*HEADER    ANTITUMOR PROTEIN                       24-JUL-03   1Q2I              
*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, 20 STRUCTURES                                                    
*AUTHOR    R.ROSAL, M.R.PINCUS, P.W.BRANDT-RAUF, R.L.FINE, H.WANG                
*REVDAT   1   16-MAR-04 1Q2I    0                                                
1 PRO HB3 1 PRO HA      4.474 # noe-37C.337
1 PRO HB2 1 PRO HA      3.820 # noe-37C.314
1 PRO HD3 1 PRO HG3      4.022 # noe-37C.282
2 PRO HD3 1 PRO HB3      3.769 # noe-37C.281
2 PRO HD2 1 PRO HA      3.592 # noe-37C.278
2 PRO HB2 2 PRO HA      3.276 # noe-37C.321
2 PRO HB2 2 PRO HB3      3.014 # noe-37C.322
2 PRO HB3 2 PRO HB2      2.996 # noe-37C.348
2 PRO HD2 2 PRO HD3      2.687 # noe-37C.279
2 PRO HD3 2 PRO HD2      2.724 # noe-37C.280
2 PRO HG2 2 PRO HA      4.457 # noe-37C.707
2 PRO HG2 2 PRO HD3      3.820 # noe-37C.336
2 PRO HD2 2 PRO HG2      3.420 # noe-37C.277
2 PRO HG2 2 PRO HD2      3.530 # noe-37C.334
3 LEU HN 2 PRO HA      2.817 # noe-37C.3
3 LEU HB3 3 LEU HA      3.616 # noe-37C.384
3 LEU HA 3 LEU QD1      4.308 # noe-37C.218
3 LEU QD1 3 LEU HA      4.099 # noe-37C.427
3 LEU HB2 3 LEU QD2      4.544 # noe-37C.379
3 LEU HG 3 LEU QD1      4.168 # noe-37C.760
3 LEU HG 3 LEU QD1      4.168 # noe-37C.833
3 LEU HA 3 LEU HN      3.530 # noe-37C.485
3 LEU HN 3 LEU HA      3.526 # noe-37C.701
3 LEU HB3 3 LEU HN      4.119 # noe-37C.570
3 LEU HB2 3 LEU HN      3.682 # noe-37C.569
3 LEU HA 4 SER HN      2.751 # noe-37C.763
3 LEU HA 4 SER HN      2.751 # noe-37C.836
4 SER HN 3 LEU HB3      4.069 # noe-37C.20
4 SER HN 3 LEU HB2      4.350 # noe-37C.19
3 LEU HN 4 SER HN      3.921 # noe-37C.702
4 SER HA 4 SER HB3      3.258 # noe-37C.206
4 SER HB3 4 SER HA      3.237 # noe-37C.275
4 SER HA 4 SER HB2      3.208 # noe-37C.205
4 SER HB2 4 SER HA      3.284 # noe-37C.268
4 SER HN 4 SER HA      3.097 # noe-37C.884
4 SER HN 4 SER HB3      3.522 # noe-37C.17
4 SER HB3 4 SER HN      3.704 # noe-37C.492
4 SER HB2 4 SER HN      3.437 # noe-37C.487
5 GLN HN 4 SER HA      2.859 # noe-37C.4
4 SER HA 5 GLN HN      2.762 # noe-37C.448
5 GLN HN 4 SER HB2      3.862 # noe-37C.6
4 SER HB2 5 GLN HN      3.884 # noe-37C.486
4 SER HN 5 GLN HN      3.721 # noe-37C.613
5 GLN HA 5 GLN HB3      3.490 # noe-37C.217
5 GLN HB3 5 GLN HA      3.621 # noe-37C.347
5 GLN HA 5 GLN HB2      3.693 # noe-37C.216
5 GLN HB2 5 GLN HA      3.721 # noe-37C.326
5 GLN HB2 5 GLN HB3      2.855 # noe-37C.327
5 GLN HA 5 GLN HG3      3.827 # noe-37C.215
5 GLN HG3 5 GLN HB3      3.167 # noe-37C.319
5 GLN HB3 5 GLN HG3      3.315 # noe-37C.339
5 GLN HG2 5 GLN HA      3.733 # noe-37C.932
5 GLN HG2 5 GLN HB2      3.274 # noe-37C.320
5 GLN HB2 5 GLN HG2      3.452 # noe-37C.325
5 GLN HN 5 GLN HA      3.403 # noe-37C.5
5 GLN HA 5 GLN HN      3.342 # noe-37C.457
5 GLN HN 5 GLN HB3      3.474 # noe-37C.9
5 GLN HB3 5 GLN HN      3.565 # noe-37C.547
5 GLN HN 5 GLN HB2      4.031 # noe-37C.8
5 GLN HB2 5 GLN HN      3.929 # noe-37C.540
5 GLN HN 5 GLN HG2      4.022 # noe-37C.7
5 GLN HG2 5 GLN HN      3.996 # noe-37C.539
6 GLU- HN 5 GLN HB2      4.013 # noe-37C.28
