           HH       TRP  18   5.861   0.031  -5.179
  162    H    LYS  19           H        LYS  19   0.423  -3.948  -0.101
  163    HA   LYS  19           HA       LYS  19   2.389  -2.447   1.086
  164   1HB   LYS  19          1HB       LYS  19   1.316  -2.916   3.061
  165   2HB   LYS  19          2HB       LYS  19   0.093  -3.561   1.940
  166   1HG   LYS  19          1HG       LYS  19   1.105  -5.816   2.142
  167   2HG   LYS  19          2HG       LYS  19   2.314  -5.168   3.276
  168   1HD   LYS  19          1HD       LYS  19   0.531  -4.522   4.842
  169   2HD   LYS  19          2HD       LYS  19  -0.705  -5.093   3.696
  170   1HE   LYS  19          1HE       LYS  19   0.055  -7.371   3.890
  171   2HE   LYS  19          2HE       LYS  19   1.497  -6.874   4.802
  172   1HZ   LYS  19          1HZ       LYS  19  -0.795  -7.682   5.880
  173   2HZ   LYS  19          2HZ       LYS  19   0.340  -6.771   6.656
  174   3HZ   LYS  19          3HZ       LYS  19  -0.967  -6.044   5.961
  175    H    MET  20           H        MET  20   2.299  -6.030   0.809
  176    HA   MET  20           HA       MET  20   4.346  -6.909   2.297
  177   1HB   MET  20          1HB       MET  20   3.463  -8.530   0.894
  178   2HB   MET  20          2HB       MET  20   3.570  -7.493  -0.548
  179   1HG   MET  20          1HG       MET  20   6.215  -7.756   0.347
  180   2HG   MET  20          2HG       MET  20   5.517  -9.371   0.552
  181   1HE   MET  20          1HE       MET  20   6.116  -6.650  -2.828
  182   2HE   MET  20          2HE       MET  20   4.461  -7.209  -3.169
  183   3HE   MET  20          3HE       MET  20   4.848  -6.486  -1.590
  184    H    ARG  21           H        ARG  21   4.696  -4.868  -0.607
  185    HA   ARG  21           HA       ARG  21   7.626  -4.761  -0.112
  186   1HB   ARG  21          1HB       ARG  21   5.910  -4.739  -2.489
  187   2HB   ARG  21          2HB       ARG  21   7.071  -3.390  -2.475
  188   1HG   ARG  21          1HG       ARG  21   7.828  -5.684  -3.479
  189   2HG   ARG  21          2HG       ARG  21   8.934  -4.830  -2.376
  190   1HD   ARG  21          1HD       ARG  21   8.762  -6.433  -0.782
  191   2HD   ARG  21          2HD       ARG  21   7.002  -6.572  -0.988
  192    HE   ARG  21           HE       ARG  21   7.952  -7.787  -3.239
  193   1HH1  ARG  21          2HH2      ARG  21   8.695  -8.105   0.203
  194   2HH1  ARG  21          1HH2      ARG  21   9.119  -9.799   0.095
  195   1HH2  ARG  21          2HH1      ARG  21   8.512 -10.025  -3.381
  196   2HH2  ARG  21          1HH1      ARG  21   9.014 -10.893  -1.949
  197    H    ARG  22           H        ARG  22   4.664  -2.799  -0.509
  198    HA   ARG  22           HA       ARG  22   6.085  -0.295  -0.099
  199   1HB   ARG  22          1HB       ARG  22   4.014  -0.502  -1.475
  200   2HB   ARG  22          2HB       ARG  22   3.108  -0.924  -0.003
  201   1HG   ARG  22          1HG       ARG  22   4.579   1.411   0.638
  202   2HG   ARG  22          2HG       ARG  22   3.895   1.697  -0.981
  203   1HD   ARG  22          1HD       ARG  22   2.383   2.371   0.933
  204   2HD   ARG  22          2HD       ARG  22   1.664   1.212  -0.206
  205    HE   ARG  22           HE       ARG  22   2.827  -0.351   1.777
  206   1HH1  ARG  22          2HH2      ARG  22   0.423   2.236   1.608
  207   2HH1  ARG  22          1HH2      ARG  22  -0.484   1.669   2.993
  208   1HH2  ARG  22          2HH1      ARG  22   1.628  -1.099   3.606
  209   2HH2  ARG  22          1HH1      ARG  22   0.203  -0.232   4.131
  210    H    ASN  23           H        ASN  23   6.205  -2.557   1.950
  211    HA   ASN  23           HA       ASN  23   5.657  -0.820   4.271
  212   1HB   ASN  23          1HB       ASN  23   3.858  -2.817   3.534
  213   2HB   ASN  23          2HB       ASN  23   4.867  -3.596   4.772
  214   1HD2  ASN  23          1HD2      ASN  23   2.273  -3.259   5.437
  215   2HD2  ASN  23          2HD2      ASN  23   2.073  -1.946   6.577
  216    H    GLN  24           H        GLN  24   7.931  -2.159   2.607
  217    HA   GLN  24           HA       GLN  24   9.435  -3.039   4.998
  218   1HB   GLN  24          1HB       GLN  24   9.055  -4.611   2.430
  219   2HB   GLN  24          2HB       GLN  24  10.415  -4.898   3.541
  220   1HG   GLN  24          1HG       GLN  24   8.338  -4.872   5.306
  221   2HG   GLN  24          2HG       GLN  24   7.519  -5.510   3.864
  222   1HE2  GLN  24          1HE2      GLN  24   7.323  -7.467   5.302
  223   2HE2  GLN  24          2HE2      GLN  24   8.646  -8.613   5.301
  224    H    PHE  25           H        PHE  25  10.738  -3.705   1.862
  225    HA   PHE  25           HA       PHE  25  12.922  -1.922   2.227
  226   1HB   PHE  25          1HB       PHE  25  13.614  -3.463   0.750
  227   2HB   PHE  25          2HB       PHE  25  11.958  -3.853   0.254
  228    HD1  PHE  25           1HD      PHE  25  10.864  -1.617  -1.043
  229    HD2  PHE  25           2HD      PHE  25  14.967  -2.890  -1.028
  230    HE1  PHE  25           1HE      PHE  25  11.234  -0.451  -3.200
  231    HE2  PHE  25           2HE      PHE  25  15.337  -1.724  -3.186
  232    HZ   PHE  25           HZ       PHE  25  13.470  -0.504  -4.271
  233    H    TRP  26           H        TRP  26   9.728  -1.208   1.570
  234    HA   TRP  26           HA       TRP  26  10.225   0.937  -0.359
  235   1HB   TRP  26          1HB       TRP  26   7.941  -0.465   0.827
  236   2HB   TRP  26          2HB       TRP  26   7.691   1.282   0.718
  237    HD1  TRP  26           HD       TRP  26   7.964  -1.848  -1.380
  238    HE1  TRP  26           1HE      TRP  26   7.312  -1.365  -3.794
  239    HE3  TRP  26           3HE      TRP  26   7.695   3.257  -1.137
  240    HZ2  TRP  26           2HZ      TRP  26   6.742   0.952  -5.432
  241    HZ3  TRP  26           3HZ      TRP  26   7.096   4.566  -3.141
  242    HH2  TRP  26           HH       TRP  26   6.618   3.432  -5.291
  243    H    VAL  27           H        VAL  27   8.572   0.968   2.843
  244    HA   VAL  27           HA       VAL  27   8.522   3.494   3.572
  245    HB   VAL  27           HB       VAL  27   9.049   2.884   5.859
  246   1HG1  VAL  27          1HG1      VAL  27   7.053   1.826   4.545
  247   2HG1  VAL  27          2HG1      VAL  27   8.007   0.325   4.619
  248   3HG1  VAL  27          3HG1      VAL  27   7.495   1.129   6.122
  249   1HG2  VAL  27          1HG2      VAL  27   9.943   0.299   5.915
  250   2HG2  VAL  27          2HG2      VAL  27  10.783   0.907   4.468
  251   3HG2  VAL  27          3HG2      VAL  27  11.009   1.720   6.035
  252    H    LYS  28           H        LYS  28  11.571   1.687   3.161
  253    HA   LYS  28           HA       LYS  28  13.261   3.811   4.105
  254   1HB   LYS  28          1HB       LYS  28  13.690   1.319   2.433
  255   2HB   LYS  28          2HB       LYS  28  15.012   2.454   2.795
  256   1HG   LYS  28          1HG       LYS  28  13.239   1.344   4.990
  257   2HG   LYS  28          2HG       LYS  28  14.665   0.451   4.411
  258   1HD   LYS  28          1HD       LYS  28  15.152   3.324   4.952
  259   2HD   LYS  28          2HD       LYS  28  14.718   2.366   6.389
  260   1HE   LYS  28          1HE       LYS  28  16.621   0.994   4.610
  261   2HE   LYS  28          2HE       LYS  28  17.249   2.529   5.249
  262   1HZ   LYS  28          1HZ       LYS  28  17.075   1.780   7.374
  263   2HZ   LYS  28          2HZ       LYS  28  15.960   0.617   7.024
  264   3HZ   LYS  28          3HZ       LYS  28  17.536   0.406   6.588
  265    H    VAL  29           H        VAL  29  12.062   2.778   0.890
  266    HA   VAL  29           HA       VAL  29  13.587   4.436  -0.745
  267    HB   VAL  29           HB       VAL  29  11.723   4.283  -2.329
  268   1HG1  VAL  29          1HG1      VAL  29  11.228   1.695  -1.844
  269   2HG1  VAL  29          2HG1      VAL  29  12.833   2.251  -2.376
  270   3HG1  VAL  29          3HG1      VAL  29  12.530   1.925  -0.653
  271   1HG2  VAL  29          1HG2      VAL  29   9.594   4.320  -1.593
  272   2HG2  VAL  29          2HG2      VAL  29   9.847   2.765  -0.764
  273   3HG2  VAL  29          3HG2      VAL  29  10.180   4.292   0.087
  274    H    GLN  30           H        GLN  30  11.499   5.354   1.782
  275    HA   GLN  30           HA       GLN  30  10.813   7.953   0.579
  276   1HB   GLN  30          1HB       GLN  30  10.280   7.251   3.449
  277   2HB   GLN  30          2HB       GLN  30   9.276   8.159   2.294
  278   1HG   GLN  30          1HG       GLN  30   9.734   5.422   1.386
  279   2HG   GLN  30          2HG       GLN  30   9.003   5.449   3.005
  280   1HE2  GLN  30          1HE2      GLN  30   8.702   7.209  -0.140
  281   2HE2  GLN  30          2HE2      GLN  30   6.951   7.219  -0.159
  282    H    ARG  31           H        ARG  31  12.627   6.647   3.408
  283    HA   ARG  31           HA       ARG  31  14.044   7.801   4.855
  284   1HB   ARG  31          1HB       ARG  31  15.529   6.863   3.189
  285   2HB   ARG  31          2HB       ARG  31  15.210   8.216   2.077
  286   1HG   ARG  31          1HG       ARG  31  16.065   9.180   4.697
  287   2HG   ARG  31          2HG       ARG  31  17.264   8.065   3.997
  288   1HD   ARG  31          1HD       ARG  31  16.537   9.595   1.813
  289   2HD   ARG  31          2HD       ARG  31  16.468  10.778   3.137
  290    HE   ARG  31           HE       ARG  31  18.865   9.419   3.508
  291   1HH1  ARG  31          2HH2      ARG  31  17.335  11.298   0.933
  292   2HH1  ARG  31          1HH2      ARG  31  18.847  11.890   0.280
  293   1HH2  ARG  31          2HH1      ARG  31  20.861  10.200   2.645
  294   2HH2  ARG  31          1HH1      ARG  31  20.857  11.264   1.256
  295    H    GLY  32           H        GLY  32  12.688   9.475   5.668
  296   1HA   GLY  32          1HA       GLY  32  13.665  12.097   5.304
  297   2HA   GLY  32          2HA       GLY  32  12.196  11.923   4.316
  Start of MODEL   23
    1    HA   PRO   1           HA       PRO   1 -18.892   0.131   2.584
    2   1HB   PRO   1          1HB       PRO   1 -19.625   2.623   1.759
    3   2HB   PRO   1          2HB       PRO   1 -20.671   1.191   1.486
    4   1HG   PRO   1          1HG       PRO   1 -20.845   3.188   3.761
    5   2HG   PRO   1          2HG       PRO   1 -22.169   2.663   2.671
    6   1HD   PRO   1          1HD       PRO   1 -21.800   1.513   5.115
    7   2HD   PRO   1          2HD       PRO   1 -22.254   0.514   3.701
    8    HA   PRO   2           HA       PRO   2 -15.662   2.383   4.557
    9   1HB   PRO   2          1HB       PRO   2 -14.100   3.108   2.446
   10   2HB   PRO   2          2HB       PRO   2 -14.343   1.388   2.896
   11   1HG   PRO   2          1HG       PRO   2 -15.851   2.968   0.794
   12   2HG   PRO   2          2HG       PRO   2 -15.037   1.384   0.588
   13   1HD   PRO   2          1HD       PRO   2 -17.707   1.553   1.108
   14   2HD   PRO   2          2HD       PRO   2 -16.711   0.281   1.879
   15    H    LEU   3           H        LEU   3 -18.176   3.790   2.969
   16    HA   LEU   3           HA       LEU   3 -18.993   5.943   3.139
   17   1HB   LEU   3          1HB       LEU   3 -16.869   5.973   4.967
   18   2HB   LEU   3          2HB       LEU   3 -16.548   7.354   3.890
   19    HG   LEU   3           HG       LEU   3 -19.357   7.323   4.413
   20   1HD1  LEU   3          1HD1      LEU   3 -18.961   7.790   7.003
   21   2HD1  LEU   3          2HD1      LEU   3 -19.263   6.138   6.413
   22   3HD1  LEU   3          3HD1      LEU   3 -17.601   6.666   6.769
   23   1HD2  LEU   3          1HD2      LEU   3 -17.086   9.085   5.431
   24   2HD2  LEU   3          2HD2      LEU   3 -17.998   9.308   3.919
   25   3HD2  LEU   3          3HD2      LEU   3 -18.814   9.510   5.488
   26    H    SER   4           H        SER   4 -16.776   4.675   1.128
   27    HA   SER   4           HA       SER   4 -17.000   6.961  -0.718
   28   1HB   SER   4          1HB       SER   4 -14.782   7.021   0.649
   29   2HB   SER   4          2HB       SER   4 -14.316   5.622  -0.347
   30    HG   SER   4           HG       SER   4 -15.237   8.112  -1.354
   31    H    GLN   5           H        GLN   5 -14.908   5.579  -2.418
   32    HA   GLN   5           HA       GLN   5 -15.511   2.928  -2.987
   33   1HB   GLN   5          1HB       GLN   5 -17.113   3.282  -4.953
   34   2HB   GLN   5          2HB       GLN   5 -17.818   3.420  -3.325
   35   1HG   GLN   5          1HG       GLN   5 -17.293   5.950  -3.527
   36   2HG   GLN   5          2HG       GLN   5 -17.080   5.632  -5.262
   37   1HE2  GLN   5          1HE2      GLN   5 -19.002   7.371  -4.842
   38   2HE2  GLN   5          2HE2      GLN   5 -20.599   6.661  -4.933
   39    H    GLU   6           H        GLU   6 -15.181   6.167  -4.505
   40    HA   GLU   6           HA       GLU   6 -14.072   5.728  -6.903
   41   1HB   GLU   6          1HB       GLU   6 -13.896   7.758  -4.938
   42   2HB   GLU   6          2HB       GLU   6 -12.227   7.434  -5.464
   43   1HG   GLU   6          1HG       GLU   6 -13.087   7.547  -7.860
   44   2HG   GLU   6          2HG       GLU   6 -14.619   8.156  -7.197
   45    H    THR   7           H        THR   7 -11.760   6.001  -4.160
   46    HA   THR   7           HA       THR   7  -9.914   4.234  -5.591
   47    HB   THR   7           HB       THR   7  -9.213   5.028  -2.849
   48    HG1  THR   7           1HG      THR   7  -9.774   7.029  -2.986
   49   1HG2  THR   7          1HG2      THR   7  -8.002   5.728  -5.555
   50   2HG2  THR   7          2HG2      THR   7  -7.191   5.768  -3.971
   51   3HG2  THR   7          3HG2      THR   7  -7.678   4.211  -4.681
   52    H    PHE   8           H        PHE   8 -10.228   4.182  -2.074
   53    HA   PHE   8           HA       PHE   8  -9.884   1.994  -1.022
   54   1HB   PHE   8          1HB       PHE   8 -12.869   2.242  -1.322
   55   2HB   PHE   8          2HB       PHE   8 -11.919   1.802   0.107
   56    HD1  PHE   8           1HD      PHE   8 -11.894   4.728  -2.260
   57    HD2  PHE   8           2HD      PHE   8 -12.161   3.354   1.801
   58    HE1  PHE   8           1HE      PHE   8 -11.992   7.078  -1.472
   59    HE2  PHE   8           2HE      PHE   8 -12.258   5.704   2.589
   60    HZ   PHE   8           HZ       PHE   8 -12.174   7.565   0.953
   61    H    SER   9           H        SER   9 -12.666   1.774  -3.320
   62    HA   SER   9           HA       SER   9 -13.007  -0.873  -3.597
   63   1HB   SER   9          1HB       SER   9 -14.040   0.979  -4.986
   64   2HB   SER   9          2HB       SER   9 -12.591   0.918  -6.018
   65    HG   SER   9           HG       SER   9 -13.170  -0.997  -6.750
   66    H    ASP  10           H        ASP  10 -10.511   0.861  -5.555
   67    HA   ASP  10           HA       ASP  10  -9.140  -1.728  -5.954
   68   1HB   ASP  10          1HB       ASP  10  -9.051   0.991  -7.260
   69   2HB   ASP  10          2HB       ASP  10  -7.708  -0.154  -7.474
   70    H    LEU  11           H        LEU  11  -8.879   1.350  -4.265
   71    HA   LEU  11           HA       LEU  11  -6.075   1.254  -3.731
   72   1HB   LEU  11          1HB       LEU  11  -8.043   3.092  -3.378
   73   2HB   LEU  11          2HB       LEU  11  -7.897   2.471  -1.716
   74    HG   LEU  11           HG       LEU  11  -5.393   2.808  -1.906
   75   1HD1  LEU  11          1HD1      LEU  11  -6.093   3.237  -4.629
   76   2HD1  LEU  11          2HD1      LEU  11  -5.536   4.805  -3.998
   77   3HD1  LEU  11          3HD1      LEU  11  -4.481   3.376  -3.887
   78   1HD2  LEU  11          1HD2      LEU  11  -5.922   4.684  -0.776
   79   2HD2  LEU  11          2HD2      LEU  11  -6.103   5.536  -2.328
   80   3HD2  LEU  11          3HD2      LEU  11  -7.511   4.747  -1.576
   81    H    TRP  12           H        TRP  12  -8.792   0.682  -1.420
   82    HA   TRP  12           HA       TRP  12  -7.299  -0.508   0.593
   83   1HB   TRP  12          1HB       TRP  12  -9.323  -0.627   1.506
   84   2HB   TRP  12          2HB       TRP  12 -10.009  -0.104  -0.038
   85    HD1  TRP  12           HD       TRP  12 -11.820  -1.614  -0.890
   86    HE1  TRP  12           1HE      TRP  12 -12.479  -4.066  -0.693
   87    HE3  TRP  12           3HE      TRP  12  -7.920  -3.270   1.982
   88    HZ2  TRP  12           2HZ      TRP  12 -11.448  -6.464   0.557
   89    HZ3  TRP  12           3HZ      TRP  12  -7.793  -5.641   2.655
   90    HH2  TRP  12           HH       TRP  12  -9.544  -7.247   1.953
   91    H    LYS  13           H        LYS  13  -8.619  -1.967  -2.387
   92    HA   LYS  13           HA       LYS  13  -7.897  -4.661  -1.661
   93   1HB   LYS  13          1HB       LYS  13  -9.608  -3.713  -3.436
   94   2HB   LYS  13          2HB       LYS  13  -8.187  -3.726  -4.508
   95   1HG   LYS  13          1HG       LYS  13  -7.919  -6.179  -3.387
   96   2HG   LYS  13          2HG       LYS  13  -9.688  -6.006  -3.291
   97   1HD   LYS  13          1HD       LYS  13  -9.305  -5.120  -5.817
   98   2HD   LYS  13          2HD       LYS  13  -7.911  -6.218  -5.688
   99   1HE   LYS  13          1HE       LYS  13  -9.292  -8.093  -5.217
  100   2HE   LYS  13          2HE       LYS  13 -10.696  -7.069  -4.845
  101   1HZ   LYS  13          1HZ       LYS  13 -11.060  -7.902  -6.947
  102   2HZ   LYS  13          2HZ       LYS  13 -10.529  -6.365  -7.224
  103   3HZ   LYS  13          3HZ       LYS  13  -9.512  -7.643  -7.455
  104    H    LEU  14           H        LEU  14  -6.293  -1.941  -3.264
  105    HA   LEU  14           HA       LEU  14  -4.159  -3.413  -4.447
  106   1HB   LEU  14          1HB       LEU  14  -4.896  -0.622  -3.942
  107   2HB   LEU  14          2HB       LEU  14  -3.144  -0.899  -3.791
  108    HG   LEU  14           HG       LEU  14  -4.339  -0.431  -6.169
  109   1HD1  LEU  14          1HD1      LEU  14  -1.857  -1.350  -5.246
  110   2HD1  LEU  14          2HD1      LEU  14  -2.324  -2.535  -6.489
  111   3HD1  LEU  14          3HD1      LEU  14  -2.231  -0.806  -6.899
  112   1HD2  LEU  14          1HD2      LEU  14  -5.433  -2.891  -5.472
  113   2HD2  LEU  14          2HD2      LEU  14  -5.340  -2.229  -7.122
  114   3HD2  LEU  14          3HD2      LEU  14  -4.080  -3.342  -6.537
  115    H    LEU  15           H        LEU  15  -4.470  -1.708  -1.290
  116    HA   LEU  15           HA       LEU  15  -1.861  -2.255  -0.359
  117   1HB   LEU  15          1HB       LEU  15  -4.512  -1.583   0.880
  118   2HB   LEU  15          2HB       LEU  15  -3.197  -2.143   1.941
  119    HG   LEU  15           HG       LEU  15  -2.856   0.084  -0.105
  120   1HD1  LEU  15          1HD1      LEU  15  -3.813   0.108   2.760
  121   2HD1  LEU  15          2HD1      LEU  15  -2.851   1.469   2.137
  122   3HD1  LEU  15          3HD1      LEU  15  -4.401   1.049   1.369
  123   1HD2  LEU  15          1HD2      LEU  15  -1.254  -0.698   2.368
  124   2HD2  LEU  15          2HD2      LEU  15  -0.821  -1.143   0.700
  125   3HD2  LEU  15          3HD2      LEU  15  -0.839   0.568   1.188
  126    H    LYS  16           H        LYS  16  -4.544  -4.351  -0.922
  127    HA   LYS  16           HA       LYS  16  -4.070  -6.311   1.087
  128   1HB   LYS  16          1HB       LYS  16  -6.030  -5.947  -0.662
  129   2HB   LYS  16          2HB       LYS  16  -5.051  -7.052  -1.656
  130   1HG   LYS  16          1HG       LYS  16  -5.063  -8.729   0.121
  131   2HG   LYS  16          2HG       LYS  16  -5.918  -7.613   1.212
  132   1HD   LYS  16          1HD       LYS  16  -7.931  -8.031   0.242
  133   2HD   LYS  16          2HD       LYS  16  -7.249  -7.975  -1.401
  134   1HE   LYS  16          1HE       LYS  16  -6.596 -10.305   0.395
  135   2HE   LYS  16          2HE       LYS  16  -8.177 -10.250  -0.414
  136   1HZ   LYS  16          1HZ       LYS  16  -5.525 -10.461  -1.575
  137   2HZ   LYS  16          2HZ       LYS  16  -6.898 -11.304  -1.927
  138   3HZ   LYS  16          3HZ       LYS  16  -6.727  -9.750  -2.453
  139    H    LYS  17           H        LYS  17  -1.779  -5.177  -0.792
  140    HA   LYS  17           HA       LYS  17  -0.206  -7.587  -0.696
  141   1HB   LYS  17          1HB       LYS  17  -0.031  -8.144  -2.953
  142   2HB   LYS  17          2HB       LYS  17  -1.760  -7.748  -2.812
  143   1HG   LYS  17          1HG       LYS  17  -0.874  -6.618  -4.775
  144   2HG   LYS  17          2HG       LYS  17  -1.209  -5.393  -3.527
  145   1HD   LYS  17          1HD       LYS  17   0.981  -4.832  -3.346
  146   2HD   LYS  17          2HD       LYS  17   1.497  -6.535  -3.319
  147   1HE   LYS  17          1HE       LYS  17   1.470  -6.686  -5.701
  148   2HE   LYS  17          2HE       LYS  17   0.573  -5.161  -5.862
  149   1HZ   LYS  17          1HZ       LYS  17   2.752  -4.656  -6.341
  150   2HZ   LYS  17          2HZ       LYS  17   2.571  -4.138  -4.786
  151   3HZ   LYS  17          3HZ       LYS  17   3.366  -5.549  -5.098
  152    H    TRP  18           H        TRP  18  -0.761  -4.223  -1.322
  153    HA   TRP  18           HA       TRP  18   2.070  -3.698  -1.933
  154   1HB   TRP  18          1HB       TRP  18  -0.339  -2.490  -2.598
  155   2HB   TRP  18          2HB       TRP  18   0.323  -1.416  -1.358
  156    HD1  TRP  18           HD       TRP  18   0.253  -1.721  -4.908
  157    HE1  TRP  18           1HE      TRP  18   2.197  -0.559  -6.072
  158    HE3  TRP  18           3HE      TRP  18   3.359  -1.121  -0.885
  159    HZ2  TRP  18           2HZ      TRP  18   4.791   0.505  -5.355
  160    HZ3  TRP  18           3HZ      TRP  18   5.555  -0.031  -1.164
  161    HH2  TRP  18           HH       TRP  18   6.285   0.786  -3.386
  162    H    LYS  19           H        LYS  19  -0.354  -3.045   0.638
  163    HA   LYS  19           HA       LYS  19   0.977  -1.466   2.389
  164   1HB   LYS  19          1HB       LYS  19  -1.233  -2.970   2.568
  165   2HB   LYS  19          2HB       LYS  19  -0.149  -3.989   3.545
  166   1HG   LYS  19          1HG       LYS  19   0.488  -1.573   4.578
  167   2HG   LYS  19          2HG       LYS  19  -1.186  -1.233   4.078
  168   1HD   LYS  19          1HD       LYS  19  -2.024  -2.479   5.767
  169   2HD   LYS  19          2HD       LYS  19  -0.965  -3.850   5.360
  170   1HE   LYS  19          1HE       LYS  19   0.582  -1.673   6.504
  171   2HE   LYS  19          2HE       LYS  19  -0.753  -2.119   7.588
  172   1HZ   LYS  19          1HZ       LYS  19   1.360  -3.851   6.536
  173   2HZ   LYS  19          2HZ       LYS  19   1.040  -3.476   8.110
  174   3HZ   LYS  19          3HZ       LYS  19   0.003  -4.440   7.265
  175    H    MET  20           H        MET  20   1.441  -5.044   2.217
  176    HA   MET  20           HA       MET  20   3.289  -5.548   4.093
  177   1HB   MET  20          1HB       MET  20   4.517  -6.872   2.115