5 GLN HB2 6 GLU- HN      4.079 # noe-37C.541
6 GLU- HN 5 GLN HG3      4.394 # noe-37C.744
6 GLU- HN 5 GLN HG3      4.394 # noe-37C.816
5 GLN HG2 6 GLU- HN      4.394 # noe-37C.781
5 GLN HG2 6 GLU- HN      4.394 # noe-37C.856
5 GLN HN 6 GLU- HN      3.139 # noe-37C.611
6 GLU- HN 5 GLN HN      3.133 # noe-37C.617
6 GLU- HA 6 GLU- HG3      4.059 # noe-37C.214
6 GLU- HG2 6 GLU- HA      4.099 # noe-37C.317
6 GLU- HG2 6 GLU- HB2      3.474 # noe-37C.318
6 GLU- HB2 6 GLU- HG2      3.616 # noe-37C.333
6 GLU- HN 6 GLU- HA      3.143 # noe-37C.753
6 GLU- HA 6 GLU- HN      3.185 # noe-37C.762
6 GLU- HA 6 GLU- HN      3.185 # noe-37C.835
6 GLU- HN 6 GLU- HB3      3.160 # noe-37C.29
6 GLU- HB3 6 GLU- HN      3.222 # noe-37C.546
6 GLU- HG3 6 GLU- HN      4.013 # noe-37C.538
6 GLU- HN 6 GLU- HG2      4.022 # noe-37C.27
7 THR HN 6 GLU- HA      2.659 # noe-37C.98
6 GLU- HA 7 THR HN      2.676 # noe-37C.951
6 GLU- HN 7 THR HN      3.017 # noe-37C.616
7 THR HN 6 GLU- HN      2.958 # noe-37C.880
7 THR QG2 7 THR HA      3.062 # noe-37C.943
7 THR HB 7 THR QG2      3.014 # noe-37C.233
7 THR HA 7 THR HN      3.047 # noe-37C.460
7 THR HN 7 THR HB      3.091 # noe-37C.103
7 THR HN 7 THR QG2      3.760 # noe-37C.104
7 THR QG2 7 THR HN      3.751 # noe-37C.584
4 SER HA 8 PHE HB2      3.996 # noe-37C.203
8 PHE HD1 5 GLN HA      4.269 # noe-37C.750
8 PHE HD1 5 GLN HA      4.269 # noe-37C.822
8 PHE HD1 5 GLN HA      4.282 # noe-37C.918
8 PHE HD1 7 THR HA      4.474 # noe-37C.185
7 THR HA 8 PHE HN      2.879 # noe-37C.761
8 PHE HN 7 THR HA      2.865 # noe-37C.824
7 THR HA 8 PHE HN      2.879 # noe-37C.834
8 PHE HN 7 THR QG2      4.329 # noe-37C.26
7 THR QG2 8 PHE HN      4.402 # noe-37C.583
8 PHE HA 8 PHE HB3      3.710 # noe-37C.204
8 PHE HB3 8 PHE HA      3.693 # noe-37C.303
8 PHE HB2 8 PHE HA      3.827 # noe-37C.297
8 PHE HD1 8 PHE HA      3.602 # noe-37C.189
8 PHE HA 8 PHE HD1      3.710 # noe-37C.450
8 PHE HD1 8 PHE HB3      3.423 # noe-37C.191
8 PHE HB3 8 PHE HD1      3.565 # noe-37C.522
8 PHE HE1 8 PHE HD1      2.219 # noe-37C.671
8 PHE HD1 8 PHE HE1      2.239 # noe-37C.681
8 PHE HA 8 PHE HN      3.062 # noe-37C.449
8 PHE HN 8 PHE HB3      3.242 # noe-37C.25
8 PHE HN 8 PHE HB2      3.441 # noe-37C.24
8 PHE HN 8 PHE HD1      3.921 # noe-37C.615
8 PHE HD1 8 PHE HN      3.884 # noe-37C.679
9 SER HN 4 SER HA      3.514 # noe-37C.40
9 SER HN 6 GLU- HA      4.050 # noe-37C.41
9 SER HN 7 THR HA      3.937 # noe-37C.950
7 THR HB 9 SER HN      3.869 # noe-37C.468
9 SER HN 7 THR HB      3.914 # noe-37C.949
7 THR HN 9 SER HN      4.425 # noe-37C.723
9 SER HN 7 THR HN      4.441 # noe-37C.727
7 THR HN 9 SER HN      4.425 # noe-37C.794
9 SER HN 7 THR HN      4.441 # noe-37C.798
8 PHE HD1 9 SER HA      4.322 # noe-37C.190
9 SER HA 8 PHE HD1      3.884 # noe-37C.463
8 PHE HA 9 SER HN      3.583 # noe-37C.447
9 SER HN 8 PHE HB3      3.763 # noe-37C.47
9 SER HN 8 PHE HB2      3.710 # noe-37C.46
8 PHE HD1 9 SER HN      4.244 # noe-37C.680
9 SER HN 8 PHE HD1      4.425 # noe-37C.805
9 SER HN 8 PHE HN      3.093 # noe-37C.703
8 PHE HN 9 SER HN      3.025 # noe-37C.728