  178   2HB   MET  20          2HB       MET  20   2.926  -7.373   2.737
  179   1HG   MET  20          1HG       MET  20   1.915  -6.892   0.793
  180   2HG   MET  20          2HG       MET  20   2.664  -5.289   0.724
  181   1HE   MET  20          1HE       MET  20   3.739  -4.515  -0.737
  182   2HE   MET  20          2HE       MET  20   5.261  -5.131  -1.425
  183   3HE   MET  20          3HE       MET  20   3.737  -5.320  -2.325
  184    H    ARG  21           H        ARG  21   4.052  -3.941   0.964
  185    HA   ARG  21           HA       ARG  21   6.750  -3.307   1.992
  186   1HB   ARG  21          1HB       ARG  21   5.412  -3.435  -0.681
  187   2HB   ARG  21          2HB       ARG  21   6.735  -2.261  -0.481
  188   1HG   ARG  21          1HG       ARG  21   7.284  -4.731  -1.225
  189   2HG   ARG  21          2HG       ARG  21   8.318  -3.924  -0.022
  190   1HD   ARG  21          1HD       ARG  21   6.943  -4.966   1.792
  191   2HD   ARG  21          2HD       ARG  21   6.022  -5.842   0.550
  192    HE   ARG  21           HE       ARG  21   8.738  -6.415   1.479
  193   1HH1  ARG  21          2HH2      ARG  21   6.316  -6.825  -1.065
  194   2HH1  ARG  21          1HH2      ARG  21   7.035  -8.286  -1.703
  195   1HH2  ARG  21          2HH1      ARG  21   9.688  -8.346   0.635
  196   2HH2  ARG  21          1HH1      ARG  21   8.957  -9.153  -0.734
  197    H    ARG  22           H        ARG  22   3.680  -1.797   0.989
  198    HA   ARG  22           HA       ARG  22   4.650   0.905   1.190
  199   1HB   ARG  22          1HB       ARG  22   2.211  -0.486   0.494
  200   2HB   ARG  22          2HB       ARG  22   1.850   0.837   1.629
  201   1HG   ARG  22          1HG       ARG  22   3.678   1.251  -0.756
  202   2HG   ARG  22          2HG       ARG  22   1.911   1.410  -0.901
  203   1HD   ARG  22          1HD       ARG  22   2.275   3.561  -0.261
  204   2HD   ARG  22          2HD       ARG  22   2.392   2.869   1.371
  205    HE   ARG  22           HE       ARG  22   4.932   2.637   0.662
  206   1HH1  ARG  22          2HH2      ARG  22   2.674   5.272  -0.020
  207   2HH1  ARG  22          1HH2      ARG  22   3.914   6.505  -0.069
  208   1HH2  ARG  22          2HH1      ARG  22   6.569   4.267   0.597
  209   2HH2  ARG  22          1HH1      ARG  22   6.135   5.932   0.284
  210    H    ASN  23           H        ASN  23   4.991  -1.114   3.513
  211    HA   ASN  23           HA       ASN  23   4.197   0.823   5.598
  212   1HB   ASN  23          1HB       ASN  23   2.639  -1.404   5.108
  213   2HB   ASN  23          2HB       ASN  23   3.745  -1.984   6.371
  214   1HD2  ASN  23          1HD2      ASN  23   2.409  -2.008   8.147
  215   2HD2  ASN  23          2HD2      ASN  23   1.606  -0.589   8.784
  216    H    GLN  24           H        GLN  24   6.649  -0.452   4.119
  217    HA   GLN  24           HA       GLN  24   8.401  -0.362   6.375
  218   1HB   GLN  24          1HB       GLN  24   9.121  -2.889   5.845
  219   2HB   GLN  24          2HB       GLN  24   7.900  -2.496   7.079
  220   1HG   GLN  24          1HG       GLN  24   6.097  -2.886   5.487
  221   2HG   GLN  24          2HG       GLN  24   7.265  -3.125   4.169
  222   1HE2  GLN  24          1HE2      GLN  24   5.460  -4.623   6.673
  223   2HE2  GLN  24          2HE2      GLN  24   6.206  -6.205   6.606
  224    H    PHE  25           H        PHE  25   9.114  -2.796   3.990
  225    HA   PHE  25           HA       PHE  25  11.441  -1.952   3.021
  226   1HB   PHE  25          1HB       PHE  25  10.543  -3.883   2.049
  227   2HB   PHE  25          2HB       PHE  25   9.057  -3.059   1.547
  228    HD1  PHE  25           1HD      PHE  25   9.548  -0.966  -0.114
  229    HD2  PHE  25           2HD      PHE  25  12.032  -4.437   0.375
  230    HE1  PHE  25           1HE      PHE  25  10.515  -0.591  -2.367
  231    HE2  PHE  25           2HE      PHE  25  12.999  -4.062  -1.878
  232    HZ   PHE  25           HZ       PHE  25  12.241  -2.139  -3.249
  233    H    TRP  26           H        TRP  26   8.295  -0.576   1.949
  234    HA   TRP  26           HA       TRP  26   9.136   1.170  -0.010
  235   1HB   TRP  26          1HB       TRP  26   7.176   2.376   0.394
  236   2HB   TRP  26          2HB       TRP  26   6.803   0.743   0.963
  237    HD1  TRP  26           HD       TRP  26   5.940   0.506   3.341
  238    HE1  TRP  26           1HE      TRP  26   5.593   2.040   5.345
  239    HE3  TRP  26           3HE      TRP  26   8.367   4.664   1.603
  240    HZ2  TRP  26           2HZ      TRP  26   6.281   4.745   6.110
  241    HZ3  TRP  26           3HZ      TRP  26   8.500   6.697   2.996
  242    HH2  TRP  26           HH       TRP  26   7.465   6.754   5.246
  243    H    VAL  27           H        VAL  27   9.305   1.629   3.545
  244    HA   VAL  27           HA       VAL  27  10.089   4.227   3.791
  245    HB   VAL  27           HB       VAL  27  11.296   3.572   5.768
  246   1HG1  VAL  27          1HG1      VAL  27   9.587   1.286   6.052
  247   2HG1  VAL  27          2HG1      VAL  27   9.332   2.936   6.667
  248   3HG1  VAL  27          3HG1      VAL  27   8.734   2.487   5.052
  249   1HG2  VAL  27          1HG2      VAL  27  12.827   1.937   4.909
  250   2HG2  VAL  27          2HG2      VAL  27  11.812   1.085   6.098
  251   3HG2  VAL  27          3HG2      VAL  27  11.501   0.886   4.357
  252    H    LYS  28           H        LYS  28  12.237   1.488   2.861
  253    HA   LYS  28           HA       LYS  28  14.601   3.012   2.589
  254   1HB   LYS  28          1HB       LYS  28  13.603   0.446   1.320
  255   2HB   LYS  28          2HB       LYS  28  15.215   1.111   0.967
  256   1HG   LYS  28          1HG       LYS  28  14.220   0.650   3.802
  257   2HG   LYS  28          2HG       LYS  28  15.095  -0.595   2.879
  258   1HD   LYS  28          1HD       LYS  28  16.737   1.529   2.459
  259   2HD   LYS  28          2HD       LYS  28  16.085   1.962   4.058
  260   1HE   LYS  28          1HE       LYS  28  16.590  -0.587   4.594
  261   2HE   LYS  28          2HE       LYS  28  17.729  -0.425   3.240
  262   1HZ   LYS  28          1HZ       LYS  28  17.918   1.748   5.009
  263   2HZ   LYS  28          2HZ       LYS  28  18.136   0.326   5.815
  264   3HZ   LYS  28          3HZ       LYS  28  19.085   0.692   4.517
  265    H    VAL  29           H        VAL  29  11.866   2.438   0.383
  266    HA   VAL  29           HA       VAL  29  12.890   3.272  -2.040
  267    HB   VAL  29           HB       VAL  29  10.196   3.906  -0.774
  268   1HG1  VAL  29          1HG1      VAL  29  11.115   4.017  -3.679
  269   2HG1  VAL  29          2HG1      VAL  29   9.436   4.210  -3.121
  270   3HG1  VAL  29          3HG1      VAL  29  10.668   5.413  -2.669
  271   1HG2  VAL  29          1HG2      VAL  29  10.967   1.771  -2.799
  272   2HG2  VAL  29          2HG2      VAL  29  10.937   1.478  -1.043
  273   3HG2  VAL  29          3HG2      VAL  29   9.439   1.919  -1.898
  274    H    GLN  30           H        GLN  30  12.687   5.080   0.888
  275    HA   GLN  30           HA       GLN  30  12.888   7.657  -0.561
  276   1HB   GLN  30          1HB       GLN  30  12.108   8.653   1.354
  277   2HB   GLN  30          2HB       GLN  30  11.418   7.032   1.605
  278   1HG   GLN  30          1HG       GLN  30  12.499   7.485   3.650
  279   2HG   GLN  30          2HG       GLN  30  13.679   6.488   2.771
  280   1HE2  GLN  30          1HE2      GLN  30  14.936   7.755   4.622
  281   2HE2  GLN  30          2HE2      GLN  30  15.721   9.224   4.082
  282    H    ARG  31           H        ARG  31  14.645   5.467   1.642
  283    HA   ARG  31           HA       ARG  31  16.768   5.808   2.605
  284   1HB   ARG  31          1HB       ARG  31  17.144   4.349   0.740
  285   2HB   ARG  31          2HB       ARG  31  17.074   5.701  -0.415
  286   1HG   ARG  31          1HG       ARG  31  19.241   6.265  -0.047
  287   2HG   ARG  31          2HG       ARG  31  19.070   6.098   1.717
  288   1HD   ARG  31          1HD       ARG  31  19.276   3.664   1.538
  289   2HD   ARG  31          2HD       ARG  31  19.340   3.775  -0.235
  290    HE   ARG  31           HE       ARG  31  21.523   4.157   1.599
  291   1HH1  ARG  31          2HH2      ARG  31  20.138   5.299  -1.446
  292   2HH1  ARG  31          1HH2      ARG  31  21.674   5.809  -2.112
  293   1HH2  ARG  31          2HH1      ARG  31  23.552   4.829   0.720
  294   2HH2  ARG  31          1HH1      ARG  31  23.620   5.541  -0.877
  295    H    GLY  32           H        GLY  32  17.768   7.507  -0.304
  296   1HA   GLY  32          1HA       GLY  32  18.651   9.763   1.348
  297   2HA   GLY  32          2HA       GLY  32  19.012   9.481  -0.370
  Start of MODEL   24
    1    HA   PRO   1           HA       PRO   1  -7.843  10.371   2.399
    2   1HB   PRO   1          1HB       PRO   1 -10.454  10.170   3.149
    3   2HB   PRO   1          2HB       PRO   1  -9.169  10.633   4.312
    4   1HG   PRO   1          1HG       PRO   1 -10.995  12.487   2.755
    5   2HG   PRO   1          2HG       PRO   1 -10.700  12.483   4.525
    6   1HD   PRO   1          1HD       PRO   1  -9.336  14.156   2.860
    7   2HD   PRO   1          2HD       PRO   1  -8.501  13.357   4.227
    8    HA   PRO   2           HA       PRO   2  -9.746   9.649  -1.506
    9   1HB   PRO   2          1HB       PRO   2 -11.031   7.261  -1.239
   10   2HB   PRO   2          2HB       PRO   2  -9.250   7.398  -1.083
   11   1HG   PRO   2          1HG       PRO   2 -11.296   7.398   1.155
   12   2HG   PRO   2          2HG       PRO   2  -9.838   6.363   1.013
   13   1HD   PRO   2          1HD       PRO   2  -9.809   8.667   2.469
   14   2HD   PRO   2          2HD       PRO   2  -8.400   8.212   1.464
   15    H    LEU   3           H        LEU   3 -12.190   8.396  -2.154
   16    HA   LEU   3           HA       LEU   3 -14.078  10.490  -1.248
   17   1HB   LEU   3          1HB       LEU   3 -13.512   9.155  -3.741
   18   2HB   LEU   3          2HB       LEU   3 -15.202   8.840  -3.277
   19    HG   LEU   3           HG       LEU   3 -15.020  10.928  -4.593
   20   1HD1  LEU   3          1HD1      LEU   3 -16.363  10.555  -2.198
   21   2HD1  LEU   3          2HD1      LEU   3 -15.519  12.099  -1.929
   22   3HD1  LEU   3          3HD1      LEU   3 -16.618  11.916  -3.317
   23   1HD2  LEU   3          1HD2      LEU   3 -12.878  11.790  -4.220
   24   2HD2  LEU   3          2HD2      LEU   3 -13.874  12.869  -3.215
   25   3HD2  LEU   3          3HD2      LEU   3 -12.970  11.533  -2.462
   26    H    SER   4           H        SER   4 -13.162   7.801   0.106
   27    HA   SER   4           HA       SER   4 -14.162   6.269   1.480
   28   1HB   SER   4          1HB       SER   4 -16.851   7.554   1.062
   29   2HB   SER   4          2HB       SER   4 -16.130   6.890   2.548
   30    HG   SER   4           HG       SER   4 -15.015   8.691   2.836
   31    H    GLN   5           H        GLN   5 -14.471   4.220   0.858
   32    HA   GLN   5           HA       GLN   5 -15.491   2.402  -0.129
   33   1HB   GLN   5          1HB       GLN   5 -17.707   2.809  -0.203
   34   2HB   GLN   5          2HB       GLN   5 -17.453   4.539  -0.536
   35   1HG   GLN   5          1HG       GLN   5 -17.182   4.132  -2.890
   36   2HG   GLN   5          2HG       GLN   5 -17.095   2.375  -2.640
   37   1HE2  GLN   5          1HE2      GLN   5 -19.102   4.931  -3.529
   38   2HE2  GLN   5          2HE2      GLN   5 -20.656   4.163  -3.284
   39    H    GLU   6           H        GLU   6 -15.283   5.279  -2.291
   40    HA   GLU   6           HA       GLU   6 -14.946   4.151  -4.741
   41   1HB   GLU   6          1HB       GLU   6 -13.590   6.463  -3.368
   42   2HB   GLU   6          2HB       GLU   6 -13.077   5.994  -5.006
   43   1HG   GLU   6          1HG       GLU   6 -15.922   6.656  -4.143
   44   2HG   GLU   6          2HG       GLU   6 -14.851   7.709  -5.093
   45    H    THR   7           H        THR   7 -12.406   4.385  -2.202
   46    HA   THR   7           HA       THR   7 -10.659   2.664  -3.855
   47    HB   THR   7           HB       THR   7  -9.619   3.413  -1.241
   48    HG1  THR   7           1HG      THR   7 -10.585   5.457  -2.962
   49   1HG2  THR   7          1HG2      THR   7  -8.404   2.744  -3.386
   50   2HG2  THR   7          2HG2      THR   7  -8.814   4.356  -4.019
   51   3HG2  THR   7          3HG2      THR   7  -7.782   4.202  -2.577
   52    H    PHE   8           H        PHE   8 -10.491   2.618  -0.357
   53    HA   PHE   8           HA       PHE   8 -10.156   0.454   0.695
   54   1HB   PHE   8          1HB       PHE   8 -13.149   0.787   0.703
   55   2HB   PHE   8          2HB       PHE   8 -12.071   0.323   2.030
   56    HD1  PHE   8           1HD      PHE   8 -12.182   3.237  -0.350
   57    HD2  PHE   8           2HD      PHE   8 -12.104   1.889   3.728
   58    HE1  PHE   8           1HE      PHE   8 -12.123   5.592   0.428
   59    HE2  PHE   8           2HE      PHE   8 -12.046   4.243   4.505
   60    HZ   PHE   8           HZ       PHE   8 -12.055   6.095   2.855
   61    H    SER   9           H        SER   9 -13.188   0.270  -1.263
   62    HA   SER   9           HA       SER   9 -13.602  -2.372  -1.475
   63   1HB   SER   9          1HB       SER   9 -14.757  -0.505  -2.749
   64   2HB   SER   9          2HB       SER   9 -13.447  -0.616  -3.950
   65    HG   SER   9           HG       SER   9 -14.089  -2.614  -4.488
   66    H    ASP  10           H        ASP  10 -11.309  -0.687  -3.705
   67    HA   ASP  10           HA       ASP  10  -9.979  -3.312  -4.127
   68   1HB   ASP  10          1HB       ASP  10 -10.032  -0.729  -5.724
   69   2HB   ASP  10          2HB       ASP  10  -8.955  -2.092  -6.098
   70    H    LEU  11           H        LEU  11  -9.667  -0.197  -2.637
   71    HA   LEU  11           HA       LEU  11  -6.816   0.030  -2.690
   72   1HB   LEU  11          1HB       LEU  11  -8.782   1.710  -2.025
   73   2HB   LEU  11          2HB       LEU  11  -8.433   1.085  -0.395
   74    HG   LEU  11           HG       LEU  11  -6.659   2.644  -2.269
   75   1HD1  LEU  11          1HD1      LEU  11  -6.939   4.158  -0.625
   76   2HD1  LEU  11          2HD1      LEU  11  -7.942   2.998   0.279
   77   3HD1  LEU  11          3HD1      LEU  11  -6.181   3.037   0.532
   78   1HD2  LEU  11          1HD2      LEU  11  -5.827   0.493  -0.309
   79   2HD2  LEU  11          2HD2      LEU  11  -5.214   0.811  -1.949
   80   3HD2  LEU  11          3HD2      LEU  11  -4.777   1.898  -0.609
   81    H    TRP  12           H        TRP  12  -8.913  -0.725   0.152
   82    HA   TRP  12           HA       TRP  12  -6.904  -1.729   1.790
   83   1HB   TRP  12          1HB       TRP  12  -8.646  -1.978   3.150
   84   2HB   TRP  12          2HB       TRP  12  -9.703  -1.529   1.805
   85    HD1  TRP  12           HD       TRP  12 -11.545  -3.176   1.374
   86    HE1  TRP  12           1HE      TRP  12 -11.976  -5.661   1.732
   87    HE3  TRP  12           3HE      TRP  12  -7.007  -4.507   3.331
   88    HZ2  TRP  12           2HZ      TRP  12 -10.533  -7.956   2.746
   89    HZ3  TRP  12           3HZ      TRP  12  -6.573  -6.848   3.980
   90    HH2  TRP  12           HH       TRP  12  -8.321  -8.580   3.695
   91    H    LYS  13           H        LYS  13  -8.721  -3.350  -0.814
   92    HA   LYS  13           HA       LYS  13  -7.676  -5.973  -0.229
   93   1HB   LYS  13          1HB       LYS  13  -9.675  -4.883  -1.848
   94   2HB   LYS  13          2HB       LYS  13  -8.472  -5.499  -3.006
   95   1HG   LYS  13          1HG       LYS  13  -8.538  -7.540  -1.168
   96   2HG   LYS  13          2HG       LYS  13 -10.225  -6.974  -1.118
   97   1HD   LYS  13          1HD       LYS  13 -10.240  -7.082  -3.652
   98   2HD   LYS  13          2HD       LYS  13  -8.648  -7.872  -3.563
   99   1HE   LYS  13          1HE       LYS  13  -9.784  -9.527  -1.922
  100   2HE   LYS  13          2HE       LYS  13 -11.318  -8.870  -2.532
  101   1HZ   LYS  13          1HZ       LYS  13 -10.912  -9.690  -4.599
  102   2HZ   LYS  13          2HZ       LYS  13  -9.280  -9.804  -4.388
  103   3HZ   LYS  13          3HZ       LYS  13 -10.284 -10.886  -3.653
  104    H    LEU  14           H        LEU  14  -6.616  -3.177  -2.109
  105    HA   LEU  14           HA       LEU  14  -4.711  -4.512  -3.751
  106   1HB   LEU  14          1HB       LEU  14  -5.504  -1.790  -3.079
  107   2HB   LEU  14          2HB       LEU  14  -3.735  -1.931  -3.213
  108    HG   LEU  14           HG       LEU  14  -5.068  -1.446  -5.386
  109   1HD1  LEU  14          1HD1      LEU  14  -3.594  -3.839  -6.098
  110   2HD1  LEU  14          2HD1      LEU  14  -3.146  -2.134  -6.342
  111   3HD1  LEU  14          3HD1      LEU  14  -2.728  -2.954  -4.819
  112   1HD2  LEU  14          1HD2      LEU  14  -5.538  -4.051  -6.225
  113   2HD2  LEU  14          2HD2      LEU  14  -6.130  -4.066  -4.547
  114   3HD2  LEU  14          3HD2      LEU  14  -6.787  -2.891  -5.712
  115    H    LEU  15           H        LEU  15  -4.394  -2.820  -0.584
  116    HA   LEU  15           HA       LEU  15  -1.642  -3.207  -0.224
  117   1HB   LEU  15          1HB       LEU  15  -4.014  -2.848   1.589
  118   2HB   LEU  15          2HB       LEU  15  -2.442  -3.283   2.304
  119    HG   LEU  15           HG       LEU  15  -3.052  -0.885   0.526
  120   1HD1  LEU  15          1HD1      LEU  15  -1.703  -0.552   3.134
  121   2HD1  LEU  15          2HD1      LEU  15  -3.076   0.342   2.439
  122   3HD1  LEU  15          3HD1      LEU  15  -3.350  -1.215   3.257
  123   1HD2  LEU  15          1HD2      LEU  15  -0.895  -1.161  -0.148
  124   2HD2  LEU  15          2HD2      LEU  15  -0.484  -0.570   1.480
  125   3HD2  LEU  15          3HD2      LEU  15  -0.539  -2.319   1.156
  126    H    LYS  16           H        LYS  16  -4.248  -5.505  -0.223
  127    HA   LYS  16           HA       LYS  16  -3.009  -7.483   1.458
  128   1HB   LYS  16          1HB       LYS  16  -5.496  -7.156   0.515
  129   2HB   LYS  16          2HB       LYS  16  -4.884  -8.252  -0.746
  130   1HG   LYS  16          1HG       LYS  16  -4.462  -9.984   0.783
  131   2HG   LYS  16          2HG       LYS  16  -4.398  -8.874   2.172
  132   1HD   LYS  16          1HD       LYS  16  -6.801  -8.500   2.053
  133   2HD   LYS  16          2HD       LYS  16  -6.912  -9.449   0.551
  134   1HE   LYS  16          1HE       LYS  16  -5.680 -11.258   2.161
  135   2HE   LYS  16          2HE       LYS  16  -6.618 -10.361   3.374
  136   1HZ   LYS  16          1HZ       LYS  16  -7.778 -11.456   0.915
  137   2HZ   LYS  16          2HZ       LYS  16  -7.765 -12.261   2.354
  138   3HZ   LYS  16          3HZ       LYS  16  -8.579 -10.834   2.216
  139    H    LYS  17           H        LYS  17  -1.586  -6.158  -1.020
  140    HA   LYS  17           HA       LYS  17  -0.033  -8.495  -1.670
  141   1HB   LYS  17          1HB       LYS  17  -1.305  -9.239  -3.381
  142   2HB   LYS  17          2HB       LYS  17  -2.297  -7.762  -3.395
  143   1HG   LYS  17          1HG       LYS  17   0.500  -8.014  -4.581
  144   2HG   LYS  17          2HG       LYS  17  -1.016  -8.043  -5.512
  145   1HD   LYS  17          1HD       LYS  17  -1.154  -5.758  -3.826
  146   2HD   LYS  17          2HD       LYS  17   0.477  -5.760  -4.536
  147   1HE   LYS  17          1HE       LYS  17  -1.617  -6.487  -6.468
  148   2HE   LYS  17          2HE       LYS  17  -1.845  -4.864  -5.783
  149   1HZ   LYS  17          1HZ       LYS  17   0.482  -4.442  -6.354
  150   2HZ   LYS  17          2HZ       LYS  17   0.543  -5.892  -7.139
  151   3HZ   LYS  17          3HZ       LYS  17  -0.478  -4.709  -7.668
  152    H    TRP  18           H        TRP  18  -0.856  -5.125  -1.835
  153    HA   TRP  18           HA       TRP  18   1.620  -4.464  -3.302
  154   1HB   TRP  18          1HB       TRP  18  -0.896  -3.372  -3.273
  155   2HB   TRP  18          2HB       TRP  18  -0.038  -2.311  -2.147
  156    HD1  TRP  18           HD       TRP  18  -0.813  -2.628  -5.669
  157    HE1  TRP  18           1HE      TRP  18   0.682  -1.186  -7.142
  158    HE3  TRP  18           3HE      TRP  18   2.849  -1.526  -2.267
  159    HZ2  TRP  18           2HZ      TRP  18   3.168   0.273  -6.886
  160    HZ3  TRP  18           3HZ      TRP  18   4.762  -0.109  -2.918
  161    HH2  TRP  18           HH       TRP  18   4.937   0.796  -5.217
  162    H    LYS  19           H        LYS  19   0.068  -4.029  -0.096
  163    HA   LYS  19           HA       LYS  19   1.867  -2.393   1.180
  164   1HB   LYS  19          1HB       LYS  19   0.928  -3.167   3.128
  165   2HB   LYS  19          2HB       LYS  19  -0.246  -3.851   1.978
  166   1HG   LYS  19          1HG       LYS  19   0.946  -5.988   1.974
  167   2HG   LYS  19          2HG       LYS  19   2.217  -5.314   3.022
  168   1HD   LYS  19          1HD       LYS  19   0.889  -5.376   4.903
  169   2HD   LYS  19          2HD       LYS  19  -0.607  -5.076   3.986
  170   1HE   LYS  19          1HE       LYS  19   0.129  -7.511   2.983
  171   2HE   LYS  19          2HE       LYS  19   0.747  -7.638   4.644
  172   1HZ   LYS  19          1HZ       LYS  19  -1.474  -6.922   5.366
  173   2HZ   LYS  19          2HZ       LYS  19  -2.002  -7.062   3.809
  174   3HZ   LYS  19          3HZ       LYS  19  -1.453  -8.391   4.617
  175    H    MET  20           H        MET  20   2.179  -5.961   0.763
  176    HA   MET  20           HA       MET  20   4.406  -6.625   2.080
  177   1HB   MET  20          1HB       MET  20   5.115  -7.911  -0.052
  178   2HB   MET  20          2HB       MET  20   3.498  -8.241   0.615
  179   1HG   MET  20          1HG       MET  20   2.763  -7.813  -1.476
  180   2HG   MET  20          2HG       MET  20   2.980  -6.113  -1.028
  181   1HE   MET  20          1HE       MET  20   4.525  -5.169  -4.240
  182   2HE   MET  20          2HE       MET  20   2.918  -5.719  -3.708
  183   3HE   MET  20          3HE       MET  20   3.859  -4.602  -2.690
  184    H    ARG  21           H        ARG  21   4.357  -4.527  -0.813
  185    HA   ARG  21           HA       ARG  21   7.275  -4.095  -0.505
  186   1HB   ARG  21          1HB       ARG  21   5.932  -4.636  -2.742
  187   2HB   ARG  21          2HB       ARG  21   5.640  -2.881  -2.710
  188   1HG   ARG  21          1HG       ARG  21   7.699  -2.601  -3.590
  189   2HG   ARG  21          2HG       ARG  21   8.370  -3.197  -2.053
  190   1HD   ARG  21          1HD       ARG  21   9.263  -4.850  -3.332
  191   2HD   ARG  21          2HD       ARG  21   7.630  -5.546  -3.267
  192    HE   ARG  21           HE       ARG  21   7.590  -3.764  -5.409
  193   1HH1  ARG  21          2HH2      ARG  21   9.432  -6.622  -4.439
  194   2HH1  ARG  21          1HH2      ARG  21   9.738  -7.150  -6.079
  195   1HH2  ARG  21          2HH1      ARG  21   7.994  -4.461  -7.574
  196   2HH2  ARG  21          1HH1      ARG  21   8.918  -5.917  -7.866
  197    H    ARG  22           H        ARG  22   4.135  -2.361  -0.692
  198    HA   ARG  22           HA       ARG  22   5.358   0.207  -0.123
  199   1HB   ARG  22          1HB       ARG  22   3.263  -0.091  -1.456
  200   2HB   ARG  22          2HB       ARG  22   2.444  -0.659   0.019
  201   1HG   ARG  22          1HG       ARG  22   3.713   1.718   0.802
  202   2HG   ARG  22          2HG       ARG  22   3.077   2.072  -0.823
  203   1HD   ARG  22          1HD       ARG  22   1.263   2.587   0.586
  204   2HD   ARG  22          2HD       ARG  22   0.891   0.942   0.027
  205    HE   ARG  22           HE       ARG  22   2.328   0.559   2.357
  206   1HH1  ARG  22          2HH2      ARG  22  -0.573   2.354   1.430
  207   2HH1  ARG  22          1HH2      ARG  22  -1.336   2.199   2.997
  208   1HH2  ARG  22          2HH1      ARG  22   1.321   0.354   4.427
  209   2HH2  ARG  22          1HH1      ARG  22  -0.256   1.058   4.706
  210    H    ASN  23           H        ASN  23   5.741  -2.155   1.764
  211    HA   ASN  23           HA       ASN  23   5.149  -0.627   4.210
  212   1HB   ASN  23          1HB       ASN  23   3.437  -2.667   3.394
  213   2HB   ASN  23          2HB       ASN  23   4.528  -3.472   4.542
  214   1HD2  ASN  23          1HD2      ASN  23   1.790  -1.441   4.180
  215   2HD2  ASN  23          2HD2      ASN  23   1.620  -0.950   5.852
  216    H    GLN  24           H        GLN  24   7.440  -1.710   2.399
  217    HA   GLN  24           HA       GLN  24   9.070  -2.654   4.679
  218   1HB   GLN  24          1HB       GLN  24   8.649  -4.102   2.049
  219   2HB   GLN  24          2HB       GLN  24  10.100  -4.354   3.048
  220   1HG   GLN  24          1HG       GLN  24   8.038  -4.513   4.900
  221   2HG   GLN  24          2HG       GLN  24   7.335  -5.287   3.463
  222   1HE2  GLN  24          1HE2      GLN  24   7.571  -7.015   5.407
  223   2HE2  GLN  24          2HE2      GLN  24   8.983  -8.039   5.257
  224    H    PHE  25           H        PHE  25  10.289  -3.061   1.465
  225    HA   PHE  25           HA       PHE  25  12.393  -1.192   1.863
  226   1HB   PHE  25          1HB       PHE  25  13.098  -2.602   0.265
  227   2HB   PHE  25          2HB       PHE  25  11.444  -3.039  -0.199
  228    HD1  PHE  25           1HD      PHE  25  10.204  -0.763  -1.293
  229    HD2  PHE  25           2HD      PHE  25  14.350  -1.865  -1.528
  230    HE1  PHE  25           1HE      PHE  25  10.437   0.558  -3.379
  231    HE2  PHE  25           2HE      PHE  25  14.583  -0.543  -3.614
  232    HZ   PHE  25           HZ       PHE  25  12.626   0.668  -4.539
  233    H    TRP  26           H        TRP  26   9.136  -0.620   1.337
  234    HA   TRP  26           HA       TRP  26   9.451   1.670  -0.452
  235   1HB   TRP  26          1HB       TRP  26   7.288   0.082   0.729
  236   2HB   TRP  26          2HB       TRP  26   6.948   1.818   0.734
  237    HD1  TRP  26           HD       TRP  26   7.308  -1.166  -1.560
  238    HE1  TRP  26           1HE      TRP  26   6.534  -0.579  -3.914
  239    HE3  TRP  26           3HE      TRP  26   6.760   3.891  -0.992
  240    HZ2  TRP  26           2HZ      TRP  26   5.768   1.793  -5.384
  241    HZ3  TRP  26           3HZ      TRP  26   6.007   5.279  -2.889
  242    HH2  TRP  26           HH       TRP  26   5.509   4.248  -5.086
  243    H    VAL  27           H        VAL  27   7.866   1.459   2.772
  244    HA   VAL  27           HA       VAL  27   7.745   3.916   3.666
  245    HB   VAL  27           HB       VAL  27   8.350   3.198   5.893
  246   1HG1  VAL  27          1HG1      VAL  27   7.461   0.643   4.537
  247   2HG1  VAL  27          2HG1      VAL  27   6.918   1.338   6.083
  248   3HG1  VAL  27          3HG1      VAL  27   6.406   2.076   4.546
  249   1HG2  VAL  27          1HG2      VAL  27  10.135   1.357   4.351
  250   2HG2  VAL  27          2HG2      VAL  27  10.424   2.198   5.892
  251   3HG2  VAL  27          3HG2      VAL  27   9.431   0.721   5.857
  252    H    LYS  28           H        LYS  28  10.869   2.276   3.103
  253    HA   LYS  28           HA       LYS  28  12.480   4.429   4.103
  254   1HB   LYS  28          1HB       LYS  28  12.979   2.055   2.285
  255   2HB   LYS  28          2HB       LYS  28  14.256   3.231   2.678
  256   1HG   LYS  28          1HG       LYS  28  13.591   2.829   5.153
  257   2HG   LYS  28          2HG       LYS  28  12.739   1.387   4.549
  258   1HD   LYS  28          1HD       LYS  28  14.688   0.260   4.464
  259   2HD   LYS  28          2HD       LYS  28  15.350   1.474   3.343
  260   1HE   LYS  28          1HE       LYS  28  15.538   2.871   5.644
  261   2HE   LYS  28          2HE       LYS  28  15.663   1.227   6.308
  262   1HZ   LYS  28          1HZ       LYS  28  17.557   2.712   4.855
  263   2HZ   LYS  28          2HZ       LYS  28  17.750   1.317   5.713
  264   3HZ   LYS  28          3HZ       LYS  28  17.279   1.255   4.133
  265    H    VAL  29           H        VAL  29  11.253   3.508   0.864
  266    HA   VAL  29           HA       VAL  29  12.637   5.279  -0.744
  267    HB   VAL  29           HB       VAL  29  10.651   5.232  -2.210
  268   1HG1  VAL  29          1HG1      VAL  29  11.857   3.260  -2.481
  269   2HG1  VAL  29          2HG1      VAL  29  11.617   2.758  -0.790
  270   3HG1  VAL  29          3HG1      VAL  29  10.284   2.610  -1.959
  271   1HG2  VAL  29          1HG2      VAL  29   9.289   5.032   0.285
  272   2HG2  VAL  29          2HG2      VAL  29   8.575   5.081  -1.345
  273   3HG2  VAL  29          3HG2      VAL  29   8.974   3.516  -0.595
  274    H    GLN  30           H        GLN  30  10.559   6.025   1.888
  275    HA   GLN  30           HA       GLN  30   9.940   8.723   0.873
  276   1HB   GLN  30          1HB       GLN  30   8.243   8.696   2.375
  277   2HB   GLN  30          2HB       GLN  30   8.557   6.946   2.457
  278   1HG   GLN  30          1HG       GLN  30  10.156   7.340   4.320
  279   2HG   GLN  30          2HG       GLN  30   9.788   9.078   4.253
  280   1HE2  GLN  30          1HE2      GLN  30   8.362   5.839   4.814
  281   2HE2  GLN  30          2HE2      GLN  30   7.055   6.391   5.839
  282    H    ARG  31           H        ARG  31  11.760   7.097   3.509
  283    HA   ARG  31           HA       ARG  31  13.146   8.081   5.115
  284   1HB   ARG  31          1HB       ARG  31  14.658   7.366   3.382
  285   2HB   ARG  31          2HB       ARG  31  14.305   8.809   2.401
  286   1HG   ARG  31          1HG       ARG  31  15.435  10.251   3.909
  287   2HG   ARG  31          2HG       ARG  31  15.422   9.038   5.212
  288   1HD   ARG  31          1HD       ARG  31  16.757   7.663   3.272
  289   2HD   ARG  31          2HD       ARG  31  17.255   9.324   2.882
  290    HE   ARG  31           HE       ARG  31  18.165   7.741   5.086
  291   1HH1  ARG  31          2HH2      ARG  31  17.188  11.024   4.210
  292   2HH1  ARG  31          1HH2      ARG  31  18.190  11.793   5.421
  293   1HH2  ARG  31          2HH1      ARG  31  19.489   8.756   6.686
  294   2HH2  ARG  31          1HH1      ARG  31  19.502  10.499   6.832
  295    H    GLY  32           H        GLY  32  11.711   9.633   6.077
  296   1HA   GLY  32          1HA       GLY  32  12.274  12.426   5.182
  297   2HA   GLY  32          2HA       GLY  32  10.692  11.901   5.802
  Start of MODEL   25
    1    HA   PRO   1           HA       PRO   1 -15.674  11.547  -4.172
    2   1HB   PRO   1          1HB       PRO   1 -13.731   9.693  -3.711
    3   2HB   PRO   1          2HB       PRO   1 -13.915  10.493  -5.306
    4   1HG   PRO   1          1HG       PRO   1 -12.036  11.280  -3.060
    5   2HG   PRO   1          2HG       PRO   1 -11.615  10.991  -4.780
    6   1HD   PRO   1          1HD       PRO   1 -12.092  13.503  -3.836
    7   2HD   PRO   1          2HD       PRO   1 -12.689  13.012  -5.450
    8    HA   PRO   2           HA       PRO   2 -16.229  11.077   0.170
    9   1HB   PRO   2          1HB       PRO   2 -17.186   8.536   0.396
   10   2HB   PRO   2          2HB       PRO   2 -18.093   9.814  -0.476
   11   1HG   PRO   2          1HG       PRO   2 -16.235   7.738  -1.672
   12   2HG   PRO   2          2HG       PRO   2 -17.919   8.108  -2.169
   13   1HD   PRO   2          1HD       PRO   2 -15.782   9.215  -3.449
   14   2HD   PRO   2          2HD       PRO   2 -17.249  10.188  -3.125
   15    H    LEU   3           H        LEU   3 -15.905   8.775   1.751
   16    HA   LEU   3           HA       LEU   3 -13.224   7.703   1.305
   17   1HB   LEU   3          1HB       LEU   3 -12.803   8.629   3.824
   18   2HB   LEU   3          2HB       LEU   3 -12.265   9.486   2.359
   19    HG   LEU   3           HG       LEU   3 -13.637  10.817   4.133
   20   1HD1  LEU   3          1HD1      LEU   3 -15.055  11.125   1.557
   21   2HD1  LEU   3          2HD1      LEU   3 -14.039  12.286   2.445
   22   3HD1  LEU   3          3HD1      LEU   3 -13.283  11.060   1.400
   23   1HD2  LEU   3          1HD2      LEU   3 -15.466   8.699   3.455
   24   2HD2  LEU   3          2HD2      LEU   3 -15.694  10.033   4.612
   25   3HD2  LEU   3          3HD2      LEU   3 -16.160  10.244   2.907
   26    H    SER   4           H        SER   4 -15.229   6.083   1.244
   27    HA   SER   4           HA       SER   4 -14.952   4.434   3.555
   28   1HB   SER   4          1HB       SER   4 -16.672   6.464   4.095
   29   2HB   SER   4          2HB       SER   4 -17.796   5.294   3.361
   30    HG   SER   4           HG       SER   4 -16.579   5.238   5.779
   31    H    GLN   5           H        GLN   5 -15.005   4.612   0.502
   32    HA   GLN   5           HA       GLN   5 -15.910   2.007  -0.026
   33   1HB   GLN   5          1HB       GLN   5 -18.077   3.779   0.270
   34   2HB   GLN   5          2HB       GLN   5 -17.876   3.580  -1.487
   35   1HG   GLN   5          1HG       GLN   5 -17.560   1.009  -0.730
   36   2HG   GLN   5          2HG       GLN   5 -18.597   1.563   0.603
   37   1HE2  GLN   5          1HE2      GLN   5 -19.656  -0.345  -0.993
   38   2HE2  GLN   5          2HE2      GLN   5 -20.867   0.325  -2.065
   39    H    GLU   6           H        GLU   6 -15.692   5.345  -1.327
   40    HA   GLU   6           HA       GLU   6 -15.287   4.897  -3.999
   41   1HB   GLU   6          1HB       GLU   6 -15.182   7.082  -2.624
   42   2HB   GLU   6          2HB       GLU   6 -13.452   6.717  -2.420
   43   1HG   GLU   6          1HG       GLU   6 -14.580   6.512  -5.185
   44   2HG   GLU   6          2HG       GLU   6 -14.394   8.143  -4.505
   45    H    THR   7           H        THR   7 -12.655   4.864  -1.520
   46    HA   THR   7           HA       THR   7 -10.917   3.483  -3.459
   47    HB   THR   7           HB       THR   7  -9.801   3.831  -0.803
   48    HG1  THR   7           1HG      THR   7  -9.978   6.089  -0.766
   49   1HG2  THR   7          1HG2      THR   7  -8.351   3.681  -2.677
   50   2HG2  THR   7          2HG2      THR   7  -9.294   4.869  -3.608
   51   3HG2  THR   7          3HG2      THR   7  -8.308   5.402  -2.225
   52    H    PHE   8           H        PHE   8 -10.723   2.893   0.006
   53    HA   PHE   8           HA       PHE   8 -10.210   0.591   0.658
   54   1HB   PHE   8          1HB       PHE   8 -13.212   0.786   0.816
   55   2HB   PHE   8          2HB       PHE   8 -12.067   0.151   2.010
   56    HD1  PHE   8           1HD      PHE   8 -12.416   3.416   0.168
   57    HD2  PHE   8           2HD      PHE   8 -12.051   1.406   3.947
   58    HE1  PHE   8           1HE      PHE   8 -12.413   5.606   1.332
   59    HE2  PHE   8           2HE      PHE   8 -12.048   3.596   5.111
   60    HZ   PHE   8           HZ       PHE   8 -12.229   5.696   3.804
   61    H    SER   9           H        SER   9 -13.287   0.616  -1.240
   62    HA   SER   9           HA       SER   9 -13.622  -1.974  -1.865
   63   1HB   SER   9          1HB       SER   9 -14.877   0.025  -2.791
   64   2HB   SER   9          2HB       SER   9 -13.595   0.171  -4.017
   65    HG   SER   9           HG       SER   9 -14.114  -2.238  -4.262
   66    H    ASP  10           H        ASP  10 -11.438   0.137  -3.824
   67    HA   ASP  10           HA       ASP  10 -10.051  -2.331  -4.726
   68   1HB   ASP  10          1HB       ASP  10 -11.064  -0.555  -6.330
   69   2HB   ASP  10          2HB       ASP  10  -9.679   0.450  -5.852
   70    H    LEU  11           H        LEU  11  -9.777   0.477  -2.704
   71    HA   LEU  11           HA       LEU  11  -6.926   0.752  -2.748
   72   1HB   LEU  11          1HB       LEU  11  -8.875   2.297  -1.818
   73   2HB   LEU  11          2HB       LEU  11  -8.570   1.394  -0.315
   74    HG   LEU  11           HG       LEU  11  -6.594   3.052  -1.928
   75   1HD1  LEU  11          1HD1      LEU  11  -8.079   3.299   0.644
   76   2HD1  LEU  11          2HD1      LEU  11  -6.366   3.781   0.689
   77   3HD1  LEU  11          3HD1      LEU  11  -7.481   4.565  -0.456
   78   1HD2  LEU  11          1HD2      LEU  11  -5.003   2.301  -0.031
   79   2HD2  LEU  11          2HD2      LEU  11  -6.164   0.981   0.249
   80   3HD2  LEU  11          3HD2      LEU  11  -5.341   1.124  -1.323
   81    H    TRP  12           H        TRP  12  -8.970  -0.460  -0.032
   82    HA   TRP  12           HA       TRP  12  -6.927  -1.715   1.377
   83   1HB   TRP  12          1HB       TRP  12  -8.639  -2.163   2.724
   84   2HB   TRP  12          2HB       TRP  12  -9.728  -1.517   1.488
   85    HD1  TRP  12           HD       TRP  12 -11.589  -3.081   0.874
   86    HE1  TRP  12           1HE      TRP  12 -12.013  -5.593   0.856
   87    HE3  TRP  12           3HE      TRP  12  -6.992  -4.688   2.453
   88    HZ2  TRP  12           2HZ      TRP  12 -10.543  -8.014   1.452
   89    HZ3  TRP  12           3HZ      TRP  12  -6.543  -7.100   2.716
   90    HH2  TRP  12           HH       TRP  12  -8.303  -8.772   2.221
   91    H    LYS  13           H        LYS  13  -8.843  -2.914  -1.386
   92    HA   LYS  13           HA       LYS  13  -7.810  -5.595  -1.258
   93   1HB   LYS  13          1HB       LYS  13  -9.866  -4.352  -2.570
   94   2HB   LYS  13          2HB       LYS  13  -8.678  -4.528  -3.884
   95   1HG   LYS  13          1HG       LYS  13  -9.275  -6.848  -2.036
   96   2HG   LYS  13          2HG       LYS  13 -10.344  -6.496  -3.414
   97   1HD   LYS  13          1HD       LYS  13  -8.775  -7.125  -4.963
   98   2HD   LYS  13          2HD       LYS  13  -7.420  -6.494  -3.997
   99   1HE   LYS  13          1HE       LYS  13  -7.539  -8.413  -2.495
  100   2HE   LYS  13          2HE       LYS  13  -8.989  -9.015  -3.326
  101   1HZ   LYS  13          1HZ       LYS  13  -6.383  -8.661  -4.623
  102   2HZ   LYS  13          2HZ       LYS  13  -6.915 -10.089  -3.994
  103   3HZ   LYS  13          3HZ       LYS  13  -7.720  -9.392  -5.253
  104    H    LEU  14           H        LEU  14  -6.768  -2.555  -2.749
  105    HA   LEU  14           HA       LEU  14  -4.803  -3.766  -4.479
  106   1HB   LEU  14          1HB       LEU  14  -5.541  -1.004  -3.570
  107   2HB   LEU  14          2HB       LEU  14  -3.929  -1.253  -4.281
  108    HG   LEU  14           HG       LEU  14  -6.374  -0.938  -5.666
  109   1HD1  LEU  14          1HD1      LEU  14  -3.512  -1.383  -6.196
  110   2HD1  LEU  14          2HD1      LEU  14  -4.564  -2.006  -7.489
  111   3HD1  LEU  14          3HD1      LEU  14  -4.663  -0.295  -7.009
  112   1HD2  LEU  14          1HD2      LEU  14  -5.315  -3.691  -6.293
  113   2HD2  LEU  14          2HD2      LEU  14  -6.508  -3.493  -4.987
  114   3HD2  LEU  14          3HD2      LEU  14  -6.912  -2.988  -6.646
  115    H    LEU  15           H        LEU  15  -4.803  -2.356  -1.192
  116    HA   LEU  15           HA       LEU  15  -1.963  -2.474  -0.843
  117   1HB   LEU  15          1HB       LEU  15  -4.369  -1.906   0.766
  118   2HB   LEU  15          2HB       LEU  15  -3.045  -2.657   1.689
  119    HG   LEU  15           HG       LEU  15  -1.508  -0.929   1.077
  120   1HD1  LEU  15          1HD1      LEU  15  -1.662   0.349  -0.810
  121   2HD1  LEU  15          2HD1      LEU  15  -2.827  -0.895  -1.323
  122   3HD1  LEU  15          3HD1      LEU  15  -3.408   0.624  -0.600
  123   1HD2  LEU  15          1HD2      LEU  15  -4.244  -0.096   1.952
  124   2HD2  LEU  15          2HD2      LEU  15  -2.679   0.084   2.780
  125   3HD2  LEU  15          3HD2      LEU  15  -3.127   1.203   1.470
  126    H    LYS  16           H        LYS  16  -4.324  -4.904  -1.123
  127    HA   LYS  16           HA       LYS  16  -3.285  -6.794   0.777
  128   1HB   LYS  16          1HB       LYS  16  -5.513  -6.600  -0.861
  129   2HB   LYS  16          2HB       LYS  16  -4.568  -7.897  -1.631
  130   1HG   LYS  16          1HG       LYS  16  -4.925  -7.882   1.368
  131   2HG   LYS  16          2HG       LYS  16  -6.237  -8.484   0.326
  132   1HD   LYS  16          1HD       LYS  16  -3.937  -9.660  -0.748
  133   2HD   LYS  16          2HD       LYS  16  -3.671  -9.732   1.011
  134   1HE   LYS  16          1HE       LYS  16  -5.036 -11.525   1.040
  135   2HE   LYS  16          2HE       LYS  16  -6.372 -10.407   0.689
  136   1HZ   LYS  16          1HZ       LYS  16  -5.882 -12.399  -0.839
  137   2HZ   LYS  16          2HZ       LYS  16  -6.340 -10.952  -1.484
  138   3HZ   LYS  16          3HZ       LYS  16  -4.752 -11.398  -1.503
  139    H    LYS  17           H        LYS  17  -1.575  -5.361  -1.497
  140    HA   LYS  17           HA       LYS  17   0.268  -7.569  -1.777
  141   1HB   LYS  17          1HB       LYS  17  -0.710  -8.424  -3.641
  142   2HB   LYS  17          2HB       LYS  17  -1.656  -6.947  -3.943
  143   1HG   LYS  17          1HG       LYS  17   1.341  -7.177  -4.437
  144   2HG   LYS  17          2HG       LYS  17   0.105  -7.420  -5.695
  145   1HD   LYS  17          1HD       LYS  17  -0.628  -5.013  -4.448
  146   2HD   LYS  17          2HD       LYS  17   1.146  -4.929  -4.568
  147   1HE   LYS  17          1HE       LYS  17   0.860  -5.704  -7.002
  148   2HE   LYS  17          2HE       LYS  17  -0.870  -5.353  -6.798
  149   1HZ   LYS  17          1HZ       LYS  17   1.021  -3.592  -7.514
  150   2HZ   LYS  17          2HZ       LYS  17  -0.480  -3.213  -6.944
  151   3HZ   LYS  17          3HZ       LYS  17   0.808  -3.249  -5.914
  152    H    TRP  18           H        TRP  18  -0.833  -4.315  -2.725
  153    HA   TRP  18           HA       TRP  18   1.758  -3.433  -3.623
  154   1HB   TRP  18          1HB       TRP  18  -0.781  -2.516  -3.861
  155   2HB   TRP  18          2HB       TRP  18  -0.205  -1.479  -2.548
  156    HD1  TRP  18           HD       TRP  18  -0.418  -1.584  -6.164
  157    HE1  TRP  18           1HE      TRP  18   1.121   0.103  -7.291
  158    HE3  TRP  18           3HE      TRP  18   2.565  -0.421  -2.171
  159    HZ2  TRP  18           2HZ      TRP  18   3.377   1.762  -6.558
  160    HZ3  TRP  18           3HZ      TRP  18   4.396   1.214  -2.424
  161    HH2  TRP  18           HH       TRP  18   4.814   2.311  -4.605
  162    H    LYS  19           H        LYS  19  -0.100  -3.134  -0.562
  163    HA   LYS  19           HA       LYS  19   1.819  -1.528   0.790
  164   1HB   LYS  19          1HB       LYS  19   0.165  -1.550   2.306
  165   2HB   LYS  19          2HB       LYS  19  -0.690  -2.771   1.333
  166   1HG   LYS  19          1HG       LYS  19   0.484  -4.576   2.469
  167   2HG   LYS  19          2HG       LYS  19   1.509  -3.413   3.342
  168   1HD   LYS  19          1HD       LYS  19  -0.986  -2.487   3.989
  169   2HD   LYS  19          2HD       LYS  19  -1.302  -4.233   3.851
  170   1HE   LYS  19          1HE       LYS  19   1.060  -3.147   5.413
  171   2HE   LYS  19          2HE       LYS  19  -0.543  -3.343   6.155
  172   1HZ   LYS  19          1HZ       LYS  19   0.709  -5.270   6.545
  173   2HZ   LYS  19          2HZ       LYS  19  -0.440  -5.666   5.430
  174   3HZ   LYS  19          3HZ       LYS  19   1.124  -5.436   4.958
  175    H    MET  20           H        MET  20   1.330  -5.084   0.611
  176    HA   MET  20           HA       MET  20   3.047  -6.095   2.422
  177   1HB   MET  20          1HB       MET  20   1.992  -7.590   0.907
  178   2HB   MET  20          2HB       MET  20   2.729  -6.802  -0.509
  179   1HG   MET  20          1HG       MET  20   4.849  -7.569   1.227
  180   2HG   MET  20          2HG       MET  20   3.752  -8.956   1.116
  181   1HE   MET  20          1HE       MET  20   5.660  -6.890  -2.566
  182   2HE   MET  20          2HE       MET  20   4.323  -6.204  -1.612
  183   3HE   MET  20          3HE       MET  20   5.940  -6.369  -0.887
  184    H    ARG  21           H        ARG  21   4.014  -4.435  -0.597
  185    HA   ARG  21           HA       ARG  21   6.855  -4.691   0.182
  186   1HB   ARG  21          1HB       ARG  21   5.420  -4.619  -2.281
  187   2HB   ARG  21          2HB       ARG  21   6.426  -3.151  -2.213
  188   1HG   ARG  21          1HG       ARG  21   8.407  -4.344  -2.166
  189   2HG   ARG  21          2HG       ARG  21   7.670  -5.741  -1.344
  190   1HD   ARG  21          1HD       ARG  21   6.331  -5.546  -3.816
  191   2HD   ARG  21          2HD       ARG  21   8.042  -5.252  -4.195
  192    HE   ARG  21           HE       ARG  21   6.840  -7.757  -3.410
  193   1HH1  ARG  21          2HH2      ARG  21   9.772  -5.792  -3.199
  194   2HH1  ARG  21          1HH2      ARG  21  10.841  -7.163  -3.005
  195   1HH2  ARG  21          2HH1      ARG  21   8.253  -9.568  -3.154
  196   2HH2  ARG  21          1HH1      ARG  21   9.975  -9.316  -2.979
  197    H    ARG  22           H        ARG  22   4.240  -2.312  -0.233
  198    HA   ARG  22           HA       ARG  22   5.988  -0.038   0.230
  199   1HB   ARG  22          1HB       ARG  22   3.694  -0.210  -1.052
  200   2HB   ARG  22          2HB       ARG  22   2.993   0.012   0.569
  201   1HG   ARG  22          1HG       ARG  22   5.228   1.840  -0.257
  202   2HG   ARG  22          2HG       ARG  22   3.625   2.103  -0.985
  203   1HD   ARG  22          1HD       ARG  22   4.497   2.350   1.877
  204   2HD   ARG  22          2HD       ARG  22   3.412   3.389   0.929
  205    HE   ARG  22           HE       ARG  22   2.699   0.941   2.398
  206   1HH1  ARG  22          2HH2      ARG  22   1.794   3.415   0.040
  207   2HH1  ARG  22          1HH2      ARG  22   0.075   3.128   0.194
  208   1HH2  ARG  22          2HH1      ARG  22   0.428   0.562   2.601
  209   2HH2  ARG  22          1HH1      ARG  22  -0.703   1.501   1.654
  210    H    ASN  23           H        ASN  23   6.027  -2.231   2.234
  211    HA   ASN  23           HA       ASN  23   5.551  -0.523   4.589
  212   1HB   ASN  23          1HB       ASN  23   3.667  -2.425   3.848
  213   2HB   ASN  23          2HB       ASN  23   4.671  -3.289   5.031
  214   1HD2  ASN  23          1HD2      ASN  23   2.746  -0.319   4.488
  215   2HD2  ASN  23          2HD2      ASN  23   2.383  -0.027   6.176
  216    H    GLN  24           H        GLN  24   7.754  -1.922   2.871
  217    HA   GLN  24           HA       GLN  24   9.278  -2.847   5.227
  218   1HB   GLN  24          1HB       GLN  24   8.812  -4.448   2.686
  219   2HB   GLN  24          2HB       GLN  24  10.120  -4.794   3.843
  220   1HG   GLN  24          1HG       GLN  24   8.013  -4.613   5.551
  221   2HG   GLN  24          2HG       GLN  24   7.178  -5.205   4.099
  222   1HE2  GLN  24          1HE2      GLN  24   7.740  -7.258   3.209
  223   2HE2  GLN  24          2HE2      GLN  24   8.621  -8.445   4.146
  224    H    PHE  25           H        PHE  25  10.534  -3.688   2.142
  225    HA   PHE  25           HA       PHE  25  12.759  -1.943   2.391
  226   1HB   PHE  25          1HB       PHE  25  13.405  -3.563   0.983
  227   2HB   PHE  25          2HB       PHE  25  11.735  -3.954   0.539
  228    HD1  PHE  25           1HD      PHE  25  10.666  -1.736  -0.843
  229    HD2  PHE  25           2HD      PHE  25  14.719  -3.158  -0.872
  230    HE1  PHE  25           1HE      PHE  25  11.013  -0.701  -3.070
  231    HE2  PHE  25           2HE      PHE  25  15.067  -2.123  -3.099
  232    HZ   PHE  25           HZ       PHE  25  13.214  -0.894  -4.198
  233    H    TRP  26           H        TRP  26   9.578  -1.181   1.708
  234    HA   TRP  26           HA       TRP  26  10.116   0.846  -0.330
  235   1HB   TRP  26          1HB       TRP  26   7.799  -0.402   0.980
  236   2HB   TRP  26          2HB       TRP  26   7.608   1.338   0.717
  237    HD1  TRP  26           HD       TRP  26   7.754  -1.973  -1.095
  238    HE1  TRP  26           1HE      TRP  26   7.104  -1.683  -3.541
  239    HE3  TRP  26           3HE      TRP  26   7.672   3.140  -1.306
  240    HZ2  TRP  26           2HZ      TRP  26   6.607   0.499  -5.376
  241    HZ3  TRP  26           3HZ      TRP  26   7.107   4.287  -3.416
  242    HH2  TRP  26           HH       TRP  26   6.574   2.985  -5.455
  243    H    VAL  27           H        VAL  27   8.434   1.145   2.836
  244    HA   VAL  27           HA       VAL  27   8.496   3.695   3.431
  245    HB   VAL  27           HB       VAL  27   8.943   3.202   5.744
  246   1HG1  VAL  27          1HG1      VAL  27   7.331   1.556   6.063
  247   2HG1  VAL  27          2HG1      VAL  27   7.032   1.971   4.358
  248   3HG1  VAL  27          3HG1      VAL  27   7.980   0.521   4.769
  249   1HG2  VAL  27          1HG2      VAL  27  10.626   1.026   4.532
  250   2HG2  VAL  27          2HG2      VAL  27  10.985   2.112   5.896
  251   3HG2  VAL  27          3HG2      VAL  27   9.885   0.731   6.124
  252    H    LYS  28           H        LYS  28  11.487   1.747   3.211
  253    HA   LYS  28           HA       LYS  28  13.249   3.854   4.016
  254   1HB   LYS  28          1HB       LYS  28  13.581   1.264   2.478
  255   2HB   LYS  28          2HB       LYS  28  14.947   2.366   2.773
  256   1HG   LYS  28          1HG       LYS  28  13.150   1.479   5.043
  257   2HG   LYS  28          2HG       LYS  28  14.500   0.456   4.496
  258   1HD   LYS  28          1HD       LYS  28  16.114   1.985   5.177
  259   2HD   LYS  28          2HD       LYS  28  15.017   3.377   5.009
  260   1HE   LYS  28          1HE       LYS  28  13.679   2.271   6.951
  261   2HE   LYS  28          2HE       LYS  28  15.156   1.323   7.229
  262   1HZ   LYS  28          1HZ       LYS  28  15.466   3.129   8.535
  263   2HZ   LYS  28          2HZ       LYS  28  16.246   3.619   7.167
  264   3HZ   LYS  28          3HZ       LYS  28  14.733   4.185   7.502
  265    H    VAL  29           H        VAL  29  11.996   2.724   0.858
  266    HA   VAL  29           HA       VAL  29  13.587   4.210  -0.868
  267    HB   VAL  29           HB       VAL  29  11.670   4.123  -2.412
  268   1HG1  VAL  29          1HG1      VAL  29  12.393   1.769  -0.682
  269   2HG1  VAL  29          2HG1      VAL  29  11.089   1.578  -1.878
  270   3HG1  VAL  29          3HG1      VAL  29  12.721   2.050  -2.409
  271   1HG2  VAL  29          1HG2      VAL  29   9.557   4.238  -1.637
  272   2HG2  VAL  29          2HG2      VAL  29   9.790   2.727  -0.724
  273   3HG2  VAL  29          3HG2      VAL  29  10.192   4.291   0.025
  274    H    GLN  30           H        GLN  30  11.508   5.360   1.600
  275    HA   GLN  30           HA       GLN  30  11.165   7.990   0.282
  276   1HB   GLN  30          1HB       GLN  30   9.395   8.327   1.708
  277   2HB   GLN  30          2HB       GLN  30   9.395   6.547   1.702
  278   1HG   GLN  30          1HG       GLN  30  11.195   6.947   3.662
  279   2HG   GLN  30          2HG       GLN  30  10.276   8.458   3.833
  280   1HE2  GLN  30          1HE2      GLN  30  10.483   6.020   5.604
  281   2HE2  GLN  30          2HE2      GLN  30   8.830   5.496   5.846
  282    H    ARG  31           H        ARG  31  12.968   6.304   2.788
  283    HA   ARG  31           HA       ARG  31  13.834   7.959   4.633
  284   1HB   ARG  31          1HB       ARG  31  14.945   5.797   3.761
  285   2HB   ARG  31          2HB       ARG  31  15.926   6.869   2.732
  286   1HG   ARG  31          1HG       ARG  31  15.701   7.652   5.602
  287   2HG   ARG  31          2HG       ARG  31  16.635   6.174   5.265
  288   1HD   ARG  31          1HD       ARG  31  17.885   7.499   3.491
  289   2HD   ARG  31          2HD       ARG  31  17.081   8.955   4.118
  290    HE   ARG  31           HE       ARG  31  19.328   7.576   5.285
  291   1HH1  ARG  31          2HH2      ARG  31  16.394   9.403   6.032
  292   2HH1  ARG  31          1HH2      ARG  31  16.990   9.997   7.566
  293   1HH2  ARG  31          2HH1      ARG  31  20.115   8.360   7.312
  294   2HH2  ARG  31          1HH1      ARG  31  19.111   9.402   8.296
  295    H    GLY  32           H        GLY  32  15.048   8.325   1.248
  296   1HA   GLY  32          1HA       GLY  32  14.711  10.931   0.750
  297   2HA   GLY  32          2HA       GLY  32  16.054  11.008   1.913
  Start of MODEL   26
    1    HA   PRO   1           HA       PRO   1 -10.570   7.660   2.954
    2   1HB   PRO   1          1HB       PRO   1 -11.991   6.528   4.985
    3   2HB   PRO   1          2HB       PRO   1 -10.198   6.564   4.991
    4   1HG   PRO   1          1HG       PRO   1 -12.080   8.514   6.350
    5   2HG   PRO   1          2HG       PRO   1 -10.707   7.629   7.093
    6   1HD   PRO   1          1HD       PRO   1 -10.425  10.181   6.178
    7   2HD   PRO   1          2HD       PRO   1  -9.122   8.979   5.930
    8    HA   PRO   2           HA       PRO   2 -14.386  10.031   2.113
    9   1HB   PRO   2          1HB       PRO   2 -14.458   9.519  -0.562
   10   2HB   PRO   2          2HB       PRO   2 -13.315  10.708   0.143
   11   1HG   PRO   2          1HG       PRO   2 -12.765   7.802  -0.522
   12   2HG   PRO   2          2HG       PRO   2 -11.812   9.233  -1.031
   13   1HD   PRO   2          1HD       PRO   2 -11.113   7.764   1.155
   14   2HD   PRO   2          2HD       PRO   2 -10.981   9.549   1.182
   15    H    LEU   3           H        LEU   3 -15.941   8.828  -0.031
   16    HA   LEU   3           HA       LEU   3 -16.354   6.030   0.672
   17   1HB   LEU   3          1HB       LEU   3 -17.692   8.034   2.176
   18   2HB   LEU   3          2HB       LEU   3 -18.896   7.348   1.059
   19    HG   LEU   3           HG       LEU   3 -17.760   5.050   1.827
   20   1HD1  LEU   3          1HD1      LEU   3 -17.571   5.704   4.509
   21   2HD1  LEU   3          2HD1      LEU   3 -16.187   5.450   3.418
   22   3HD1  LEU   3          3HD1      LEU   3 -16.788   7.097   3.725
   23   1HD2  LEU   3          1HD2      LEU   3 -19.959   6.735   2.922
   24   2HD2  LEU   3          2HD2      LEU   3 -20.002   5.070   2.293
   25   3HD2  LEU   3          3HD2      LEU   3 -19.438   5.381   3.953
   26    H    SER   4           H        SER   4 -15.610   7.206  -1.736
   27    HA   SER   4           HA       SER   4 -18.136   7.038  -3.314
   28   1HB   SER   4          1HB       SER   4 -16.303   9.132  -3.194
   29   2HB   SER   4          2HB       SER   4 -15.827   8.244  -4.661
   30    HG   SER   4           HG       SER   4 -17.592   8.876  -5.588
   31    H    GLN   5           H        GLN   5 -15.471   5.321  -2.367
   32    HA   GLN   5           HA       GLN   5 -14.759   3.259  -3.147
   33   1HB   GLN   5          1HB       GLN   5 -17.006   3.721  -4.749
   34   2HB   GLN   5          2HB       GLN   5 -15.691   3.432  -5.914
   35   1HG   GLN   5          1HG       GLN   5 -15.064   1.421  -4.406
   36   2HG   GLN   5          2HG       GLN   5 -16.672   1.632  -3.681
   37   1HE2  GLN   5          1HE2      GLN   5 -15.981  -0.739  -5.008
   38   2HE2  GLN   5          2HE2      GLN   5 -16.903  -0.857  -6.491
   39    H    GLU   6           H        GLU   6 -14.256   6.344  -4.495
   40    HA   GLU   6           HA       GLU   6 -12.631   6.261  -6.609
   41   1HB   GLU   6          1HB       GLU   6 -12.849   7.899  -4.293
   42   2HB   GLU   6          2HB       GLU   6 -11.113   7.608  -4.560
   43   1HG   GLU   6          1HG       GLU   6 -11.117   8.635  -6.635
   44   2HG   GLU   6          2HG       GLU   6 -12.824   8.248  -6.942
   45    H    THR   7           H        THR   7 -11.278   5.598  -3.322
   46    HA   THR   7           HA       THR   7  -9.055   4.148  -4.626
   47    HB   THR   7           HB       THR   7  -8.993   4.278  -1.714
   48    HG1  THR   7           1HG      THR   7  -9.849   6.185  -1.561
   49   1HG2  THR   7          1HG2      THR   7  -6.789   4.959  -2.118
   50   2HG2  THR   7          2HG2      THR   7  -7.158   4.033  -3.593
   51   3HG2  THR   7          3HG2      THR   7  -7.222   5.812  -3.619
   52    H    PHE   8           H        PHE   8 -10.329   3.444  -1.397
   53    HA   PHE   8           HA       PHE   8 -10.242   1.028  -0.822
   54   1HB   PHE   8          1HB       PHE   8 -13.093   1.526  -1.589
   55   2HB   PHE   8          2HB       PHE   8 -12.422   0.867  -0.088
   56    HD1  PHE   8           1HD      PHE   8 -11.875   4.077  -1.973
   57    HD2  PHE   8           2HD      PHE   8 -13.007   2.190   1.716
   58    HE1  PHE   8           1HE      PHE   8 -12.086   6.302  -0.899
   59    HE2  PHE   8           2HE      PHE   8 -13.218   4.415   2.790
   60    HZ   PHE   8           HZ       PHE   8 -12.757   6.472   1.482
   61    H    SER   9           H        SER   9 -12.515   1.583  -3.577
   62    HA   SER   9           HA       SER   9 -12.953  -0.880  -4.524
   63   1HB   SER   9          1HB       SER   9 -13.456   1.403  -5.606
   64   2HB   SER   9          2HB       SER   9 -11.877   1.233  -6.410
   65    HG   SER   9           HG       SER   9 -14.126   0.218  -7.199
   66    H    ASP  10           H        ASP  10  -9.954   0.927  -5.422
   67    HA   ASP  10           HA       ASP  10  -8.692  -1.707  -5.993
   68   1HB   ASP  10          1HB       ASP  10  -8.401   1.068  -7.098
   69   2HB   ASP  10          2HB       ASP  10  -6.978   0.004  -7.092
   70    H    LEU  11           H        LEU  11  -8.734   1.039  -3.874
   71    HA   LEU  11           HA       LEU  11  -6.013   0.964  -3.000
   72   1HB   LEU  11          1HB       LEU  11  -7.862   2.764  -2.653
   73   2HB   LEU  11          2HB       LEU  11  -8.355   1.766  -1.264
   74    HG   LEU  11           HG       LEU  11  -5.803   3.303  -1.710
   75   1HD1  LEU  11          1HD1      LEU  11  -6.517   3.055   1.016
   76   2HD1  LEU  11          2HD1      LEU  11  -6.777   4.465  -0.039
   77   3HD1  LEU  11          3HD1      LEU  11  -8.053   3.236   0.135
   78   1HD2  LEU  11          1HD2      LEU  11  -4.769   1.916   0.131
   79   2HD2  LEU  11          2HD2      LEU  11  -6.109   0.760  -0.060
   80   3HD2  LEU  11          3HD2      LEU  11  -4.977   1.039  -1.405
   81    H    TRP  12           H        TRP  12  -8.994  -0.199  -1.315
   82    HA   TRP  12           HA       TRP  12  -7.752  -1.604   0.725
   83   1HB   TRP  12          1HB       TRP  12  -9.867  -2.114   1.193
   84   2HB   TRP  12          2HB       TRP  12 -10.331  -1.309  -0.313
   85    HD1  TRP  12           HD       TRP  12 -11.718  -2.716  -1.863
   86    HE1  TRP  12           1HE      TRP  12 -12.147  -5.191  -2.283
   87    HE3  TRP  12           3HE      TRP  12  -8.379  -4.691   1.476
   88    HZ2  TRP  12           2HZ      TRP  12 -11.167  -7.728  -1.294
   89    HZ3  TRP  12           3HZ      TRP  12  -8.156  -7.137   1.708
   90    HH2  TRP  12           HH       TRP  12  -9.539  -8.666   0.335
   91    H    LYS  13           H        LYS  13  -8.139  -2.488  -2.684
   92    HA   LYS  13           HA       LYS  13  -7.259  -5.233  -2.250
   93   1HB   LYS  13          1HB       LYS  13  -8.357  -3.602  -4.416
   94   2HB   LYS  13          2HB       LYS  13  -7.006  -4.622  -4.966
   95   1HG   LYS  13          1HG       LYS  13  -8.947  -5.944  -3.137
   96   2HG   LYS  13          2HG       LYS  13  -9.582  -5.507  -4.741
   97   1HD   LYS  13          1HD       LYS  13  -7.160  -6.550  -5.441
   98   2HD   LYS  13          2HD       LYS  13  -7.515  -7.514  -3.987
   99   1HE   LYS  13          1HE       LYS  13  -8.821  -8.798  -5.305
  100   2HE   LYS  13          2HE       LYS  13  -9.954  -7.430  -5.346
  101   1HZ   LYS  13          1HZ       LYS  13  -7.788  -7.218  -7.184
  102   2HZ   LYS  13          2HZ       LYS  13  -8.777  -8.507  -7.472
  103   3HZ   LYS  13          3HZ       LYS  13  -9.404  -6.983  -7.417
  104    H    LEU  14           H        LEU  14  -5.852  -2.101  -3.113
  105    HA   LEU  14           HA       LEU  14  -3.386  -3.055  -4.157
  106   1HB   LEU  14          1HB       LEU  14  -4.620  -0.584  -3.687
  107   2HB   LEU  14          2HB       LEU  14  -3.170  -0.560  -2.655
  108    HG   LEU  14           HG       LEU  14  -2.475   0.270  -4.795
  109   1HD1  LEU  14          1HD1      LEU  14  -1.025  -1.491  -3.707
  110   2HD1  LEU  14          2HD1      LEU  14  -1.790  -2.697  -4.770
  111   3HD1  LEU  14          3HD1      LEU  14  -0.826  -1.376  -5.472
  112   1HD2  LEU  14          1HD2      LEU  14  -4.232  -0.328  -6.260
  113   2HD2  LEU  14          2HD2      LEU  14  -2.857  -1.297  -6.841
  114   3HD2  LEU  14          3HD2      LEU  14  -4.118  -2.053  -5.838
  115    H    LEU  15           H        LEU  15  -4.492  -2.294  -0.837
  116    HA   LEU  15           HA       LEU  15  -1.883  -2.827   0.320
  117   1HB   LEU  15          1HB       LEU  15  -4.521  -2.795   1.803
  118   2HB   LEU  15          2HB       LEU  15  -2.909  -2.303   2.376
  119    HG   LEU  15           HG       LEU  15  -3.961  -0.855  -0.013
  120   1HD1  LEU  15          1HD1      LEU  15  -6.004  -0.903   1.260
  121   2HD1  LEU  15          2HD1      LEU  15  -5.134  -0.600   2.783
  122   3HD1  LEU  15          3HD1      LEU  15  -5.254   0.684   1.555
  123   1HD2  LEU  15          1HD2      LEU  15  -1.774  -0.365   1.084
  124   2HD2  LEU  15          2HD2      LEU  15  -2.879   1.029   1.134
  125   3HD2  LEU  15          3HD2      LEU  15  -2.640   0.030   2.588
  126    H    LYS  16           H        LYS  16  -4.101  -4.809  -1.136
  127    HA   LYS  16           HA       LYS  16  -4.039  -6.982   0.822
  128   1HB   LYS  16          1HB       LYS  16  -5.735  -6.242  -1.247
  129   2HB   LYS  16          2HB       LYS  16  -4.853  -7.631  -1.927
  130   1HG   LYS  16          1HG       LYS  16  -5.334  -8.669   0.484
  131   2HG   LYS  16          2HG       LYS  16  -6.678  -7.501   0.461
  132   1HD   LYS  16          1HD       LYS  16  -7.848  -8.899  -0.862
  133   2HD   LYS  16          2HD       LYS  16  -6.586  -8.754  -2.109
  134   1HE   LYS  16          1HE       LYS  16  -6.459 -11.024  -1.735
  135   2HE   LYS  16          2HE       LYS  16  -5.323 -10.471  -0.485
  136   1HZ   LYS  16          1HZ       LYS  16  -6.683 -11.800   0.693
  137   2HZ   LYS  16          2HZ       LYS  16  -7.477 -10.370   0.900
  138   3HZ   LYS  16          3HZ       LYS  16  -8.029 -11.468  -0.200
  139    H    LYS  17           H        LYS  17  -1.596  -5.711  -0.724
  140    HA   LYS  17           HA       LYS  17  -0.160  -8.216  -0.936
  141   1HB   LYS  17          1HB       LYS  17  -0.346  -8.591  -3.139
  142   2HB   LYS  17          2HB       LYS  17  -1.466  -7.215  -3.277
  143   1HG   LYS  17          1HG       LYS  17   1.567  -6.942  -3.259
  144   2HG   LYS  17          2HG       LYS  17   0.587  -7.026  -4.742
  145   1HD   LYS  17          1HD       LYS  17  -0.617  -5.098  -2.988
  146   2HD   LYS  17          2HD       LYS  17   1.123  -4.741  -3.089
  147   1HE   LYS  17          1HE       LYS  17   0.149  -3.569  -4.914
  148   2HE   LYS  17          2HE       LYS  17   0.873  -5.024  -5.631
  149   1HZ   LYS  17          1HZ       LYS  17  -1.096  -5.464  -6.427
  150   2HZ   LYS  17          2HZ       LYS  17  -1.670  -5.694  -4.899
  151   3HZ   LYS  17          3HZ       LYS  17  -1.800  -4.214  -5.615
  152    H    TRP  18           H        TRP  18  -0.373  -4.702  -1.467
  153    HA   TRP  18           HA       TRP  18   2.507  -4.342  -1.464
  154   1HB   TRP  18          1HB       TRP  18   0.565  -2.888  -2.481
  155   2HB   TRP  18          2HB       TRP  18   0.510  -2.179  -0.861
  156    HD1  TRP  18           HD       TRP  18   3.180  -2.846  -3.587
  157    HE1  TRP  18           1HE      TRP  18   4.811  -0.891  -3.660
  158    HE3  TRP  18           3HE      TRP  18   1.264  -0.053   0.251
  159    HZ2  TRP  18           2HZ      TRP  18   5.241   1.589  -2.231
  160    HZ3  TRP  18           3HZ      TRP  18   2.310   2.096   0.865
  161    HH2  TRP  18           HH       TRP  18   4.294   2.929  -0.363
  162    H    LYS  19           H        LYS  19  -0.111  -4.391   0.907
  163    HA   LYS  19           HA       LYS  19   0.820  -2.992   3.044
  164   1HB   LYS  19          1HB       LYS  19  -1.172  -4.186   3.372
  165   2HB   LYS  19          2HB       LYS  19  -0.452  -5.725   2.842
  166   1HG   LYS  19          1HG       LYS  19   0.556  -6.116   4.882
  167   2HG   LYS  19          2HG       LYS  19   0.765  -4.383   5.231
  168   1HD   LYS  19          1HD       LYS  19  -1.268  -4.222   6.245
  169   2HD   LYS  19          2HD       LYS  19  -2.059  -5.257   5.033
  170   1HE   LYS  19          1HE       LYS  19  -0.479  -7.096   6.255
  171   2HE   LYS  19          2HE       LYS  19  -0.754  -5.985   7.614
  172   1HZ   LYS  19          1HZ       LYS  19  -2.762  -7.402   6.023
  173   2HZ   LYS  19          2HZ       LYS  19  -2.459  -7.543   7.638
  174   3HZ   LYS  19          3HZ       LYS  19  -3.141  -6.164   7.045
  175    H    MET  20           H        MET  20   2.172  -6.023   1.756
  176    HA   MET  20           HA       MET  20   3.904  -6.639   3.901
  177   1HB   MET  20          1HB       MET  20   4.047  -8.382   2.476
  178   2HB   MET  20          2HB       MET  20   3.540  -7.389   1.089
  179   1HG   MET  20          1HG       MET  20   6.119  -6.480   1.812
  180   2HG   MET  20          2HG       MET  20   6.198  -8.249   1.866
  181   1HE   MET  20          1HE       MET  20   4.275  -6.275  -1.774
  182   2HE   MET  20          2HE       MET  20   3.884  -6.056  -0.052
  183   3HE   MET  20          3HE       MET  20   5.235  -5.153  -0.780
  184    H    ARG  21           H        ARG  21   4.378  -4.585   0.991
  185    HA   ARG  21           HA       ARG  21   7.039  -3.792   1.958
  186   1HB   ARG  21          1HB       ARG  21   5.403  -3.305  -0.539
  187   2HB   ARG  21          2HB       ARG  21   6.857  -2.339  -0.190
  188   1HG   ARG  21          1HG       ARG  21   8.285  -4.167  -0.384
  189   2HG   ARG  21          2HG       ARG  21   7.013  -5.338   0.041
  190   1HD   ARG  21          1HD       ARG  21   5.941  -4.346  -2.229
  191   2HD   ARG  21          2HD       ARG  21   7.659  -4.078  -2.594
  192    HE   ARG  21           HE       ARG  21   7.668  -6.656  -1.736
  193   1HH1  ARG  21          2HH2      ARG  21   5.650  -4.893  -4.042
  194   2HH1  ARG  21          1HH2      ARG  21   5.343  -6.289  -5.051
  195   1HH2  ARG  21          2HH1      ARG  21   7.263  -8.501  -3.069
  196   2HH2  ARG  21          1HH1      ARG  21   6.264  -8.346  -4.496
  197    H    ARG  22           H        ARG  22   3.737  -2.507   1.606
  198    HA   ARG  22           HA       ARG  22   4.367   0.209   2.198
  199   1HB   ARG  22          1HB       ARG  22   2.134   0.496   1.949
  200   2HB   ARG  22          2HB       ARG  22   2.127  -1.208   1.435
  201   1HG   ARG  22          1HG       ARG  22   0.587  -1.380   3.136
  202   2HG   ARG  22          2HG       ARG  22   2.061  -1.564   4.117
  203   1HD   ARG  22          1HD       ARG  22   1.779   1.197   3.891
  204   2HD   ARG  22          2HD       ARG  22   0.103   0.631   4.053
  205    HE   ARG  22           HE       ARG  22   1.995  -0.522   5.973
  206   1HH1  ARG  22          2HH2      ARG  22  -0.316   2.051   5.235
  207   2HH1  ARG  22          1HH2      ARG  22  -0.621   2.444   6.912
  208   1HH2  ARG  22          2HH1      ARG  22   1.592  -0.002   8.188
  209   2HH2  ARG  22          1HH1      ARG  22   0.467   1.274   8.596
  210    H    ASN  23           H        ASN  23   5.297  -2.223   4.011
  211    HA   ASN  23           HA       ASN  23   4.826  -0.731   6.530
  212   1HB   ASN  23          1HB       ASN  23   3.401  -2.991   5.974
  213   2HB   ASN  23          2HB       ASN  23   4.841  -3.690   6.746
  214   1HD2  ASN  23          1HD2      ASN  23   2.849  -4.229   8.256
  215   2HD2  ASN  23          2HD2      ASN  23   2.616  -3.109   9.581
  216    H    GLN  24           H        GLN  24   7.019  -1.446   4.373
  217    HA   GLN  24           HA       GLN  24   9.185  -1.516   6.282
  218   1HB   GLN  24          1HB       GLN  24   8.501  -3.986   4.663
  219   2HB   GLN  24          2HB       GLN  24  10.153  -3.662   5.239
  220   1HG   GLN  24          1HG       GLN  24   8.882  -3.232   7.545
  221   2HG   GLN  24          2HG       GLN  24   7.664  -4.291   6.802
  222   1HE2  GLN  24          1HE2      GLN  24   7.992  -6.069   8.157
  223   2HE2  GLN  24          2HE2      GLN  24   9.468  -7.010   8.146
  224    H    PHE  25           H        PHE  25   9.674  -3.152   3.248
  225    HA   PHE  25           HA       PHE  25  11.630  -1.596   2.215
  226   1HB   PHE  25          1HB       PHE  25  11.047  -3.517   1.010
  227   2HB   PHE  25          2HB       PHE  25   9.344  -3.044   0.889
  228    HD1  PHE  25           1HD      PHE  25   9.009  -0.674  -0.383
  229    HD2  PHE  25           2HD      PHE  25  12.305  -3.376  -0.920
  230    HE1  PHE  25           1HE      PHE  25   9.435   0.292  -2.627
  231    HE2  PHE  25           2HE      PHE  25  12.732  -2.409  -3.164
  232    HZ   PHE  25           HZ       PHE  25  11.297  -0.576  -4.018
  233    H    TRP  26           H        TRP  26   8.120  -0.899   2.021
  234    HA   TRP  26           HA       TRP  26   8.060   1.235   0.292
  235   1HB   TRP  26          1HB       TRP  26   6.065   1.836   1.299
  236   2HB   TRP  26          2HB       TRP  26   6.224   0.136   1.760
  237    HD1  TRP  26           HD       TRP  26   6.290  -0.433   4.261
  238    HE1  TRP  26           1HE      TRP  26   6.109   0.880   6.436
  239    HE3  TRP  26           3HE      TRP  26   6.755   4.306   2.384
  240    HZ2  TRP  26           2HZ      TRP  26   6.157   3.650   7.271
  241    HZ3  TRP  26           3HZ      TRP  26   6.682   6.253   3.898
  242    HH2  TRP  26           HH       TRP  26   6.385   5.944   6.337
  243    H    VAL  27           H        VAL  27   9.107   1.256   3.721
  244    HA   VAL  27           HA       VAL  27   9.404   3.904   4.270
  245    HB   VAL  27           HB       VAL  27  11.282   3.300   5.684
  246   1HG1  VAL  27          1HG1      VAL  27   9.736   2.242   6.939
  247   2HG1  VAL  27          2HG1      VAL  27   8.834   1.758   5.483
  248   3HG1  VAL  27          3HG1      VAL  27  10.149   0.728   6.098
  249   1HG2  VAL  27          1HG2      VAL  27  12.113   0.823   5.370
  250   2HG2  VAL  27          2HG2      VAL  27  11.506   1.022   3.709
  251   3HG2  VAL  27          3HG2      VAL  27  12.778   2.103   4.328
  252    H    LYS  28           H        LYS  28  11.549   1.939   2.172
  253    HA   LYS  28           HA       LYS  28  13.420   4.042   1.667
  254   1HB   LYS  28          1HB       LYS  28  12.720   1.397   0.407
  255   2HB   LYS  28          2HB       LYS  28  13.813   2.514  -0.445
  256   1HG   LYS  28          1HG       LYS  28  14.768   2.582   2.164
  257   2HG   LYS  28          2HG       LYS  28  14.291   0.879   1.961
  258   1HD   LYS  28          1HD       LYS  28  15.666   0.658  -0.019
  259   2HD   LYS  28          2HD       LYS  28  15.998   2.406  -0.045
  260   1HE   LYS  28          1HE       LYS  28  17.588   2.255   1.576
  261   2HE   LYS  28          2HE       LYS  28  16.656   1.066   2.513
  262   1HZ   LYS  28          1HZ       LYS  28  18.356   0.568   0.180
  263   2HZ   LYS  28          2HZ       LYS  28  18.559   0.012   1.719
  264   3HZ   LYS  28          3HZ       LYS  28  17.317  -0.556   0.794
  265    H    VAL  29           H        VAL  29  10.386   2.986   0.117
  266    HA   VAL  29           HA       VAL  29  10.454   4.324  -2.286
  267    HB   VAL  29           HB       VAL  29   8.169   4.076  -0.292
  268   1HG1  VAL  29          1HG1      VAL  29   7.227   5.625  -1.699
  269   2HG1  VAL  29          2HG1      VAL  29   8.374   5.280  -3.016
  270   3HG1  VAL  29          3HG1      VAL  29   6.988   4.198  -2.736
  271   1HG2  VAL  29          1HG2      VAL  29   9.336   1.989  -1.217
  272   2HG2  VAL  29          2HG2      VAL  29   7.586   2.104  -1.524
  273   3HG2  VAL  29          3HG2      VAL  29   8.744   2.488  -2.820
  274    H    GLN  30           H        GLN  30  10.656   5.692   0.881
  275    HA   GLN  30           HA       GLN  30   9.852   8.368  -0.092
  276   1HB   GLN  30          1HB       GLN  30   9.430   8.876   2.091
  277   2HB   GLN  30          2HB       GLN  30   9.353   7.106   2.264
  278   1HG   GLN  30          1HG       GLN  30  11.844   7.145   2.745
  279   2HG   GLN  30          2HG       GLN  30  11.737   8.918   2.801
  280   1HE2  GLN  30          1HE2      GLN  30  12.622   7.492   5.027
  281   2HE2  GLN  30          2HE2      GLN  30  11.416   7.579   6.293
  282    H    ARG  31           H        ARG  31  12.643   6.544   1.208
  283    HA   ARG  31           HA       ARG  31  14.821   7.338   1.589
  284   1HB   ARG  31          1HB       ARG  31  14.954   6.219  -0.522
  285   2HB   ARG  31          2HB       ARG  31  14.216   7.596  -1.376
  286   1HG   ARG  31          1HG       ARG  31  16.225   8.591  -1.622
  287   2HG   ARG  31          2HG       ARG  31  16.546   8.472   0.124
  288   1HD   ARG  31          1HD       ARG  31  17.170   6.044  -0.253
  289   2HD   ARG  31          2HD       ARG  31  17.061   6.355  -1.999
  290    HE   ARG  31           HE       ARG  31  19.161   7.253  -0.163
  291   1HH1  ARG  31          2HH2      ARG  31  17.562   7.651  -3.291
  292   2HH1  ARG  31          1HH2      ARG  31  18.938   8.422  -4.050
  293   1HH2  ARG  31          2HH1      ARG  31  20.977   8.271  -1.165
  294   2HH2  ARG  31          1HH1      ARG  31  20.884   8.775  -2.837
  295    H    GLY  32           H        GLY  32  14.503   9.510  -1.150
  296   1HA   GLY  32          1HA       GLY  32  13.898  11.894   0.321
  297   2HA   GLY  32          2HA       GLY  32  15.656  11.710   0.129
  Start of MODEL   27
    1    HA   PRO   1           HA       PRO   1 -21.852   9.679  -0.690
    2   1HB   PRO   1          1HB       PRO   1 -21.022   8.144   1.402
    3   2HB   PRO   1          2HB       PRO   1 -21.322   9.904   1.581
    4   1HG   PRO   1          1HG       PRO   1 -23.234   7.639   2.220
    5   2HG   PRO   1          2HG       PRO   1 -22.755   8.995   3.293
    6   1HD   PRO   1          1HD       PRO   1 -25.041   9.094   1.811
    7   2HD   PRO   1          2HD       PRO   1 -24.019  10.551   2.000
    8    HA   PRO   2           HA       PRO   2 -22.373   5.775  -2.675
    9   1HB   PRO   2          1HB       PRO   2 -19.797   5.194  -3.349
   10   2HB   PRO   2          2HB       PRO   2 -20.668   6.594  -4.058
   11   1HG   PRO   2          1HG       PRO   2 -18.788   6.611  -1.679
   12   2HG   PRO   2          2HG       PRO   2 -18.714   7.660  -3.132
   13   1HD   PRO   2          1HD       PRO   2 -19.924   8.494  -0.836
   14   2HD   PRO   2          2HD       PRO   2 -20.640   8.879  -2.430
   15    H    LEU   3           H        LEU   3 -21.261   6.207   0.402
   16    HA   LEU   3           HA       LEU   3 -20.586   4.822   2.110
   17   1HB   LEU   3          1HB       LEU   3 -22.923   3.858   0.889
   18   2HB   LEU   3          2HB       LEU   3 -21.903   2.417   1.116
   19    HG   LEU   3           HG       LEU   3 -21.500   3.625   3.507
   20   1HD1  LEU   3          1HD1      LEU   3 -24.164   4.582   2.433
   21   2HD1  LEU   3          2HD1      LEU   3 -23.924   4.333   4.179
   22   3HD1  LEU   3          3HD1      LEU   3 -22.911   5.503   3.300
   23   1HD2  LEU   3          1HD2      LEU   3 -22.539   1.306   2.729
   24   2HD2  LEU   3          2HD2      LEU   3 -22.796   1.902   4.387
   25   3HD2  LEU   3          3HD2      LEU   3 -24.073   2.098   3.162
   26    H    SER   4           H        SER   4 -18.371   4.963   1.010
   27    HA   SER   4           HA       SER   4 -16.415   3.936   0.411
   28   1HB   SER   4          1HB       SER   4 -16.043   1.691   1.260
   29   2HB   SER   4          2HB       SER   4 -17.001   2.601   2.452
   30    HG   SER   4           HG       SER   4 -18.502   1.313   0.552
   31    H    GLN   5           H        GLN   5 -15.886   3.779  -1.680
   32    HA   GLN   5           HA       GLN   5 -16.296   1.548  -3.282
   33   1HB   GLN   5          1HB       GLN   5 -18.700   3.126  -3.030
   34   2HB   GLN   5          2HB       GLN   5 -18.106   3.215  -4.705
   35   1HG   GLN   5          1HG       GLN   5 -17.814   0.662  -4.564
   36   2HG   GLN   5          2HG       GLN   5 -18.785   0.744  -3.078
   37   1HE2  GLN   5          1HE2      GLN   5 -20.999   1.045  -3.196
   38   2HE2  GLN   5          2HE2      GLN   5 -21.880   1.148  -4.705
   39    H    GLU   6           H        GLU   6 -16.678   5.126  -3.633
   40    HA   GLU   6           HA       GLU   6 -15.518   5.636  -6.007
   41   1HB   GLU   6          1HB       GLU   6 -15.814   7.027  -3.521
   42   2HB   GLU   6          2HB       GLU   6 -14.183   7.362  -4.149
   43   1HG   GLU   6          1HG       GLU   6 -16.510   7.438  -6.053
   44   2HG   GLU   6          2HG       GLU   6 -16.279   8.802  -4.938
   45    H    THR   7           H        THR   7 -13.345   5.816  -3.150
   46    HA   THR   7           HA       THR   7 -11.082   5.080  -4.828
   47    HB   THR   7           HB       THR   7 -11.064   5.319  -1.813
   48    HG1  THR   7           1HG      THR   7 -11.673   7.298  -2.029
   49   1HG2  THR   7          1HG2      THR   7  -9.116   4.874  -3.770
   50   2HG2  THR   7          2HG2      THR   7  -8.981   6.615  -3.425
   51   3HG2  THR   7          3HG2      THR   7  -8.822   5.431  -2.105
   52    H    PHE   8           H        PHE   8 -11.363   3.822  -1.550
   53    HA   PHE   8           HA       PHE   8 -10.510   1.607  -1.105
   54   1HB   PHE   8          1HB       PHE   8 -13.378   1.102  -1.891
   55   2HB   PHE   8          2HB       PHE   8 -12.466   0.446  -0.521
   56    HD1  PHE   8           1HD      PHE   8 -13.010   3.960  -1.741
   57    HD2  PHE   8           2HD      PHE   8 -13.482   1.124   1.450
   58    HE1  PHE   8           1HE      PHE   8 -13.912   5.751  -0.282
   59    HE2  PHE   8           2HE      PHE   8 -14.384   2.915   2.909
   60    HZ   PHE   8           HZ       PHE   8 -14.599   5.229   2.043
   61    H    SER   9           H        SER   9 -12.603   1.658  -4.043
   62    HA   SER   9           HA       SER   9 -11.682  -0.889  -4.985
   63   1HB   SER   9          1HB       SER   9 -13.788   0.654  -5.583
   64   2HB   SER   9          2HB       SER   9 -12.694   1.201  -6.877
   65    HG   SER   9           HG       SER   9 -14.135  -0.902  -6.965
   66    H    ASP  10           H        ASP  10  -9.349   0.169  -4.280
   67    HA   ASP  10           HA       ASP  10  -7.589  -0.112  -6.276
   68   1HB   ASP  10          1HB       ASP  10  -8.434   1.405  -7.816
   69   2HB   ASP  10          2HB       ASP  10  -8.961   2.548  -6.562
   70    H    LEU  11           H        LEU  11  -8.617   2.069  -3.675
   71    HA   LEU  11           HA       LEU  11  -5.872   2.741  -2.942
   72   1HB   LEU  11          1HB       LEU  11  -8.423   3.835  -2.505
   73   2HB   LEU  11          2HB       LEU  11  -7.897   3.249  -0.908
   74    HG   LEU  11           HG       LEU  11  -5.605   4.381  -1.573
   75   1HD1  LEU  11          1HD1      LEU  11  -7.063   6.514  -2.907
   76   2HD1  LEU  11          2HD1      LEU  11  -5.595   5.657  -3.433
   77   3HD1  LEU  11          3HD1      LEU  11  -7.200   4.997  -3.829
   78   1HD2  LEU  11          1HD2      LEU  11  -7.184   6.661  -0.994
   79   2HD2  LEU  11          2HD2      LEU  11  -8.030   5.283  -0.251
   80   3HD2  LEU  11          3HD2      LEU  11  -6.333   5.616   0.168
   81    H    TRP  12           H        TRP  12  -8.522   1.353  -0.934
   82    HA   TRP  12           HA       TRP  12  -6.888   0.168   0.976
   83   1HB   TRP  12          1HB       TRP  12  -8.877  -0.404   1.793
   84   2HB   TRP  12          2HB       TRP  12  -9.614   0.236   0.318
   85    HD1  TRP  12           HD       TRP  12 -11.157  -1.381  -0.818
   86    HE1  TRP  12           1HE      TRP  12 -11.442  -3.906  -1.000
   87    HE3  TRP  12           3HE      TRP  12  -7.106  -2.852   1.943
   88    HZ2  TRP  12           2HZ      TRP  12 -10.083  -6.284  -0.064
   89    HZ3  TRP  12           3HZ      TRP  12  -6.634  -5.251   2.275
   90    HH2  TRP  12           HH       TRP  12  -8.109  -6.975   1.281
   91    H    LYS  13           H        LYS  13  -7.915  -1.081  -2.209
   92    HA   LYS  13           HA       LYS  13  -6.878  -3.718  -1.845
   93   1HB   LYS  13          1HB       LYS  13  -8.406  -2.444  -3.729
   94   2HB   LYS  13          2HB       LYS  13  -6.848  -2.578  -4.580
   95   1HG   LYS  13          1HG       LYS  13  -6.907  -5.055  -3.625
   96   2HG   LYS  13          2HG       LYS  13  -8.659  -4.752  -3.546
   97   1HD   LYS  13          1HD       LYS  13  -8.413  -3.902  -5.990
   98   2HD   LYS  13          2HD       LYS  13  -6.839  -4.732  -5.970
   99   1HE   LYS  13          1HE       LYS  13  -9.371  -6.140  -5.088
  100   2HE   LYS  13          2HE       LYS  13  -8.916  -6.058  -6.804
  101   1HZ   LYS  13          1HZ       LYS  13  -7.667  -7.489  -4.635
  102   2HZ   LYS  13          2HZ       LYS  13  -7.860  -7.918  -6.216
  103   3HZ   LYS  13          3HZ       LYS  13  -6.667  -6.863  -5.788
  104    H    LEU  14           H        LEU  14  -5.469  -0.630  -2.895
  105    HA   LEU  14           HA       LEU  14  -3.072  -1.624  -4.015
  106   1HB   LEU  14          1HB       LEU  14  -4.202   0.910  -3.203
  107   2HB   LEU  14          2HB       LEU  14  -2.506   0.812  -2.674
  108    HG   LEU  14           HG       LEU  14  -3.115   1.638  -5.127
  109   1HD1  LEU  14          1HD1      LEU  14  -0.848   0.743  -3.870
  110   2HD1  LEU  14          2HD1      LEU  14  -0.962  -0.406  -5.224
  111   3HD1  LEU  14          3HD1      LEU  14  -0.890   1.343  -5.545
  112   1HD2  LEU  14          1HD2      LEU  14  -2.631  -1.167  -5.937
  113   2HD2  LEU  14          2HD2      LEU  14  -4.233  -0.885  -5.213
  114   3HD2  LEU  14          3HD2      LEU  14  -3.724   0.051  -6.640
  115    H    LEU  15           H        LEU  15  -3.867  -0.638  -0.644
  116    HA   LEU  15           HA       LEU  15  -1.252  -1.333   0.356
  117   1HB   LEU  15          1HB       LEU  15  -3.841  -0.346   1.409
  118   2HB   LEU  15          2HB       LEU  15  -2.900  -1.343   2.544
  119    HG   LEU  15           HG       LEU  15  -0.880   0.103   1.946
  120   1HD1  LEU  15          1HD1      LEU  15  -1.069   1.735   0.396
  121   2HD1  LEU  15          2HD1      LEU  15  -2.662   1.055  -0.015
  122   3HD1  LEU  15          3HD1      LEU  15  -2.538   2.378   1.170
  123   1HD2  LEU  15          1HD2      LEU  15  -2.436   2.179   3.088
  124   2HD2  LEU  15          2HD2      LEU  15  -3.177   0.656   3.636
  125   3HD2  LEU  15          3HD2      LEU  15  -1.453   0.969   3.948
  126    H    LYS  16           H        LYS  16  -3.800  -3.201  -0.793
  127    HA   LYS  16           HA       LYS  16  -3.586  -5.354   1.167
  128   1HB   LYS  16          1HB       LYS  16  -5.629  -4.640  -0.316
  129   2HB   LYS  16          2HB       LYS  16  -4.825  -5.613  -1.571
  130   1HG   LYS  16          1HG       LYS  16  -4.640  -7.424   0.326
  131   2HG   LYS  16          2HG       LYS  16  -5.942  -6.488   1.099
  132   1HD   LYS  16          1HD       LYS  16  -7.290  -7.822  -0.184
  133   2HD   LYS  16          2HD       LYS  16  -6.897  -6.636  -1.452
  134   1HE   LYS  16          1HE       LYS  16  -6.264  -8.533  -2.579
  135   2HE   LYS  16          2HE       LYS  16  -4.747  -8.244  -1.700
  136   1HZ   LYS  16          1HZ       LYS  16  -6.683  -9.751  -0.251
  137   2HZ   LYS  16          2HZ       LYS  16  -6.150 -10.497  -1.622
  138   3HZ   LYS  16          3HZ       LYS  16  -5.071 -10.024  -0.468
  139    H    LYS  17           H        LYS  17  -1.257  -4.273  -0.612
  140    HA   LYS  17           HA       LYS  17   0.042  -6.800  -0.928
  141   1HB   LYS  17          1HB       LYS  17  -0.551  -7.386  -3.010
  142   2HB   LYS  17          2HB       LYS  17  -1.615  -5.963  -3.120
  143   1HG   LYS  17          1HG       LYS  17   1.376  -6.015  -3.708
  144   2HG   LYS  17          2HG       LYS  17   0.074  -5.920  -4.917
  145   1HD   LYS  17          1HD       LYS  17  -0.458  -3.871  -3.028
  146   2HD   LYS  17          2HD       LYS  17   1.288  -3.789  -3.365
  147   1HE   LYS  17          1HE       LYS  17   0.322  -2.439  -5.047
  148   2HE   LYS  17          2HE       LYS  17   0.615  -3.993  -5.859
  149   1HZ   LYS  17          1HZ       LYS  17  -1.547  -3.244  -6.359
  150   2HZ   LYS  17          2HZ       LYS  17  -1.692  -4.549  -5.361
  151   3HZ   LYS  17          3HZ       LYS  17  -1.932  -3.028  -4.770
  152    H    TRP  18           H        TRP  18  -0.225  -3.339  -1.354
  153    HA   TRP  18           HA       TRP  18   2.656  -3.086  -1.939
  154   1HB   TRP  18          1HB       TRP  18   0.517  -1.704  -2.832
  155   2HB   TRP  18          2HB       TRP  18   0.925  -0.721  -1.419
  156    HD1  TRP  18           HD       TRP  18   2.088  -1.597  -4.901
  157    HE1  TRP  18           1HE      TRP  18   4.018  -0.092  -5.605
  158    HE3  TRP  18           3HE      TRP  18   3.033   0.660  -0.405
  159    HZ2  TRP  18           2HZ      TRP  18   5.767   1.859  -4.375
  160    HZ3  TRP  18           3HZ      TRP  18   4.836   2.333  -0.211
  161    HH2  TRP  18           HH       TRP  18   6.209   2.942  -2.181
  162    H    LYS  19           H        LYS  19   0.285  -2.657   0.658
  163    HA   LYS  19           HA       LYS  19   1.779  -1.063   2.420
  164   1HB   LYS  19          1HB       LYS  19  -0.638  -1.862   2.618
  165   2HB   LYS  19          2HB       LYS  19   0.018  -3.396   3.239
  166   1HG   LYS  19          1HG       LYS  19   1.413  -1.699   4.797
  167   2HG   LYS  19          2HG       LYS  19  -0.011  -0.676   4.496
  168   1HD   LYS  19          1HD       LYS  19  -0.958  -1.830   6.212
  169   2HD   LYS  19          2HD       LYS  19  -1.163  -3.134   5.017
  170   1HE   LYS  19          1HE       LYS  19   1.396  -3.610   5.736
  171   2HE   LYS  19          2HE       LYS  19   0.818  -2.865   7.242
  172   1HZ   LYS  19          1HZ       LYS  19  -0.813  -4.485   7.444
  173   2HZ   LYS  19          2HZ       LYS  19  -0.599  -5.053   5.910
  174   3HZ   LYS  19          3HZ       LYS  19   0.562  -5.307   7.054
  175    H    MET  20           H        MET  20   1.713  -4.649   2.069
  176    HA   MET  20           HA       MET  20   3.284  -5.549   4.050
  177   1HB   MET  20          1HB       MET  20   4.474  -6.942   2.132
  178   2HB   MET  20          2HB       MET  20   2.746  -7.175   2.487
  179   1HG   MET  20          1HG       MET  20   2.257  -6.596   0.384
  180   2HG   MET  20          2HG       MET  20   2.909  -4.980   0.704
  181   1HE   MET  20          1HE       MET  20   4.053  -3.978  -0.660
  182   2HE   MET  20          2HE       MET  20   5.491  -4.462  -1.591
  183   3HE   MET  20          3HE       MET  20   3.863  -4.788  -2.234
  184    H    ARG  21           H        ARG  21   4.661  -4.086   1.050
  185    HA   ARG  21           HA       ARG  21   7.312  -3.965   2.235
  186   1HB   ARG  21          1HB       ARG  21   6.023  -3.171  -0.366
  187   2HB   ARG  21          2HB       ARG  21   7.609  -2.485   0.062
  188   1HG   ARG  21          1HG       ARG  21   8.435  -4.827   0.485
  189   2HG   ARG  21          2HG       ARG  21   6.881  -5.437  -0.134
  190   1HD   ARG  21          1HD       ARG  21   8.912  -5.225  -1.777
  191   2HD   ARG  21          2HD       ARG  21   7.305  -4.688  -2.312
  192    HE   ARG  21           HE       ARG  21   9.026  -2.641  -1.078
  193   1HH1  ARG  21          2HH2      ARG  21   7.781  -4.180  -4.007
  194   2HH1  ARG  21          1HH2      ARG  21   8.163  -2.825  -5.046
  195   1HH2  ARG  21          2HH1      ARG  21   9.530  -0.851  -2.450
  196   2HH2  ARG  21          1HH1      ARG  21   9.160  -0.927  -4.158
  197    H    ARG  22           H        ARG  22   4.661  -1.670   1.483
  198    HA   ARG  22           HA       ARG  22   6.051   0.688   2.241
  199   1HB   ARG  22          1HB       ARG  22   3.898   0.547   0.940
  200   2HB   ARG  22          2HB       ARG  22   3.070   0.124   2.458
  201   1HG   ARG  22          1HG       ARG  22   4.643   2.383   3.078
  202   2HG   ARG  22          2HG       ARG  22   3.924   2.737   1.489
  203   1HD   ARG  22          1HD       ARG  22   2.475   3.451   3.403
  204   2HD   ARG  22          2HD       ARG  22   1.692   2.264   2.338
  205    HE   ARG  22           HE       ARG  22   2.918   0.756   4.328
  206   1HH1  ARG  22          2HH2      ARG  22   0.538   3.365   4.159
  207   2HH1  ARG  22          1HH2      ARG  22  -0.319   2.861   5.598
  208   1HH2  ARG  22          2HH1      ARG  22   1.786   0.090   6.229
  209   2HH2  ARG  22          1HH1      ARG  22   0.392   0.993   6.778
  210    H    ASN  23           H        ASN  23   6.133  -1.772   4.108
  211    HA   ASN  23           HA       ASN  23   5.755  -0.191   6.573
  212   1HB   ASN  23          1HB       ASN  23   3.835  -2.024   5.767
  213   2HB   ASN  23          2HB       ASN  23   4.865  -2.978   6.857
  214   1HD2  ASN  23          1HD2      ASN  23   5.267  -2.139   9.044
  215   2HD2  ASN  23          2HD2      ASN  23   4.064  -1.122   9.806
  216    H    GLN  24           H        GLN  24   7.888  -1.539   4.704
  217    HA   GLN  24           HA       GLN  24   9.688  -2.220   6.840
  218   1HB   GLN  24          1HB       GLN  24  10.007  -4.613   5.699
  219   2HB   GLN  24          2HB       GLN  24   8.846  -4.361   7.025
  220   1HG   GLN  24          1HG       GLN  24   7.006  -4.431   5.614
  221   2HG   GLN  24          2HG       GLN  24   7.930  -3.864   4.206
  222   1HE2  GLN  24          1HE2      GLN  24   6.934  -5.631   2.997
  223   2HE2  GLN  24          2HE2      GLN  24   7.580  -7.252   3.139
  224    H    PHE  25           H        PHE  25  10.015  -4.082   3.929
  225    HA   PHE  25           HA       PHE  25  12.446  -3.200   3.121
  226   1HB   PHE  25          1HB       PHE  25  11.416  -4.980   1.948
  227   2HB   PHE  25          2HB       PHE  25  10.022  -3.986   1.494
  228    HD1  PHE  25           1HD      PHE  25  10.780  -1.739   0.139
  229    HD2  PHE  25           2HD      PHE  25  12.902  -5.473   0.253
  230    HE1  PHE  25           1HE      PHE  25  11.877  -1.183  -2.015
  231    HE2  PHE  25           2HE      PHE  25  13.998  -4.916  -1.900
  232    HZ   PHE  25           HZ       PHE  25  13.486  -2.771  -3.034
  233    H    TRP  26           H        TRP  26   9.316  -1.607   2.370
  234    HA   TRP  26           HA       TRP  26  10.056   0.344   0.607
  235   1HB   TRP  26          1HB       TRP  26   8.203   1.522   1.312
  236   2HB   TRP  26          2HB       TRP  26   7.838  -0.105   1.902
  237    HD1  TRP  26           HD       TRP  26   7.447  -0.408   4.414
  238    HE1  TRP  26           1HE      TRP  26   7.427   1.109   6.459
  239    HE3  TRP  26           3HE      TRP  26   9.489   3.794   2.322
  240    HZ2  TRP  26           2HZ      TRP  26   8.200   3.819   7.118
  241    HZ3  TRP  26           3HZ      TRP  26   9.831   5.820   3.687
  242    HH2  TRP  26           HH       TRP  26   9.193   5.850   6.081
  243    H    VAL  27           H        VAL  27  10.673   0.327   4.140
  244    HA   VAL  27           HA       VAL  27  11.653   2.830   4.602
  245    HB   VAL  27           HB       VAL  27  13.085   1.841   6.295
  246   1HG1  VAL  27          1HG1      VAL  27  11.218  -0.252   6.688
  247   2HG1  VAL  27          2HG1      VAL  27  11.144   1.397   7.355
  248   3HG1  VAL  27          3HG1      VAL  27  10.337   1.023   5.812
  249   1HG2  VAL  27          1HG2      VAL  27  14.322   0.154   5.245
  250   2HG2  VAL  27          2HG2      VAL  27  13.167  -0.795   6.212
  251   3HG2  VAL  27          3HG2      VAL  27  12.885  -0.556   4.470
  252    H    LYS  28           H        LYS  28  13.372   0.159   2.932
  253    HA   LYS  28           HA       LYS  28  15.823   1.593   2.596
  254   1HB   LYS  28          1HB       LYS  28  14.538  -0.823   1.318
  255   2HB   LYS  28          2HB       LYS  28  16.056  -0.156   0.670
  256   1HG   LYS  28          1HG       LYS  28  17.174  -1.256   2.290
  257   2HG   LYS  28          2HG       LYS  28  16.356  -0.234   3.496
  258   1HD   LYS  28          1HD       LYS  28  14.493  -1.809   3.631
  259   2HD   LYS  28          2HD       LYS  28  15.192  -2.795   2.324
  260   1HE   LYS  28          1HE       LYS  28  16.623  -2.210   4.943
  261   2HE   LYS  28          2HE       LYS  28  15.631  -3.659   4.670
  262   1HZ   LYS  28          1HZ       LYS  28  18.180  -2.927   3.499
  263   2HZ   LYS  28          2HZ       LYS  28  17.667  -4.381   4.086
  264   3HZ   LYS  28          3HZ       LYS  28  17.144  -3.855   2.612
  265    H    VAL  29           H        VAL  29  12.825   1.316   0.685
  266    HA   VAL  29           HA       VAL  29  13.587   2.375  -1.743
  267    HB   VAL  29           HB       VAL  29  11.085   2.943  -0.107
  268   1HG1  VAL  29          1HG1      VAL  29  11.880   3.570  -2.959
  269   2HG1  VAL  29          2HG1      VAL  29  10.176   3.275  -2.538
  270   3HG1  VAL  29          3HG1      VAL  29  11.064   4.612  -1.769
  271   1HG2  VAL  29          1HG2      VAL  29  11.708   0.536  -0.711
  272   2HG2  VAL  29          2HG2      VAL  29  10.130   1.098  -1.313
  273   3HG2  VAL  29          3HG2      VAL  29  11.524   1.013  -2.416
  274    H    GLN  30           H        GLN  30  13.780   3.879   1.356
  275    HA   GLN  30           HA       GLN  30  13.900   6.587   0.162
  276   1HB   GLN  30          1HB       GLN  30  13.369   7.380   2.240
  277   2HB   GLN  30          2HB       GLN  30  12.723   5.734   2.448
  278   1HG   GLN  30          1HG       GLN  30  14.088   6.042   4.350
  279   2HG   GLN  30          2HG       GLN  30  15.117   5.116   3.236
  280   1HE2  GLN  30          1HE2      GLN  30  16.661   6.221   4.952
  281   2HE2  GLN  30          2HE2      GLN  30  17.367   7.735   4.427
  282    H    ARG  31           H        ARG  31  15.849   4.140   1.883
  283    HA   ARG  31           HA       ARG  31  18.088   4.338   2.590
  284   1HB   ARG  31          1HB       ARG  31  18.139   3.067   0.545
  285   2HB   ARG  31          2HB       ARG  31  18.025   4.544  -0.442
  286   1HG   ARG  31          1HG       ARG  31  20.237   4.922   1.299
  287   2HG   ARG  31          2HG       ARG  31  20.382   3.266   0.662
  288   1HD   ARG  31          1HD       ARG  31  19.567   4.865  -1.525
  289   2HD   ARG  31          2HD       ARG  31  20.823   5.802  -0.688
  290    HE   ARG  31           HE       ARG  31  21.774   3.164  -0.883
  291   1HH1  ARG  31          2HH2      ARG  31  20.821   5.816  -3.017
  292   2HH1  ARG  31          1HH2      ARG  31  21.917   5.358  -4.301
  293   1HH2  ARG  31          2HH1      ARG  31  23.222   2.559  -2.579
  294   2HH2  ARG  31          1HH1      ARG  31  23.286   3.502  -4.051
  295    H    GLY  32           H        GLY  32  18.749   6.297  -0.254
  296   1HA   GLY  32          1HA       GLY  32  18.691   8.854   1.049
  297   2HA   GLY  32          2HA       GLY  32  20.333   8.172   1.065
  Start of MODEL   28
    1    HA   PRO   1           HA       PRO   1 -18.304  -0.437  -0.058
    2   1HB   PRO   1          1HB       PRO   1 -20.563   0.955  -0.674
    3   2HB   PRO   1          2HB       PRO   1 -20.214  -0.649  -1.397
    4   1HG   PRO   1          1HG       PRO   1 -21.941  -0.061   1.025
    5   2HG   PRO   1          2HG       PRO   1 -22.387  -1.023  -0.421
    6   1HD   PRO   1          1HD       PRO   1 -21.462  -2.214   1.849
    7   2HD   PRO   1          2HD       PRO   1 -20.948  -2.806   0.240
    8    HA   PRO   2           HA       PRO   2 -17.954   2.313   3.454
    9   1HB   PRO   2          1HB       PRO   2 -15.893   3.814   2.492
   10   2HB   PRO   2          2HB       PRO   2 -15.663   2.110   3.004
   11   1HG   PRO   2          1HG       PRO   2 -16.156   3.135   0.193
   12   2HG   PRO   2          2HG       PRO   2 -14.837   2.048   0.740
   13   1HD   PRO   2          1HD       PRO   2 -17.129   1.062  -0.357
   14   2HD   PRO   2          2HD       PRO   2 -16.362   0.238   1.034
   15    H    LEU   3           H        LEU   3 -17.282   4.994   3.129
   16    HA   LEU   3           HA       LEU   3 -19.770   6.022   1.977
   17   1HB   LEU   3          1HB       LEU   3 -17.929   6.767   4.052
   18   2HB   LEU   3          2HB       LEU   3 -18.038   8.107   2.885
   19    HG   LEU   3           HG       LEU   3 -20.649   6.879   3.461
   20   1HD1  LEU   3          1HD1      LEU   3 -20.290   6.614   5.699
   21   2HD1  LEU   3          2HD1      LEU   3 -18.825   7.625   5.681
   22   3HD1  LEU   3          3HD1      LEU   3 -20.432   8.388   5.746
   23   1HD2  LEU   3          1HD2      LEU   3 -20.311   9.019   2.267
   24   2HD2  LEU   3          2HD2      LEU   3 -21.250   9.265   3.759
   25   3HD2  LEU   3          3HD2      LEU   3 -19.525   9.703   3.711
   26    H    SER   4           H        SER   4 -17.046   5.042   0.557
   27    HA   SER   4           HA       SER   4 -17.176   7.214  -1.466
   28   1HB   SER   4          1HB       SER   4 -14.585   5.871  -0.638
   29   2HB   SER   4          2HB       SER   4 -14.807   7.325  -1.641
   30    HG   SER   4           HG       SER   4 -15.047   8.487   0.095
   31    H    GLN   5           H        GLN   5 -14.901   5.759  -2.851
   32    HA   GLN   5           HA       GLN   5 -15.456   3.099  -3.408
   33   1HB   GLN   5          1HB       GLN   5 -17.584   4.804  -4.309
   34   2HB   GLN   5          2HB       GLN   5 -16.736   4.157  -5.734
   35   1HG   GLN   5          1HG       GLN   5 -16.952   1.873  -4.846
   36   2HG   GLN   5          2HG       GLN   5 -17.747   2.500  -3.386
   37   1HE2  GLN   5          1HE2      GLN   5 -19.892   2.170  -3.411
   38   2HE2  GLN   5          2HE2      GLN   5 -20.925   2.275  -4.821
   39    H    GLU   6           H        GLU   6 -14.913   6.290  -4.963
   40    HA   GLU   6           HA       GLU   6 -13.540   5.783  -7.203
   41   1HB   GLU   6          1HB       GLU   6 -12.708   7.608  -4.921
   42   2HB   GLU   6          2HB       GLU   6 -11.949   7.643  -6.531
   43   1HG   GLU   6          1HG       GLU   6 -14.939   7.716  -6.420
   44   2HG   GLU   6          2HG       GLU   6 -14.073   9.178  -5.900
   45    H    THR   7           H        THR   7 -11.584   6.053  -4.191
   46    HA   THR   7           HA       THR   7  -9.600   4.245  -5.370
   47    HB   THR   7           HB       THR   7  -9.168   5.033  -2.590
   48    HG1  THR   7           1HG      THR   7  -9.580   7.086  -2.737
   49   1HG2  THR   7          1HG2      THR   7  -7.066   5.785  -3.495
   50   2HG2  THR   7          2HG2      THR   7  -7.495   4.294  -4.365
   51   3HG2  THR   7          3HG2      THR   7  -7.738   5.877  -5.140
   52    H    PHE   8           H        PHE   8 -10.305   4.249  -1.915
   53    HA   PHE   8           HA       PHE   8 -10.135   2.080  -0.796
   54   1HB   PHE   8          1HB       PHE   8 -13.059   2.370  -1.457
   55   2HB   PHE   8          2HB       PHE   8 -12.297   1.929   0.081
   56    HD1  PHE   8           1HD      PHE   8 -11.908   4.828  -2.288
   57    HD2  PHE   8           2HD      PHE   8 -12.733   3.504   1.714
   58    HE1  PHE   8           1HE      PHE   8 -12.055   7.187  -1.537
   59    HE2  PHE   8           2HE      PHE   8 -12.879   5.863   2.465
   60    HZ   PHE   8           HZ       PHE   8 -12.541   7.705   0.839
   61    H    SER   9           H        SER   9 -12.619   1.863  -3.414
   62    HA   SER   9           HA       SER   9 -12.980  -0.779  -3.693
   63   1HB   SER   9          1HB       SER   9 -13.788   1.053  -5.237
   64   2HB   SER   9          2HB       SER   9 -12.213   0.967  -6.061
   65    HG   SER   9           HG       SER   9 -14.155  -0.420  -6.751
   66    H    ASP  10           H        ASP  10 -10.196   0.869  -5.307
   67    HA   ASP  10           HA       ASP  10  -8.813  -1.764  -5.334
   68   1HB   ASP  10          1HB       ASP  10  -8.517   0.766  -6.983
   69   2HB   ASP  10          2HB       ASP  10  -7.331  -0.557  -7.022
   70    H    LEU  11           H        LEU  11  -8.874   1.382  -3.888
   71    HA   LEU  11           HA       LEU  11  -6.096   1.650  -3.272
   72   1HB   LEU  11          1HB       LEU  11  -8.180   3.307  -3.109
   73   2HB   LEU  11          2HB       LEU  11  -8.223   2.702  -1.436
   74    HG   LEU  11           HG       LEU  11  -6.057   4.253  -2.854
   75   1HD1  LEU  11          1HD1      LEU  11  -7.929   4.632  -0.692
   76   2HD1  LEU  11          2HD1      LEU  11  -6.274   4.744  -0.048
   77   3HD1  LEU  11          3HD1      LEU  11  -6.781   5.802  -1.387
   78   1HD2  LEU  11          1HD2      LEU  11  -5.726   2.180  -0.669
   79   2HD2  LEU  11          2HD2      LEU  11  -4.744   2.425  -2.133
   80   3HD2  LEU  11          3HD2      LEU  11  -4.629   3.577  -0.781
   81    H    TRP  12           H        TRP  12  -8.752   0.965  -0.931
   82    HA   TRP  12           HA       TRP  12  -7.152  -0.029   1.108
   83   1HB   TRP  12          1HB       TRP  12  -9.145  -0.235   2.072
   84   2HB   TRP  12          2HB       TRP  12  -9.889   0.190   0.524
   85    HD1  TRP  12           HD       TRP  12 -11.622  -1.452  -0.243
   86    HE1  TRP  12           1HE      TRP  12 -12.143  -3.926   0.065
   87    HE3  TRP  12           3HE      TRP  12  -7.599  -2.772   2.634
   88    HZ2  TRP  12           2HZ      TRP  12 -10.964  -6.210   1.396
   89    HZ3  TRP  12           3HZ      TRP  12  -7.333  -5.102   3.401
   90    HH2  TRP  12           HH       TRP  12  -9.002  -6.829   2.793
   91    H    LYS  13           H        LYS  13  -8.418  -1.703  -1.778
   92    HA   LYS  13           HA       LYS  13  -7.580  -4.322  -0.951
   93   1HB   LYS  13          1HB       LYS  13  -9.139  -3.265  -2.971
   94   2HB   LYS  13          2HB       LYS  13  -7.682  -3.788  -3.849
   95   1HG   LYS  13          1HG       LYS  13  -8.114  -5.899  -2.111
   96   2HG   LYS  13          2HG       LYS  13  -9.773  -5.402  -2.522
   97   1HD   LYS  13          1HD       LYS  13  -7.679  -5.705  -4.686
   98   2HD   LYS  13          2HD       LYS  13  -8.554  -7.127  -4.070
   99   1HE   LYS  13          1HE       LYS  13 -10.174  -6.586  -5.551
  100   2HE   LYS  13          2HE       LYS  13 -10.577  -5.258  -4.441
  101   1HZ   LYS  13          1HZ       LYS  13  -9.622  -3.773  -5.773
  102   2HZ   LYS  13          2HZ       LYS  13  -8.437  -4.788  -6.306
  103   3HZ   LYS  13          3HZ       LYS  13  -9.954  -4.885  -6.944
  104    H    LEU  14           H        LEU  14  -6.050  -1.615  -2.665
  105    HA   LEU  14           HA       LEU  14  -3.829  -3.012  -3.729
  106   1HB   LEU  14          1HB       LEU  14  -4.686  -0.257  -3.306
  107   2HB   LEU  14          2HB       LEU  14  -2.939  -0.445  -3.023
  108    HG   LEU  14           HG       LEU  14  -3.707   0.028  -5.452
  109   1HD1  LEU  14          1HD1      LEU  14  -1.467  -0.619  -5.231
  110   2HD1  LEU  14          2HD1      LEU  14  -1.888  -2.199  -4.527
  111   3HD1  LEU  14          3HD1      LEU  14  -2.116  -1.912  -6.269
  112   1HD2  LEU  14          1HD2      LEU  14  -5.019  -2.551  -4.849
  113   2HD2  LEU  14          2HD2      LEU  14  -5.373  -1.363  -6.127
  114   3HD2  LEU  14          3HD2      LEU  14  -4.077  -2.560  -6.359
  115    H    LEU  15           H        LEU  15  -4.314  -1.358  -0.573
  116    HA   LEU  15           HA       LEU  15  -1.677  -1.909   0.394
  117   1HB   LEU  15          1HB       LEU  15  -4.290  -0.977   1.531
  118   2HB   LEU  15          2HB       LEU  15  -3.055  -1.582   2.661
  119    HG   LEU  15           HG       LEU  15  -2.439   0.474   0.507
  120   1HD1  LEU  15          1HD1      LEU  15  -2.535   1.539   3.206
  121   2HD1  LEU  15          2HD1      LEU  15  -3.390   2.098   1.749
  122   3HD1  LEU  15          3HD1      LEU  15  -4.110   0.832   2.772
  123   1HD2  LEU  15          1HD2      LEU  15  -0.485   0.910   1.928
  124   2HD2  LEU  15          2HD2      LEU  15  -1.069  -0.267   3.128
  125   3HD2  LEU  15          3HD2      LEU  15  -0.556  -0.820   1.516
  126    H    LYS  16           H        LYS  16  -4.342  -3.931  -0.234
  127    HA   LYS  16           HA       LYS  16  -3.991  -5.781   1.958
  128   1HB   LYS  16          1HB       LYS  16  -5.900  -5.330  -0.004
  129   2HB   LYS  16          2HB       LYS  16  -5.136  -6.849  -0.532
  130   1HG   LYS  16          1HG       LYS  16  -5.382  -7.621   1.920
  131   2HG   LYS  16          2HG       LYS  16  -6.483  -6.237   2.120
  132   1HD   LYS  16          1HD       LYS  16  -8.128  -7.548   1.298
  133   2HD   LYS  16          2HD       LYS  16  -7.300  -7.472  -0.275
  134   1HE   LYS  16          1HE       LYS  16  -7.050  -9.710  -0.099
  135   2HE   LYS  16          2HE       LYS  16  -5.826  -9.364   1.143
  136   1HZ   LYS  16          1HZ       LYS  16  -7.132 -10.258   2.624
  137   2HZ   LYS  16          2HZ       LYS  16  -8.369  -9.229   2.262
  138   3HZ   LYS  16          3HZ       LYS  16  -8.224 -10.660   1.455
  139    H    LYS  17           H        LYS  17  -1.731  -4.903  -0.087
  140    HA   LYS  17           HA       LYS  17  -0.336  -7.421   0.042
  141   1HB   LYS  17          1HB       LYS  17  -1.183  -8.276  -1.881
  142   2HB   LYS  17          2HB       LYS  17  -1.829  -6.704  -2.408
  143   1HG   LYS  17          1HG       LYS  17   1.125  -7.447  -2.485
  144   2HG   LYS  17          2HG       LYS  17   0.024  -7.593  -3.876
  145   1HD   LYS  17          1HD       LYS  17  -0.428  -5.002  -2.886
  146   2HD   LYS  17          2HD       LYS  17   1.336  -5.218  -2.787
  147   1HE   LYS  17          1HE       LYS  17   0.568  -6.355  -5.257
  148   2HE   LYS  17          2HE       LYS  17  -0.347  -4.838  -5.130
  149   1HZ   LYS  17          1HZ       LYS  17   2.366  -4.599  -4.332
  150   2HZ   LYS  17          2HZ       LYS  17   2.201  -5.062  -5.907
  151   3HZ   LYS  17          3HZ       LYS  17   1.484  -3.675  -5.376
  152    H    TRP  18           H        TRP  18  -0.665  -4.128  -1.271
  153    HA   TRP  18           HA       TRP  18   2.164  -3.837  -1.810
  154   1HB   TRP  18          1HB       TRP  18  -0.088  -2.545  -2.601
  155   2HB   TRP  18          2HB       TRP  18   0.467  -1.451  -1.327
  156    HD1  TRP  18           HD       TRP  18   0.848  -2.097  -4.893
  157    HE1  TRP  18           1HE      TRP  18   2.825  -0.849  -5.902
  158    HE3  TRP  18           3HE      TRP  18   3.233  -0.738  -0.573
  159    HZ2  TRP  18           2HZ      TRP  18   5.164   0.570  -4.958
  160    HZ3  TRP  18           3HZ      TRP  18   5.330   0.560  -0.668
  161    HH2  TRP  18           HH       TRP  18   6.307   1.220  -2.847
  162    H    LYS  19           H        LYS  19  -0.072  -2.970   0.847
  163    HA   LYS  19           HA       LYS  19   1.344  -1.303   2.429
  164   1HB   LYS  19          1HB       LYS  19  -0.795  -2.332   3.075
  165   2HB   LYS  19          2HB       LYS  19   0.024  -3.890   3.339
  166   1HG   LYS  19          1HG       LYS  19   0.923  -3.223   5.329
  167   2HG   LYS  19          2HG       LYS  19   1.248  -1.575   4.741
  168   1HD   LYS  19          1HD       LYS  19  -0.610  -0.822   5.769
  169   2HD   LYS  19          2HD       LYS  19  -1.604  -1.977   4.849
  170   1HE   LYS  19          1HE       LYS  19  -0.027  -2.748   7.330
  171   2HE   LYS  19          2HE       LYS  19  -1.717  -2.201   7.388
  172   1HZ   LYS  19          1HZ       LYS  19  -2.118  -4.341   7.113
  173   2HZ   LYS  19          2HZ       LYS  19  -1.805  -4.065   5.518
  174   3HZ   LYS  19          3HZ       LYS  19  -0.630  -4.688   6.493
  175    H    MET  20           H        MET  20   1.981  -4.832   2.134
  176    HA   MET  20           HA       MET  20   3.937  -5.249   3.975
  177   1HB   MET  20          1HB       MET  20   3.794  -7.156   2.776
  178   2HB   MET  20          2HB       MET  20   3.305  -6.287   1.301
  179   1HG   MET  20          1HG       MET  20   6.000  -5.581   1.758
  180   2HG   MET  20          2HG       MET  20   5.911  -7.324   2.059
  181   1HE   MET  20          1HE       MET  20   5.122  -4.535  -0.968
  182   2HE   MET  20          2HE       MET  20   3.963  -5.659  -1.718
  183   3HE   MET  20          3HE       MET  20   3.738  -5.144  -0.029
  184    H    ARG  21           H        ARG  21   4.389  -3.631   0.797
  185    HA   ARG  21           HA       ARG  21   7.178  -3.010   1.479
  186   1HB   ARG  21          1HB       ARG  21   5.396  -2.686  -0.936
  187   2HB   ARG  21          2HB       ARG  21   6.917  -1.769  -0.814
  188   1HG   ARG  21          1HG       ARG  21   8.238  -3.700  -0.837
  189   2HG   ARG  21          2HG       ARG  21   6.913  -4.736  -0.252
  190   1HD   ARG  21          1HD       ARG  21   5.789  -3.948  -2.551
  191   2HD   ARG  21          2HD       ARG  21   7.489  -3.739  -3.024
  192    HE   ARG  21           HE       ARG  21   7.393  -6.255  -1.867
  193   1HH1  ARG  21          2HH2      ARG  21   5.721  -4.587  -4.499
  194   2HH1  ARG  21          1HH2      ARG  21   5.457  -6.041  -5.435
  195   1HH2  ARG  21          2HH1      ARG  21   7.043  -8.175  -3.105
  196   2HH2  ARG  21          1HH1      ARG  21   6.211  -8.086  -4.640
  197    H    ARG  22           H        ARG  22   4.039  -1.347   0.998
  198    HA   ARG  22           HA       ARG  22   5.121   1.281   1.472
  199   1HB   ARG  22          1HB       ARG  22   3.022   0.781   0.193
  200   2HB   ARG  22          2HB       ARG  22   2.254   0.294   1.723
  201   1HG   ARG  22          1HG       ARG  22   1.685   2.475   1.958
  202   2HG   ARG  22          2HG       ARG  22   3.401   2.760   2.335
  203   1HD   ARG  22          1HD       ARG  22   2.029   2.979  -0.369
  204   2HD   ARG  22          2HD       ARG  22   2.793   4.281   0.566
  205    HE   ARG  22           HE       ARG  22   4.684   2.193  -0.002
  206   1HH1  ARG  22          2HH2      ARG  22   2.933   4.901  -1.452
  207   2HH1  ARG  22          1HH2      ARG  22   4.151   5.215  -2.669
  208   1HH2  ARG  22          2HH1      ARG  22   6.292   2.607  -1.610
  209   2HH2  ARG  22          1HH1      ARG  22   6.065   3.907  -2.759
  210    H    ASN  23           H        ASN  23   5.724  -0.883   3.481
  211    HA   ASN  23           HA       ASN  23   5.266   0.744   5.835
  212   1HB   ASN  23          1HB       ASN  23   3.280  -1.147   5.182
  213   2HB   ASN  23          2HB       ASN  23   4.252  -1.905   6.462
  214   1HD2  ASN  23          1HD2      ASN  23   2.854   1.325   5.635
  215   2HD2  ASN  23          2HD2      ASN  23   2.312   1.693   7.258
  216    H    GLN  24           H        GLN  24   7.402  -0.577   4.136
  217    HA   GLN  24           HA       GLN  24   9.151  -1.303   6.253
  218   1HB   GLN  24          1HB       GLN  24   9.090  -3.577   6.347
  219   2HB   GLN  24          2HB       GLN  24   7.422  -3.358   5.766
  220   1HG   GLN  24          1HG       GLN  24   8.225  -3.563   3.426
  221   2HG   GLN  24          2HG       GLN  24   9.879  -3.815   4.024
  222   1HE2  GLN  24          1HE2      GLN  24  10.417  -5.910   3.761
  223   2HE2  GLN  24          2HE2      GLN  24   9.401  -7.277   4.166
  224    H    PHE  25           H        PHE  25   8.288  -1.800   2.806
  225    HA   PHE  25           HA       PHE  25  11.114  -1.761   2.031
  226   1HB   PHE  25          1HB       PHE  25   9.658  -3.245   0.833
  227   2HB   PHE  25          2HB       PHE  25   8.495  -1.946   0.516
  228    HD1  PHE  25           1HD      PHE  25   9.639   0.185  -0.720
  229    HD2  PHE  25           2HD      PHE  25  11.000  -3.883  -0.933
  230    HE1  PHE  25           1HE      PHE  25  10.772   0.677  -2.870
  231    HE2  PHE  25           2HE      PHE  25  12.134  -3.391  -3.083
  232    HZ   PHE  25           HZ       PHE  25  12.020  -1.111  -4.052
  233    H    TRP  26           H        TRP  26   8.173   0.232   1.367
  234    HA   TRP  26           HA       TRP  26   9.235   2.275  -0.095
  235   1HB   TRP  26          1HB       TRP  26   7.470   3.602   0.656
  236   2HB   TRP  26          2HB       TRP  26   6.877   1.949   0.874
  237    HD1  TRP  26           HD       TRP  26   5.800   1.488   3.099
  238    HE1  TRP  26           1HE      TRP  26   5.795   2.510   5.432
  239    HE3  TRP  26           3HE      TRP  26   9.325   5.131   2.392
  240    HZ2  TRP  26           2HZ      TRP  26   7.151   4.649   6.832
  241    HZ3  TRP  26           3HZ      TRP  26   9.941   6.639   4.245
  242    HH2  TRP  26           HH       TRP  26   8.866   6.413   6.466
  243    H    VAL  27           H        VAL  27   9.539   1.828   3.449
  244    HA   VAL  27           HA       VAL  27  10.673   4.155   4.284
  245    HB   VAL  27           HB       VAL  27  11.675   2.927   6.017
  246   1HG1  VAL  27          1HG1      VAL  27   9.799   0.778   5.034
  247   2HG1  VAL  27          2HG1      VAL  27   9.991   1.446   6.673
  248   3HG1  VAL  27          3HG1      VAL  27   9.154   2.392   5.419
  249   1HG2  VAL  27          1HG2      VAL  27  11.990   0.705   3.958
  250   2HG2  VAL  27          2HG2      VAL  27  13.283   1.656   4.727
  251   3HG2  VAL  27          3HG2      VAL  27  12.333   0.502   5.693
  252    H    LYS  28           H        LYS  28  12.364   1.542   2.483
  253    HA   LYS  28           HA       LYS  28  14.901   2.858   2.460
  254   1HB   LYS  28          1HB       LYS  28  13.604   0.636   0.877
  255   2HB   LYS  28          2HB       LYS  28  15.203   1.265   0.413
  256   1HG   LYS  28          1HG       LYS  28  16.162   0.671   2.513
  257   2HG   LYS  28          2HG       LYS  28  14.566   0.421   3.260
  258   1HD   LYS  28          1HD       LYS  28  15.601  -1.234   0.925
  259   2HD   LYS  28          2HD       LYS  28  15.798  -1.712   2.628
  260   1HE   LYS  28          1HE       LYS  28  13.758  -2.663   2.472
  261   2HE   LYS  28          2HE       LYS  28  13.100  -1.012   2.437
  262   1HZ   LYS  28          1HZ       LYS  28  14.054  -1.889  -0.082
  263   2HZ   LYS  28          2HZ       LYS  28  12.847  -2.849   0.501
  264   3HZ   LYS  28          3HZ       LYS  28  12.600  -1.228   0.326
  265    H    VAL  29           H        VAL  29  12.038   2.951   0.346
  266    HA   VAL  29           HA       VAL  29  13.035   4.142  -1.934
  267    HB   VAL  29           HB       VAL  29  10.467   4.706  -0.406
  268   1HG1  VAL  29          1HG1      VAL  29  11.281   5.436  -3.252
  269   2HG1  VAL  29          2HG1      VAL  29   9.640   5.596  -2.581
  270   3HG1  VAL  29          3HG1      VAL  29  10.970   6.577  -1.921
  271   1HG2  VAL  29          1HG2      VAL  29  10.961   2.361  -1.260
  272   2HG2  VAL  29          2HG2      VAL  29   9.493   3.110  -1.932
  273   3HG2  VAL  29          3HG2      VAL  29  10.983   3.044  -2.903
  274    H    GLN  30           H        GLN  30  13.128   5.367   1.286
  275    HA   GLN  30           HA       GLN  30  13.500   8.150   0.342
  276   1HB   GLN  30          1HB       GLN  30  12.869   8.803   2.437
  277   2HB   GLN  30          2HB       GLN  30  12.131   7.184   2.479
  278   1HG   GLN  30          1HG       GLN  30  14.319   6.318   3.425
  279   2HG   GLN  30          2HG       GLN  30  14.848   8.008   3.570
  280   1HE2  GLN  30          1HE2      GLN  30  13.464   5.464   5.228
  281   2HE2  GLN  30          2HE2      GLN  30  12.621   6.353   6.478
  282    H    ARG  31           H        ARG  31  15.157   5.473   2.046
  283    HA   ARG  31           HA       ARG  31  17.354   5.448   2.877
  284   1HB   ARG  31          1HB       ARG  31  17.455   4.333   0.741
  285   2HB   ARG  31          2HB       ARG  31  17.521   5.885  -0.127
  286   1HG   ARG  31          1HG       ARG  31  19.761   5.974   0.113
  287   2HG   ARG  31          2HG       ARG  31  19.614   5.789   1.878
  288   1HD   ARG  31          1HD       ARG  31  19.040   3.243   0.986
  289   2HD   ARG  31          2HD       ARG  31  20.253   3.778  -0.196
  290    HE   ARG  31           HE       ARG  31  20.949   4.289   2.603
  291   1HH1  ARG  31          2HH2      ARG  31  21.094   2.072  -0.147
  292   2HH1  ARG  31          1HH2      ARG  31  22.498   1.213   0.444
  293   1HH2  ARG  31          2HH1      ARG  31  22.804   3.154   3.384
  294   2HH2  ARG  31          1HH1      ARG  31  23.473   1.830   2.457
  295    H    GLY  32           H        GLY  32  17.423   7.347   4.204
  296   1HA   GLY  32          1HA       GLY  32  18.461   9.798   2.904
  297   2HA   GLY  32          2HA       GLY  32  17.824   9.661   4.559
  Start of MODEL   29
    1    HA   PRO   1           HA       PRO   1  -7.284   9.069   1.335
    2   1HB   PRO   1          1HB       PRO   1  -7.624  11.171   3.034
    3   2HB   PRO   1          2HB       PRO   1  -6.141  10.162   3.063
    4   1HG   PRO   1          1HG       PRO   1  -6.542  12.798   1.621
    5   2HG   PRO   1          2HG       PRO   1  -5.217  12.367   2.749
    6   1HD   PRO   1          1HD       PRO   1  -4.912  12.150   0.050
    7   2HD   PRO   1          2HD       PRO   1  -4.236  10.903   1.142
    8    HA   PRO   2           HA       PRO   2 -10.311  11.249  -1.327
    9   1HB   PRO   2          1HB       PRO   2 -11.838   9.062  -1.881
   10   2HB   PRO   2          2HB       PRO   2 -10.256   9.337  -2.680
   11   1HG   PRO   2          1HG       PRO   2 -10.810   7.630  -0.237
   12   2HG   PRO   2          2HG       PRO   2  -9.941   7.145  -1.729
   13   1HD   PRO   2          1HD       PRO   2  -8.598   8.000   0.483
   14   2HD   PRO   2          2HD       PRO   2  -8.060   8.493  -1.151
   15    H    LEU   3           H        LEU   3 -12.969  10.361  -1.124
   16    HA   LEU   3           HA       LEU   3 -13.598  11.289   1.581
   17   1HB   LEU   3          1HB       LEU   3 -15.159  10.758  -0.955
   18   2HB   LEU   3          2HB       LEU   3 -15.991  11.026   0.596
   19    HG   LEU   3           HG       LEU   3 -14.337  13.104   0.746
   20   1HD1  LEU   3          1HD1      LEU   3 -13.982  12.085  -1.971
   21   2HD1  LEU   3          2HD1      LEU   3 -14.579  13.762  -1.978
   22   3HD1  LEU   3          3HD1      LEU   3 -13.077  13.356  -1.113
   23   1HD2  LEU   3          1HD2      LEU   3 -16.130  14.460   0.043
   24   2HD2  LEU   3          2HD2      LEU   3 -16.613  13.323  -1.238
   25   3HD2  LEU   3          3HD2      LEU   3 -16.934  12.931   0.468
   26    H    SER   4           H        SER   4 -12.545   8.434   0.621
   27    HA   SER   4           HA       SER   4 -12.659   6.433   1.808
   28   1HB   SER   4          1HB       SER   4 -15.407   7.039   2.860
   29   2HB   SER   4          2HB       SER   4 -14.063   6.160   3.627
   30    HG   SER   4           HG       SER   4 -12.988   8.157   3.844
   31    H    GLN   5           H        GLN   5 -13.370   4.450   1.065
   32    HA   GLN   5           HA       GLN   5 -14.805   2.954  -0.013
   33   1HB   GLN   5          1HB       GLN   5 -16.596   4.880   0.484
   34   2HB   GLN   5          2HB       GLN   5 -16.430   5.135  -1.270
   35   1HG   GLN   5          1HG       GLN   5 -16.628   2.461  -1.285
   36   2HG   GLN   5          2HG       GLN   5 -17.497   2.769   0.234
   37   1HE2  GLN   5          1HE2      GLN   5 -19.337   1.827  -1.044
   38   2HE2  GLN   5          2HE2      GLN   5 -20.279   2.914  -2.043
   39    H    GLU   6           H        GLU   6 -13.759   6.003  -1.526
   40    HA   GLU   6           HA       GLU   6 -13.801   5.278  -4.216
   41   1HB   GLU   6          1HB       GLU   6 -13.000   7.453  -2.865
   42   2HB   GLU   6          2HB       GLU   6 -11.402   6.735  -3.177
   43   1HG   GLU   6          1HG       GLU   6 -13.374   6.855  -5.439
   44   2HG   GLU   6          2HG       GLU   6 -12.571   8.362  -4.946
   45    H    THR   7           H        THR   7 -11.084   4.832  -1.876
   46    HA   THR   7           HA       THR   7  -9.780   3.018  -3.796
   47    HB   THR   7           HB       THR   7  -8.531   3.267  -1.169
   48    HG1  THR   7           1HG      THR   7  -8.850   5.303  -0.874
   49   1HG2  THR   7          1HG2      THR   7  -7.677   4.289  -3.908
   50   2HG2  THR   7          2HG2      THR   7  -6.626   3.891  -2.527
   51   3HG2  THR   7          3HG2      THR   7  -7.497   2.597  -3.385
   52    H    PHE   8           H        PHE   8  -9.569   2.552  -0.311
   53    HA   PHE   8           HA       PHE   8  -9.543   0.257   0.490
   54   1HB   PHE   8          1HB       PHE   8 -12.457   1.010   0.590
   55   2HB   PHE   8          2HB       PHE   8 -11.451   0.256   1.839
   56    HD1  PHE   8           1HD      PHE   8 -11.131   3.396  -0.211
   57    HD2  PHE   8           2HD      PHE   8 -11.278   1.619   3.697
   58    HE1  PHE   8           1HE      PHE   8 -10.736   5.619   0.814
   59    HE2  PHE   8           2HE      PHE   8 -10.882   3.842   4.722
   60    HZ   PHE   8           HZ       PHE   8 -10.611   5.842   3.281
   61    H    SER   9           H        SER   9 -12.574   0.729  -1.422
   62    HA   SER   9           HA       SER   9 -13.375  -1.779  -1.916
   63   1HB   SER   9          1HB       SER   9 -14.257   0.335  -2.972
   64   2HB   SER   9          2HB       SER   9 -12.941   0.221  -4.165
   65    HG   SER   9           HG       SER   9 -14.357  -2.107  -3.785
   66    H    ASP  10           H        ASP  10 -10.864  -0.237  -4.009
   67    HA   ASP  10           HA       ASP  10  -9.936  -2.972  -4.708
   68   1HB   ASP  10          1HB       ASP  10  -9.765  -0.262  -6.033
   69   2HB   ASP  10          2HB       ASP  10  -8.649  -1.570  -6.485
   70    H    LEU  11           H        LEU  11  -9.166  -0.126  -2.887
   71    HA   LEU  11           HA       LEU  11  -6.311  -0.328  -2.950
   72   1HB   LEU  11          1HB       LEU  11  -8.023   1.540  -2.076
   73   2HB   LEU  11          2HB       LEU  11  -7.737   0.707  -0.529
   74    HG   LEU  11           HG       LEU  11  -5.778   2.161  -2.309
   75   1HD1  LEU  11          1HD1      LEU  11  -5.205   2.311   0.478
   76   2HD1  LEU  11          2HD1      LEU  11  -5.890   3.581  -0.563
   77   3HD1  LEU  11          3HD1      LEU  11  -6.970   2.466   0.307
   78   1HD2  LEU  11          1HD2      LEU  11  -5.198  -0.137  -0.402
   79   2HD2  LEU  11          2HD2      LEU  11  -4.721   0.012  -2.111
   80   3HD2  LEU  11          3HD2      LEU  11  -3.968   1.056  -0.882
   81    H    TRP  12           H        TRP  12  -8.502  -1.041  -0.172
   82    HA   TRP  12           HA       TRP  12  -6.678  -2.519   1.317
   83   1HB   TRP  12          1HB       TRP  12  -8.435  -2.618   2.676
   84   2HB   TRP  12          2HB       TRP  12  -9.413  -1.882   1.399
   85    HD1  TRP  12           HD       TRP  12 -11.496  -3.172   0.864
   86    HE1  TRP  12           1HE      TRP  12 -12.304  -5.584   0.984
   87    HE3  TRP  12           3HE      TRP  12  -7.199  -5.379   2.557
   88    HZ2  TRP  12           2HZ      TRP  12 -11.226  -8.166   1.725
   89    HZ3  TRP  12           3HZ      TRP  12  -7.128  -7.813   2.957
   90    HH2  TRP  12           HH       TRP  12  -9.127  -9.217   2.548
   91    H    LYS  13           H        LYS  13  -8.764  -3.559  -1.387
   92    HA   LYS  13           HA       LYS  13  -8.151  -6.357  -1.102
   93   1HB   LYS  13          1HB       LYS  13  -9.927  -4.777  -2.585
   94   2HB   LYS  13          2HB       LYS  13  -8.848  -5.497  -3.804
   95   1HG   LYS  13          1HG       LYS  13  -9.802  -7.307  -1.625
   96   2HG   LYS  13          2HG       LYS  13 -11.016  -6.789  -2.819
   97   1HD   LYS  13          1HD       LYS  13  -9.391  -7.482  -4.637
   98   2HD   LYS  13          2HD       LYS  13  -8.365  -8.185  -3.364
   99   1HE   LYS  13          1HE       LYS  13  -9.997  -9.792  -2.773
  100   2HE   LYS  13          2HE       LYS  13 -11.298  -8.902  -3.593
  101   1HZ   LYS  13          1HZ       LYS  13 -10.479  -9.531  -5.645
  102   2HZ   LYS  13          2HZ       LYS  13  -9.029 -10.040  -5.046
  103   3HZ   LYS  13          3HZ       LYS  13 -10.399 -10.906  -4.738
  104    H    LEU  14           H        LEU  14  -6.659  -3.594  -2.730
  105    HA   LEU  14           HA       LEU  14  -4.903  -5.218  -4.371
  106   1HB   LEU  14          1HB       LEU  14  -5.240  -2.300  -3.723
  107   2HB   LEU  14          2HB       LEU  14  -3.715  -2.850  -4.458
  108    HG   LEU  14           HG       LEU  14  -6.172  -2.326  -5.777
  109   1HD1  LEU  14          1HD1      LEU  14  -4.856  -3.239  -7.755
  110   2HD1  LEU  14          2HD1      LEU  14  -4.017  -1.990  -6.804
  111   3HD1  LEU  14          3HD1      LEU  14  -3.586  -3.705  -6.598
  112   1HD2  LEU  14          1HD2      LEU  14  -6.945  -4.391  -6.608
  113   2HD2  LEU  14          2HD2      LEU  14  -5.464  -5.249  -6.119
  114   3HD2  LEU  14          3HD2      LEU  14  -6.646  -4.740  -4.889
  115    H    LEU  15           H        LEU  15  -4.661  -3.424  -1.276
  116    HA   LEU  15           HA       LEU  15  -1.885  -3.825  -0.868
  117   1HB   LEU  15          1HB       LEU  15  -4.159  -2.785   0.568
  118   2HB   LEU  15          2HB       LEU  15  -3.224  -3.852   1.644
  119    HG   LEU  15           HG       LEU  15  -1.141  -2.594   0.678
  120   1HD1  LEU  15          1HD1      LEU  15  -2.918  -1.437  -0.975
  121   2HD1  LEU  15          2HD1      LEU  15  -3.033  -0.287   0.378
  122   3HD1  LEU  15          3HD1      LEU  15  -1.464  -0.581  -0.409
  123   1HD2  LEU  15          1HD2      LEU  15  -2.923  -0.857   2.390
  124   2HD2  LEU  15          2HD2      LEU  15  -2.366  -2.431   3.005
  125   3HD2  LEU  15          3HD2      LEU  15  -1.181  -1.184   2.549
  126    H    LYS  16           H        LYS  16  -4.543  -6.026  -0.834
  127    HA   LYS  16           HA       LYS  16  -3.568  -7.896   1.096
  128   1HB   LYS  16          1HB       LYS  16  -5.852  -7.593  -0.419
  129   2HB   LYS  16          2HB       LYS  16  -5.070  -8.990  -1.198
  130   1HG   LYS  16          1HG       LYS  16  -5.345  -8.797   1.818
  131   2HG   LYS  16          2HG       LYS  16  -6.643  -9.470   0.804
  132   1HD   LYS  16          1HD       LYS  16  -4.872 -11.010  -0.215
  133   2HD   LYS  16          2HD       LYS  16  -3.784 -10.469   1.086
  134   1HE   LYS  16          1HE       LYS  16  -5.748 -11.103   2.680
  135   2HE   LYS  16          2HE       LYS  16  -6.372 -12.025   1.295
  136   1HZ   LYS  16          1HZ       LYS  16  -5.011 -13.374   2.695
  137   2HZ   LYS  16          2HZ       LYS  16  -4.286 -13.191   1.225
  138   3HZ   LYS  16          3HZ       LYS  16  -3.729 -12.349   2.529
  139    H    LYS  17           H        LYS  17  -1.788  -6.779  -1.258
  140    HA   LYS  17           HA       LYS  17  -0.178  -9.147  -1.481
  141   1HB   LYS  17          1HB       LYS  17  -1.175 -10.086  -3.269
  142   2HB   LYS  17          2HB       LYS  17  -2.221  -8.668  -3.520
  143   1HG   LYS  17          1HG       LYS  17   0.696  -8.887  -4.379
  144   2HG   LYS  17          2HG       LYS  17  -0.711  -9.040  -5.457
  145   1HD   LYS  17          1HD       LYS  17  -1.093  -6.644  -3.975
  146   2HD   LYS  17          2HD       LYS  17   0.604  -6.639  -4.510
  147   1HE   LYS  17          1HE       LYS  17   0.041  -6.423  -6.701
  148   2HE   LYS  17          2HE       LYS  17  -1.315  -7.563  -6.562
  149   1HZ   LYS  17          1HZ       LYS  17  -2.697  -5.898  -6.355
  150   2HZ   LYS  17          2HZ       LYS  17  -1.813  -5.172  -5.167
  151   3HZ   LYS  17          3HZ       LYS  17  -1.473  -4.866  -6.752
  152    H    TRP  18           H        TRP  18  -0.979  -5.825  -2.106
  153    HA   TRP  18           HA       TRP  18   1.684  -5.291  -3.275
  154   1HB   TRP  18          1HB       TRP  18  -0.838  -4.254  -3.727
  155   2HB   TRP  18          2HB       TRP  18  -0.098  -3.029  -2.687
  156    HD1  TRP  18           HD       TRP  18  -0.340  -4.084  -6.197
  157    HE1  TRP  18           1HE      TRP  18   1.292  -2.819  -7.689
  158    HE3  TRP  18           3HE      TRP  18   2.614  -1.997  -2.575
  159    HZ2  TRP  18           2HZ      TRP  18   3.603  -1.107  -7.361
  160    HZ3  TRP  18           3HZ      TRP  18   4.518  -0.558  -3.202
  161    HH2  TRP  18           HH       TRP  18   5.025  -0.104  -5.585
  162    H    LYS  19           H        LYS  19  -0.269  -4.782  -0.349
  163    HA   LYS  19           HA       LYS  19   1.297  -2.857   0.947
  164   1HB   LYS  19          1HB       LYS  19   0.041  -3.379   2.796
  165   2HB   LYS  19          2HB       LYS  19  -0.943  -4.213   1.569
  166   1HG   LYS  19          1HG       LYS  19   0.262  -6.319   2.021
  167   2HG   LYS  19          2HG       LYS  19   1.275  -5.490   3.227
  168   1HD   LYS  19          1HD       LYS  19  -0.987  -4.819   4.338
  169   2HD   LYS  19          2HD       LYS  19  -1.686  -6.117   3.341
  170   1HE   LYS  19          1HE       LYS  19   0.810  -6.722   4.892
  171   2HE   LYS  19          2HE       LYS  19  -0.714  -6.586   5.795
  172   1HZ   LYS  19          1HZ       LYS  19  -1.297  -8.100   3.628
  173   2HZ   LYS  19          2HZ       LYS  19   0.182  -8.650   4.107
  174   3HZ   LYS  19          3HZ       LYS  19  -1.077  -8.637   5.172
  175    H    MET  20           H        MET  20   1.642  -6.439   0.910
  176    HA   MET  20           HA       MET  20   3.586  -6.980   2.668
  177   1HB   MET  20          1HB       MET  20   4.657  -8.426   0.794
  178   2HB   MET  20          2HB       MET  20   2.954  -8.726   1.218
  179   1HG   MET  20          1HG       MET  20   2.589  -8.500  -1.003
  180   2HG   MET  20          2HG       MET  20   2.675  -6.765  -0.655
  181   1HE   MET  20          1HE       MET  20   4.723  -5.965  -3.612
  182   2HE   MET  20          2HE       MET  20   3.053  -6.478  -3.270
  183   3HE   MET  20          3HE       MET  20   3.857  -5.299  -2.207
  184    H    ARG  21           H        ARG  21   4.076  -5.135  -0.353
  185    HA   ARG  21           HA       ARG  21   6.892  -4.651   0.450
  186   1HB   ARG  21          1HB       ARG  21   5.963  -5.414  -1.943
  187   2HB   ARG  21          2HB       ARG  21   5.741  -3.658  -2.131
  188   1HG   ARG  21          1HG       ARG  21   8.008  -3.221  -2.043
  189   2HG   ARG  21          2HG       ARG  21   8.343  -4.612  -0.984
  190   1HD   ARG  21          1HD       ARG  21   9.038  -5.725  -2.815
  191   2HD   ARG  21          2HD       ARG  21   7.346  -5.740  -3.359
  192    HE   ARG  21           HE       ARG  21   8.668  -3.256  -4.020
  193   1HH1  ARG  21          2HH2      ARG  21   8.274  -6.643  -4.954
  194   2HH1  ARG  21          1HH2      ARG  21   8.639  -6.362  -6.642
  195   1HH2  ARG  21          2HH1      ARG  21   9.150  -2.885  -6.250
  196   2HH2  ARG  21          1HH1      ARG  21   9.138  -4.220  -7.380
  197    H    ARG  22           H        ARG  22   3.753  -3.100  -0.131
  198    HA   ARG  22           HA       ARG  22   4.852  -0.413   0.188
  199   1HB   ARG  22          1HB       ARG  22   2.654  -1.425  -1.078
  200   2HB   ARG  22          2HB       ARG  22   1.931  -0.872   0.452
  201   1HG   ARG  22          1HG       ARG  22   3.872   0.946  -0.954
  202   2HG   ARG  22          2HG       ARG  22   2.224   0.795  -1.610
  203   1HD   ARG  22          1HD       ARG  22   1.949   2.537  -0.086
  204   2HD   ARG  22          2HD       ARG  22   1.504   1.130   0.904
  205    HE   ARG  22           HE       ARG  22   4.146   1.306   1.425
  206   1HH1  ARG  22          2HH2      ARG  22   1.600   3.756   1.294
  207   2HH1  ARG  22          1HH2      ARG  22   2.346   4.791   2.492
  208   1HH2  ARG  22          2HH1      ARG  22   5.131   2.674   3.007
  209   2HH2  ARG  22          1HH1      ARG  22   4.358   4.174   3.468
  210    H    ASN  23           H        ASN  23   5.204  -2.479   2.351
  211    HA   ASN  23           HA       ASN  23   4.238  -0.765   4.544
  212   1HB   ASN  23          1HB       ASN  23   2.813  -3.042   3.822
  213   2HB   ASN  23          2HB       ASN  23   3.863  -3.612   5.137
  214   1HD2  ASN  23          1HD2      ASN  23   3.692  -2.667   7.236
  215   2HD2  ASN  23          2HD2      ASN  23   2.279  -1.745   7.705
  216    H    GLN  24           H        GLN  24   6.790  -1.791   3.076
  217    HA   GLN  24           HA       GLN  24   8.257  -2.350   5.588
  218   1HB   GLN  24          1HB       GLN  24   9.648  -3.961   3.999
  219   2HB   GLN  24          2HB       GLN  24   8.195  -4.543   4.846
  220   1HG   GLN  24          1HG       GLN  24   6.827  -4.134   2.865
  221   2HG   GLN  24          2HG       GLN  24   8.213  -3.412   2.019
  222   1HE2  GLN  24          1HE2      GLN  24   9.448  -4.712   0.767
  223   2HE2  GLN  24          2HE2      GLN  24   9.444  -6.461   0.820
  224    H    PHE  25           H        PHE  25   9.876  -2.831   2.573
  225    HA   PHE  25           HA       PHE  25  11.695  -0.697   3.034
  226   1HB   PHE  25          1HB       PHE  25  12.484  -2.498   1.759
  227   2HB   PHE  25          2HB       PHE  25  11.054  -2.511   0.713
  228    HD1  PHE  25           1HD      PHE  25  10.696  -0.217  -0.641
  229    HD2  PHE  25           2HD      PHE  25  14.448  -1.654   0.878
  230    HE1  PHE  25           1HE      PHE  25  11.901   1.168  -2.308
  231    HE2  PHE  25           2HE      PHE  25  15.653  -0.270  -0.790
  232    HZ   PHE  25           HZ       PHE  25  14.380   1.142  -2.382
  233    H    TRP  26           H        TRP  26   8.478  -0.602   2.042
  234    HA   TRP  26           HA       TRP  26   8.710   1.542   0.097
  235   1HB   TRP  26          1HB       TRP  26   6.649  -0.154   1.265
  236   2HB   TRP  26          2HB       TRP  26   6.124   1.533   1.170
  237    HD1  TRP  26           HD       TRP  26   7.084  -1.442  -1.002
  238    HE1  TRP  26           1HE      TRP  26   6.314  -1.061  -3.400
  239    HE3  TRP  26           3HE      TRP  26   5.571   3.431  -0.599
  240    HZ2  TRP  26           2HZ      TRP  26   5.180   1.094  -4.964
  241    HZ3  TRP  26           3HZ      TRP  26   4.653   4.612  -2.562
  242    HH2  TRP  26           HH       TRP  26   4.451   3.461  -4.746
  243    H    VAL  27           H        VAL  27   7.242   1.392   3.395
  244    HA   VAL  27           HA       VAL  27   6.698   3.938   3.972
  245    HB   VAL  27           HB       VAL  27   7.437   3.542   6.281
  246   1HG1  VAL  27          1HG1      VAL  27   5.477   2.266   5.124
  247   2HG1  VAL  27          2HG1      VAL  27   6.563   0.857   5.184
  248   3HG1  VAL  27          3HG1      VAL  27   6.067   1.663   6.692
  249   1HG2  VAL  27          1HG2      VAL  27   9.388   2.449   6.591
  250   2HG2  VAL  27          2HG2      VAL  27   8.544   0.945   6.150
  251   3HG2  VAL  27          3HG2      VAL  27   9.396   1.886   4.903
  252    H    LYS  28           H        LYS  28   9.976   2.665   3.466
  253    HA   LYS  28           HA       LYS  28  11.258   5.151   4.265
  254   1HB   LYS  28          1HB       LYS  28  12.241   2.645   2.849
  255   2HB   LYS  28          2HB       LYS  28  13.289   4.008   3.308
  256   1HG   LYS  28          1HG       LYS  28  11.493   2.592   5.309
  257   2HG   LYS  28          2HG       LYS  28  13.157   2.055   4.977
  258   1HD   LYS  28          1HD       LYS  28  14.061   3.786   6.135
  259   2HD   LYS  28          2HD       LYS  28  12.934   4.963   5.419
  260   1HE   LYS  28          1HE       LYS  28  11.533   4.857   7.193
  261   2HE   LYS  28          2HE       LYS  28  11.609   3.082   7.249
  262   1HZ   LYS  28          1HZ       LYS  28  12.589   4.521   9.132
  263   2HZ   LYS  28          2HZ       LYS  28  13.349   3.138   8.652
  264   3HZ   LYS  28          3HZ       LYS  28  13.906   4.605   8.143
  265    H    VAL  29           H        VAL  29  10.237   3.557   1.241
  266    HA   VAL  29           HA       VAL  29  11.522   5.010  -0.692
  267    HB   VAL  29           HB       VAL  29   8.619   4.137  -0.507
  268   1HG1  VAL  29          1HG1      VAL  29   8.601   5.890  -2.132
  269   2HG1  VAL  29          2HG1      VAL  29  10.181   5.399  -2.788
  270   3HG1  VAL  29          3HG1      VAL  29   8.748   4.381  -3.064
  271   1HG2  VAL  29          1HG2      VAL  29   9.349   2.254  -1.779
  272   2HG2  VAL  29          2HG2      VAL  29  10.898   3.032  -2.185
  273   3HG2  VAL  29          3HG2      VAL  29  10.589   2.477  -0.522
  274    H    GLN  30           H        GLN  30   9.382   6.225   1.750
  275    HA   GLN  30           HA       GLN  30   8.950   8.749   0.264
  276   1HB   GLN  30          1HB       GLN  30   7.137   9.080   1.624
  277   2HB   GLN  30          2HB       GLN  30   7.240   7.310   1.781
  278   1HG   GLN  30          1HG       GLN  30   8.762   7.680   3.780
  279   2HG   GLN  30          2HG       GLN  30   8.362   9.408   3.676
  280   1HE2  GLN  30          1HE2      GLN  30   7.768   8.111   6.011
  281   2HE2  GLN  30          2HE2      GLN  30   6.040   7.869   6.157
  282    H    ARG  31           H        ARG  31  10.455   7.423   3.230
  283    HA   ARG  31           HA       ARG  31  11.665   8.593   4.868
  284   1HB   ARG  31          1HB       ARG  31  13.344   7.624   3.462
  285   2HB   ARG  31          2HB       ARG  31  13.129   8.883   2.223
  286   1HG   ARG  31          1HG       ARG  31  14.588  10.245   3.273
  287   2HG   ARG  31          2HG       ARG  31  13.697  10.091   4.806
  288   1HD   ARG  31          1HD       ARG  31  15.088   8.466   5.602
  289   2HD   ARG  31          2HD       ARG  31  15.270   7.701   4.009
  290    HE   ARG  31           HE       ARG  31  16.966   9.774   5.185
  291   1HH1  ARG  31          2HH2      ARG  31  15.883   8.140   2.242
  292   2HH1  ARG  31          1HH2      ARG  31  17.311   8.556   1.322
  293   1HH2  ARG  31          2HH1      ARG  31  18.852  10.324   3.968
  294   2HH2  ARG  31          1HH1      ARG  31  19.003   9.802   2.306
  295    H    GLY  32           H        GLY  32  12.858  10.798   2.411
  296   1HA   GLY  32          1HA       GLY  32  12.660  13.124   3.823
  297   2HA   GLY  32          2HA       GLY  32  12.469  13.054   2.056
  Start of MODEL   30
    1    HA   PRO   1           HA       PRO   1 -18.236  10.137  -1.348
    2   1HB   PRO   1          1HB       PRO   1 -17.496  12.301   0.133
    3   2HB   PRO   1          2HB       PRO   1 -17.764  12.414  -1.637
    4   1HG   PRO   1          1HG       PRO   1 -19.739  13.072   0.567
    5   2HG   PRO   1          2HG       PRO   1 -19.262  14.113  -0.814
    6   1HD   PRO   1          1HD       PRO   1 -21.504  12.565  -0.908
    7   2HD   PRO   1          2HD       PRO   1 -20.458  12.736  -2.350
    8    HA   PRO   2           HA       PRO   2 -19.838   8.478   2.612
    9   1HB   PRO   2          1HB       PRO   2 -18.771   5.986   2.335
   10   2HB   PRO   2          2HB       PRO   2 -20.236   6.493   1.432
   11   1HG   PRO   2          1HG       PRO   2 -17.367   6.535   0.453
   12   2HG   PRO   2          2HG       PRO   2 -18.784   5.794  -0.360
   13   1HD   PRO   2          1HD       PRO   2 -17.926   8.299  -1.005
   14   2HD   PRO   2          2HD       PRO   2 -19.676   7.937  -0.906
   15    H    LEU   3           H        LEU   3 -16.959   9.583   1.403
   16    HA   LEU   3           HA       LEU   3 -15.064  10.273   2.521
   17   1HB   LEU   3          1HB       LEU   3 -16.819   9.529   4.648
   18   2HB   LEU   3          2HB       LEU   3 -15.216   8.843   5.008
   19    HG   LEU   3           HG       LEU   3 -15.507  11.186   5.868
   20   1HD1  LEU   3          1HD1      LEU   3 -13.326  11.832   5.294
   21   2HD1  LEU   3          2HD1      LEU   3 -13.299  10.085   4.955
   22   3HD1  LEU   3          3HD1      LEU   3 -13.488  11.248   3.621
   23   1HD2  LEU   3          1HD2      LEU   3 -16.975  11.874   3.904
   24   2HD2  LEU   3          2HD2      LEU   3 -15.690  13.031   4.328
   25   3HD2  LEU   3          3HD2      LEU   3 -15.491  11.955   2.924
   26    H    SER   4           H        SER   4 -15.953   7.270   1.548
   27    HA   SER   4           HA       SER   4 -13.277   6.356   1.228
   28   1HB   SER   4          1HB       SER   4 -13.533   4.301   2.721
   29   2HB   SER   4          2HB       SER   4 -13.242   5.843   3.562
   30    HG   SER   4           HG       SER   4 -15.022   4.450   4.346
   31    H    GLN   5           H        GLN   5 -13.453   5.389  -0.698
   32    HA   GLN   5           HA       GLN   5 -14.952   3.093  -1.211
   33   1HB   GLN   5          1HB       GLN   5 -16.548   5.529  -1.289
   34   2HB   GLN   5          2HB       GLN   5 -16.518   4.729  -2.879
   35   1HG   GLN   5          1HG       GLN   5 -17.240   2.627  -1.896
   36   2HG   GLN   5          2HG       GLN   5 -17.105   3.300  -0.257
   37   1HE2  GLN   5          1HE2      GLN   5 -19.273   3.022   0.319
   38   2HE2  GLN   5          2HE2      GLN   5 -20.574   3.926  -0.425
   39    H    GLU   6           H        GLU   6 -14.218   6.253  -2.800
   40    HA   GLU   6           HA       GLU   6 -13.718   5.535  -5.359
   41   1HB   GLU   6          1HB       GLU   6 -12.989   7.654  -3.688
   42   2HB   GLU   6          2HB       GLU   6 -11.440   7.050  -4.323
   43   1HG   GLU   6          1HG       GLU   6 -12.256   8.681  -5.893
   44   2HG   GLU   6          2HG       GLU   6 -12.487   7.082  -6.633
   45    H    THR   7           H        THR   7 -11.069   5.428  -2.902
   46    HA   THR   7           HA       THR   7  -9.624   3.521  -4.602
   47    HB   THR   7           HB       THR   7  -8.492   4.041  -1.960
   48    HG1  THR   7           1HG      THR   7  -8.139   6.320  -2.594
   49   1HG2  THR   7          1HG2      THR   7  -7.585   4.908  -4.734
   50   2HG2  THR   7          2HG2      THR   7  -6.572   4.657  -3.292
   51   3HG2  THR   7          3HG2      THR   7  -7.345   3.266  -4.090
   52    H    PHE   8           H        PHE   8  -9.503   3.322  -1.090
   53    HA   PHE   8           HA       PHE   8  -9.376   1.091  -0.127
   54   1HB   PHE   8          1HB       PHE   8 -12.325   1.707  -0.148
   55   2HB   PHE   8          2HB       PHE   8 -11.323   1.079   1.171
   56    HD1  PHE   8           1HD      PHE   8 -11.102   4.097  -1.067
   57    HD2  PHE   8           2HD      PHE   8 -11.239   2.561   2.942
   58    HE1  PHE   8           1HE      PHE   8 -10.830   6.396  -0.177
   59    HE2  PHE   8           2HE      PHE   8 -10.967   4.859   3.832
   60    HZ   PHE   8           HZ       PHE   8 -10.763   6.777   2.272
   61    H    SER   9           H        SER   9 -12.361   1.279  -2.158
   62    HA   SER   9           HA       SER   9 -13.034  -1.296  -2.481
   63   1HB   SER   9          1HB       SER   9 -13.976   0.693  -3.715
   64   2HB   SER   9          2HB       SER   9 -12.622   0.550  -4.862
   65    HG   SER   9           HG       SER   9 -13.334  -1.676  -5.138
   66    H    ASP  10           H        ASP  10 -10.524   0.211  -4.601
   67    HA   ASP  10           HA       ASP  10  -9.448  -2.520  -5.065
   68   1HB   ASP  10          1HB       ASP  10  -8.400  -1.556  -7.044
   69   2HB   ASP  10          2HB       ASP  10 -10.138  -1.184  -7.044
   70    H    LEU  11           H        LEU  11  -8.878   0.489  -3.452
   71    HA   LEU  11           HA       LEU  11  -6.018   0.448  -3.436
   72   1HB   LEU  11          1HB       LEU  11  -7.847   2.273  -2.738
   73   2HB   LEU  11          2HB       LEU  11  -7.571   1.563  -1.129
   74    HG   LEU  11           HG       LEU  11  -5.632   3.001  -2.942
   75   1HD1  LEU  11          1HD1      LEU  11  -5.169   3.347  -0.146
   76   2HD1  LEU  11          2HD1      LEU  11  -5.857   4.520  -1.294
   77   3HD1  LEU  11          3HD1      LEU  11  -6.930   3.418  -0.398
   78   1HD2  LEU  11          1HD2      LEU  11  -3.824   2.087  -1.362
   79   2HD2  LEU  11          2HD2      LEU  11  -5.007   0.841  -0.897
   80   3HD2  LEU  11          3HD2      LEU  11  -4.449   0.953  -2.584
   81    H    TRP  12           H        TRP  12  -8.196  -0.149  -0.624
   82    HA   TRP  12           HA       TRP  12  -6.312  -1.456   0.957
   83   1HB   TRP  12          1HB       TRP  12  -8.049  -1.491   2.344
   84   2HB   TRP  12          2HB       TRP  12  -9.058  -0.873   1.029
   85    HD1  TRP  12           HD       TRP  12 -11.121  -2.239   0.625
   86    HE1  TRP  12           1HE      TRP  12 -11.877  -4.651   0.935
   87    HE3  TRP  12           3HE      TRP  12  -6.757  -4.229   2.410
   88    HZ2  TRP  12           2HZ      TRP  12 -10.736  -7.149   1.847
   89    HZ3  TRP  12           3HZ      TRP  12  -6.630  -6.625   2.988
   90    HH2  TRP  12           HH       TRP  12  -8.605  -8.095   2.713
   91    H    LYS  13           H        LYS  13  -8.422  -2.760  -1.613
   92    HA   LYS  13           HA       LYS  13  -7.780  -5.509  -1.128
   93   1HB   LYS  13          1HB       LYS  13  -9.668  -4.279  -2.571
   94   2HB   LYS  13          2HB       LYS  13  -8.480  -4.532  -3.872
   95   1HG   LYS  13          1HG       LYS  13  -8.534  -6.953  -2.410
   96   2HG   LYS  13          2HG       LYS  13 -10.236  -6.463  -2.587
   97   1HD   LYS  13          1HD       LYS  13  -8.525  -6.149  -5.010
   98   2HD   LYS  13          2HD       LYS  13  -8.864  -7.822  -4.505
   99   1HE   LYS  13          1HE       LYS  13 -11.061  -7.673  -5.063
  100   2HE   LYS  13          2HE       LYS  13 -11.213  -6.031  -4.401
  101   1HZ   LYS  13          1HZ       LYS  13 -11.394  -6.421  -6.902
  102   2HZ   LYS  13          2HZ       LYS  13 -10.543  -5.120  -6.350
  103   3HZ   LYS  13          3HZ       LYS  13  -9.746  -6.465  -6.873
  104    H    LEU  14           H        LEU  14  -6.302  -2.896  -3.029
  105    HA   LEU  14           HA       LEU  14  -4.514  -4.591  -4.505
  106   1HB   LEU  14          1HB       LEU  14  -4.820  -1.660  -3.952
  107   2HB   LEU  14          2HB       LEU  14  -3.255  -2.237  -4.573
  108    HG   LEU  14           HG       LEU  14  -5.589  -1.714  -6.074
  109   1HD1  LEU  14          1HD1      LEU  14  -3.139  -3.378  -6.800
  110   2HD1  LEU  14          2HD1      LEU  14  -4.215  -2.537  -7.941
  111   3HD1  LEU  14          3HD1      LEU  14  -3.210  -1.599  -6.810
  112   1HD2  LEU  14          1HD2      LEU  14  -6.467  -3.746  -6.794
  113   2HD2  LEU  14          2HD2      LEU  14  -5.004  -4.655  -6.350
  114   3HD2  LEU  14          3HD2      LEU  14  -6.137  -4.119  -5.086
  115    H    LEU  15           H        LEU  15  -4.233  -2.676  -1.479
  116    HA   LEU  15           HA       LEU  15  -1.484  -3.264  -1.023
  117   1HB   LEU  15          1HB       LEU  15  -3.640  -1.873   0.273
  118   2HB   LEU  15          2HB       LEU  15  -2.857  -2.944   1.460
  119    HG   LEU  15           HG       LEU  15  -0.622  -2.017   0.469
  120   1HD1  LEU  15          1HD1      LEU  15  -2.243   0.442  -0.117
  121   2HD1  LEU  15          2HD1      LEU  15  -0.679  -0.076  -0.791
  122   3HD1  LEU  15          3HD1      LEU  15  -2.188  -0.833  -1.357
  123   1HD2  LEU  15          1HD2      LEU  15  -2.046   0.184   1.889
  124   2HD2  LEU  15          2HD2      LEU  15  -2.095  -1.410   2.680
  125   3HD2  LEU  15          3HD2      LEU  15  -0.530  -0.651   2.306
  126    H    LYS  16           H        LYS  16  -4.304  -5.221  -0.892
  127    HA   LYS  16           HA       LYS  16  -3.571  -6.981   1.237
  128   1HB   LYS  16          1HB       LYS  16  -5.793  -6.638  -0.248
  129   2HB   LYS  16          2HB       LYS  16  -5.084  -8.016  -1.123
  130   1HG   LYS  16          1HG       LYS  16  -4.836  -8.442   1.732
  131   2HG   LYS  16          2HG       LYS  16  -6.529  -8.073   1.326
  132   1HD   LYS  16          1HD       LYS  16  -6.573  -9.837  -0.345
  133   2HD   LYS  16          2HD       LYS  16  -4.829 -10.129  -0.145
  134   1HE   LYS  16          1HE       LYS  16  -5.486 -10.497   2.387
  135   2HE   LYS  16          2HE       LYS  16  -7.107 -10.787   1.719
  136   1HZ   LYS  16          1HZ       LYS  16  -4.645 -12.275   1.241
  137   2HZ   LYS  16          2HZ       LYS  16  -6.115 -12.832   1.739
  138   3HZ   LYS  16          3HZ       LYS  16  -5.900 -12.354   0.175
  139    H    LYS  17           H        LYS  17  -1.613  -6.223  -1.127
  140    HA   LYS  17           HA       LYS  17  -0.194  -8.724  -1.058
  141   1HB   LYS  17          1HB       LYS  17  -1.230  -9.723  -2.798
  142   2HB   LYS  17          2HB       LYS  17  -2.074  -8.226  -3.262
  143   1HG   LYS  17          1HG       LYS  17   0.847  -8.859  -3.867
  144   2HG   LYS  17          2HG       LYS  17  -0.494  -8.990  -5.030
  145   1HD   LYS  17          1HD       LYS  17  -0.705  -6.412  -3.848
  146   2HD   LYS  17          2HD       LYS  17   1.014  -6.643  -4.249
  147   1HE   LYS  17          1HE       LYS  17   0.346  -5.959  -6.322
  148   2HE   LYS  17          2HE       LYS  17  -0.140  -7.660  -6.493
  149   1HZ   LYS  17          1HZ       LYS  17  -2.131  -6.141  -5.220
  150   2HZ   LYS  17          2HZ       LYS  17  -1.741  -5.478  -6.679
  151   3HZ   LYS  17          3HZ       LYS  17  -2.224  -7.053  -6.591
  152    H    TRP  18           H        TRP  18  -0.679  -5.413  -1.984
  153    HA   TRP  18           HA       TRP  18   2.057  -5.195  -3.078
  154   1HB   TRP  18          1HB       TRP  18  -0.346  -3.977  -3.688
  155   2HB   TRP  18          2HB       TRP  18   0.465  -2.752  -2.703
  156    HD1  TRP  18           HD       TRP  18   0.164  -3.885  -6.148
  157    HE1  TRP  18           1HE      TRP  18   1.972  -2.914  -7.656
  158    HE3  TRP  18           3HE      TRP  18   3.361  -2.136  -2.553
  159    HZ2  TRP  18           2HZ      TRP  18   4.503  -1.543  -7.351
  160    HZ3  TRP  18           3HZ      TRP  18   5.457  -1.005  -3.199
  161    HH2  TRP  18           HH       TRP  18   6.041  -0.702  -5.588
  162    H    LYS  19           H        LYS  19   0.042  -4.173  -0.310
  163    HA   LYS  19           HA       LYS  19   1.725  -2.351   0.924
  164   1HB   LYS  19          1HB       LYS  19   0.390  -2.656   2.765
  165   2HB   LYS  19          2HB       LYS  19  -0.616  -3.513   1.573
  166   1HG   LYS  19          1HG       LYS  19   0.395  -5.654   2.214
  167   2HG   LYS  19          2HG       LYS  19   1.490  -4.824   3.344
  168   1HD   LYS  19          1HD       LYS  19  -0.791  -3.857   4.318
  169   2HD   LYS  19          2HD       LYS  19  -1.471  -5.317   3.559
  170   1HE   LYS  19          1HE       LYS  19   0.922  -6.110   4.884
  171   2HE   LYS  19          2HE       LYS  19   0.026  -5.078   6.019
  172   1HZ   LYS  19          1HZ       LYS  19  -1.176  -7.322   4.566
  173   2HZ   LYS  19          2HZ       LYS  19  -0.551  -7.447   6.087
  174   3HZ   LYS  19          3HZ       LYS  19  -1.839  -6.456   5.804
  175    H    MET  20           H        MET  20   1.795  -5.943   1.212
  176    HA   MET  20           HA       MET  20   3.677  -6.466   3.033
  177   1HB   MET  20          1HB       MET  20   4.652  -8.155   1.325
  178   2HB   MET  20          2HB       MET  20   2.923  -8.280   1.728
  179   1HG   MET  20          1HG       MET  20   2.605  -8.217  -0.507
  180   2HG   MET  20          2HG       MET  20   2.858  -6.473  -0.322
  181   1HE   MET  20          1HE       MET  20   5.004  -6.188  -3.308
  182   2HE   MET  20          2HE       MET  20   3.292  -6.541  -2.975
  183   3HE   MET  20          3HE       MET  20   4.150  -5.311  -2.016
  184    H    ARG  21           H        ARG  21   4.352  -4.976  -0.149
  185    HA   ARG  21           HA       ARG  21   7.187  -4.637   0.649
  186   1HB   ARG  21          1HB       ARG  21   6.214  -5.505  -1.682
  187   2HB   ARG  21          2HB       ARG  21   6.104  -3.759  -2.007
  188   1HG   ARG  21          1HG       ARG  21   8.306  -3.797  -2.505
  189   2HG   ARG  21          2HG       ARG  21   8.622  -4.129  -0.785
  190   1HD   ARG  21          1HD       ARG  21   9.033  -6.341  -1.153
  191   2HD   ARG  21          2HD       ARG  21   7.757  -6.476  -2.383
  192    HE   ARG  21           HE       ARG  21   9.910  -4.907  -3.411
  193   1HH1  ARG  21          2HH2      ARG  21   9.063  -8.219  -2.509
  194   2HH1  ARG  21          1HH2      ARG  21  10.165  -8.957  -3.650
  195   1HH2  ARG  21          2HH1      ARG  21  11.365  -5.882  -4.919
  196   2HH2  ARG  21          1HH1      ARG  21  11.477  -7.625  -5.024
  197    H    ARG  22           H        ARG  22   4.248  -2.831  -0.306
  198    HA   ARG  22           HA       ARG  22   5.570  -0.255  -0.046
  199   1HB   ARG  22          1HB       ARG  22   3.409  -1.097  -1.427
  200   2HB   ARG  22          2HB       ARG  22   2.595  -0.496   0.038
  201   1HG   ARG  22          1HG       ARG  22   4.716   1.158  -1.356
  202   2HG   ARG  22          2HG       ARG  22   3.024   1.185  -1.908
  203   1HD   ARG  22          1HD       ARG  22   2.940   2.896  -0.360
  204   2HD   ARG  22          2HD       ARG  22   2.560   1.523   0.702
  205    HE   ARG  22           HE       ARG  22   5.246   1.597   0.915
  206   1HH1  ARG  22          2HH2      ARG  22   2.812   4.160   1.008
  207   2HH1  ARG  22          1HH2      ARG  22   3.735   5.185   2.084
  208   1HH2  ARG  22          2HH1      ARG  22   6.465   2.951   2.336
  209   2HH2  ARG  22          1HH1      ARG  22   5.818   4.496   2.841
  210    H    ASN  23           H        ASN  23   5.512  -2.234   2.266
  211    HA   ASN  23           HA       ASN  23   4.716  -0.250   4.285
  212   1HB   ASN  23          1HB       ASN  23   2.962  -2.317   3.579
  213   2HB   ASN  23          2HB       ASN  23   3.772  -2.904   5.047
  214   1HD2  ASN  23          1HD2      ASN  23   1.447  -2.659   5.846
  215   2HD2  ASN  23          2HD2      ASN  23   1.006  -1.106   6.522
  216    H    GLN  24           H        GLN  24   7.120  -1.814   3.071
  217    HA   GLN  24           HA       GLN  24   8.306  -2.440   5.708
  218   1HB   GLN  24          1HB       GLN  24   8.153  -4.301   3.316
  219   2HB   GLN  24          2HB       GLN  24   9.384  -4.479   4.590
  220   1HG   GLN  24          1HG       GLN  24   7.078  -4.167   6.068
  221   2HG   GLN  24          2HG       GLN  24   6.483  -5.065   4.655
  222   1HE2  GLN  24          1HE2      GLN  24   8.159  -5.250   7.652
  223   2HE2  GLN  24          2HE2      GLN  24   8.685  -6.916   7.537
  224    H    PHE  25           H        PHE  25   9.929  -3.502   2.839
  225    HA   PHE  25           HA       PHE  25  12.127  -1.750   3.251
  226   1HB   PHE  25          1HB       PHE  25  12.575  -3.774   2.153
  227   2HB   PHE  25          2HB       PHE  25  11.222  -3.573   1.026
  228    HD1  PHE  25           1HD      PHE  25  11.413  -1.377  -0.505
  229    HD2  PHE  25           2HD      PHE  25  14.711  -3.417   1.343
  230    HE1  PHE  25           1HE      PHE  25  12.956  -0.407  -2.187
  231    HE2  PHE  25           2HE      PHE  25  16.254  -2.446  -0.339
  232    HZ   PHE  25           HZ       PHE  25  15.377  -0.941  -2.103
  233    H    TRP  26           H        TRP  26   9.044  -1.082   2.072
  234    HA   TRP  26           HA       TRP  26   9.792   0.802  -0.005
  235   1HB   TRP  26          1HB       TRP  26   7.376  -0.321   1.184
  236   2HB   TRP  26          2HB       TRP  26   7.227   1.421   0.911
  237    HD1  TRP  26           HD       TRP  26   7.651  -1.883  -0.940
  238    HE1  TRP  26           1HE      TRP  26   7.063  -1.588  -3.401
  239    HE3  TRP  26           3HE      TRP  26   7.108   3.206  -1.036
  240    HZ2  TRP  26           2HZ      TRP  26   6.431   0.587  -5.202
  241    HZ3  TRP  26           3HZ      TRP  26   6.514   4.351  -3.139
  242    HH2  TRP  26           HH       TRP  26   6.173   3.061  -5.226
  243    H    VAL  27           H        VAL  27   8.185   1.241   3.202
  244    HA   VAL  27           HA       VAL  27   8.168   3.876   3.569
  245    HB   VAL  27           HB       VAL  27   8.735   3.529   5.935
  246   1HG1  VAL  27          1HG1      VAL  27   6.615   2.526   4.697
  247   2HG1  VAL  27          2HG1      VAL  27   7.378   0.970   5.100
  248   3HG1  VAL  27          3HG1      VAL  27   6.943   2.110   6.396
  249   1HG2  VAL  27          1HG2      VAL  27   9.279   0.764   6.062
  250   2HG2  VAL  27          2HG2      VAL  27  10.340   1.388   4.776
  251   3HG2  VAL  27          3HG2      VAL  27  10.411   2.093   6.409
  252    H    LYS  28           H        LYS  28  11.132   1.928   3.335
  253    HA   LYS  28           HA       LYS  28  12.862   4.173   3.997
  254   1HB   LYS  28          1HB       LYS  28  13.382   1.405   2.849
  255   2HB   LYS  28          2HB       LYS  28  14.657   2.568   3.284
  256   1HG   LYS  28          1HG       LYS  28  12.982   2.526   5.528
  257   2HG   LYS  28          2HG       LYS  28  13.052   0.825   5.011
  258   1HD   LYS  28          1HD       LYS  28  15.306   0.645   5.437
  259   2HD   LYS  28          2HD       LYS  28  15.630   2.342   5.007
  260   1HE   LYS  28          1HE       LYS  28  13.986   1.720   7.455
  261   2HE   LYS  28          2HE       LYS  28  15.754   1.560   7.531
  262   1HZ   LYS  28          1HZ       LYS  28  14.312   3.841   7.793
  263   2HZ   LYS  28          2HZ       LYS  28  15.946   3.722   7.608
  264   3HZ   LYS  28          3HZ       LYS  28  14.983   3.961   6.291
  265    H    VAL  29           H        VAL  29  11.649   2.538   1.070
  266    HA   VAL  29           HA       VAL  29  13.277   3.498  -0.909
  267    HB   VAL  29           HB       VAL  29  10.254   3.257  -0.794
  268   1HG1  VAL  29          1HG1      VAL  29  11.994   3.674  -3.259
  269   2HG1  VAL  29          2HG1      VAL  29  10.223   3.503  -3.212
  270   3HG1  VAL  29          3HG1      VAL  29  10.997   4.946  -2.514
  271   1HG2  VAL  29          1HG2      VAL  29  10.623   1.176  -1.905
  272   2HG2  VAL  29          2HG2      VAL  29  12.309   1.595  -2.292
  273   3HG2  VAL  29          3HG2      VAL  29  11.843   1.241  -0.611
  274    H    GLN  30           H        GLN  30  11.357   5.366   1.296
  275    HA   GLN  30           HA       GLN  30  11.543   7.770  -0.421
  276   1HB   GLN  30          1HB       GLN  30   9.794   8.613   0.800
  277   2HB   GLN  30          2HB       GLN  30   9.492   6.883   1.085
  278   1HG   GLN  30          1HG       GLN  30  10.967   7.075   3.146
  279   2HG   GLN  30          2HG       GLN  30  10.959   8.835   2.899
  280   1HE2  GLN  30          1HE2      GLN  30   9.466   9.920   4.042
  281   2HE2  GLN  30          2HE2      GLN  30   7.923   9.283   4.570
  282    H    ARG  31           H        ARG  31  12.594   6.444   2.734
  283    HA   ARG  31           HA       ARG  31  13.952   7.488   4.343
  284   1HB   ARG  31          1HB       ARG  31  15.415   6.033   3.088
  285   2HB   ARG  31          2HB       ARG  31  15.593   7.242   1.794
  286   1HG   ARG  31          1HG       ARG  31  16.257   8.502   4.288
  287   2HG   ARG  31          2HG       ARG  31  17.146   6.962   4.192
  288   1HD   ARG  31          1HD       ARG  31  17.493   7.845   1.653
  289   2HD   ARG  31          2HD       ARG  31  17.357   9.406   2.490
  290    HE   ARG  31           HE       ARG  31  19.169   7.586   3.832
  291   1HH1  ARG  31          2HH2      ARG  31  18.817   9.888   1.171
  292   2HH1  ARG  31          1HH2      ARG  31  20.519  10.288   1.111
  293   1HH2  ARG  31          2HH1      ARG  31  21.417   8.114   3.752
  294   2HH2  ARG  31          1HH1      ARG  31  22.001   9.277   2.583
  295    H    GLY  32           H        GLY  32  12.799   9.515   4.605
  296   1HA   GLY  32          1HA       GLY  32  13.726  11.793   2.993
  297   2HA   GLY  32          2HA       GLY  32  12.469  11.808   4.250