9 SER HA 9 SER HB3      3.336 # noe-37C.225
9 SER HB3 9 SER HA      3.399 # noe-37C.276
9 SER HA 9 SER HB2      3.046 # noe-37C.224
9 SER HB2 9 SER HA      3.162 # noe-37C.269
9 SER HN 9 SER HA      2.981 # noe-37C.42
9 SER HA 9 SER HN      2.942 # noe-37C.461
9 SER HN 9 SER HB3      3.351 # noe-37C.45
9 SER HB3 9 SER HN      3.486 # noe-37C.494
9 SER HN 9 SER HB2      3.185 # noe-37C.44
9 SER HB2 9 SER HN      3.284 # noe-37C.489
10 ASP- HN 9 SER HB3      3.987 # noe-37C.37
9 SER HB3 10 ASP- HN      4.050 # noe-37C.493
10 ASP- HN 9 SER HB2      3.693 # noe-37C.36
9 SER HB2 10 ASP- HN      3.763 # noe-37C.488
9 SER HN 10 ASP- HN      2.915 # noe-37C.725
9 SER HN 10 ASP- HN      2.915 # noe-37C.796
10 ASP- HB3 10 ASP- HA      3.180 # noe-37C.309
10 ASP- HB2 10 ASP- HA      3.592 # noe-37C.307
10 ASP- HB3 10 ASP- HB2      2.538 # noe-37C.759
10 ASP- HB3 10 ASP- HB2      2.538 # noe-37C.832
10 ASP- HN 10 ASP- HA      3.171 # noe-37C.35
10 ASP- HN 10 ASP- HB3      3.399 # noe-37C.39
10 ASP- HB3 10 ASP- HN      3.330 # noe-37C.528
10 ASP- HN 10 ASP- HB2      3.336 # noe-37C.38
7 THR QG2 11 LEU QD1      5.881 # noe-37C.420
7 THR QG2 11 LEU QD2      5.325 # noe-37C.419
8 PHE HD1 11 LEU QD1      4.238 # noe-37C.908
8 PHE HD1 11 LEU QD2      4.179 # noe-37C.188
11 LEU HN 8 PHE HA      4.162 # noe-37C.78
9 SER HA 11 LEU HN      3.855 # noe-37C.464
11 LEU HN 9 SER HN      3.929 # noe-37C.722
9 SER HN 11 LEU HN      4.013 # noe-37C.726
11 LEU HN 10 ASP- HA      3.437 # noe-37C.77
11 LEU HN 10 ASP- HB3      3.962 # noe-37C.81
10 ASP- HB3 11 LEU HN      3.693 # noe-37C.529
11 LEU HN 10 ASP- HB2      3.945 # noe-37C.80
10 ASP- HB2 11 LEU HN      3.906 # noe-37C.777
10 ASP- HB2 11 LEU HN      3.906 # noe-37C.852
10 ASP- HN 11 LEU HN      2.937 # noe-37C.618
11 LEU HN 10 ASP- HN      2.952 # noe-37C.633
11 LEU HA 11 LEU HB3      3.225 # noe-37C.257
11 LEU HB3 11 LEU HA      3.247 # noe-37C.955
11 LEU HA 11 LEU HB2      3.260 # noe-37C.256
11 LEU HB2 11 LEU HA      3.345 # noe-37C.389
11 LEU HA 11 LEU QD1      3.621 # noe-37C.259
11 LEU QD1 11 LEU HA      3.616 # noe-37C.445
11 LEU HA 11 LEU QD2      3.666 # noe-37C.258
11 LEU QD2 11 LEU HA      3.721 # noe-37C.439
11 LEU HN 11 LEU HA      3.141 # noe-37C.79
11 LEU HA 11 LEU HN      3.044 # noe-37C.478
11 LEU HN 11 LEU HB3      3.156 # noe-37C.83
11 LEU HB3 11 LEU HN      3.282 # noe-37C.579
11 LEU HN 11 LEU HB2      3.042 # noe-37C.82
11 LEU HB2 11 LEU HN      3.145 # noe-37C.573
11 LEU HN 11 LEU QD1      4.202 # noe-37C.85
11 LEU QD1 11 LEU HN      4.372 # noe-37C.602
11 LEU HN 11 LEU QD2      4.343 # noe-37C.84
11 LEU HG 11 LEU HN      3.339 # noe-37C.577
9 SER HA 12 TRP HB3      4.365 # noe-37C.227
12 TRP HB3 9 SER HA      4.040 # noe-37C.292
9 SER HA 12 TRP HB2      3.739 # noe-37C.226
12 TRP HB2 9 SER HA      3.801 # noe-37C.286
12 TRP HD1 9 SER HA      3.666 # noe-37C.173
9 SER HA 12 TRP HD1      3.937 # noe-37C.462
12 TRP HN 9 SER HA      3.953 # noe-37C.70
12 TRP HD1 10 ASP- HA      4.663 # noe-37C.712
12 TRP HD1 11 LEU HB3      4.269 # noe-37C.176
12 TRP HD1 11 LEU QD1      4.674 # noe-37C.737
12 TRP HD1 11 LEU QD2      4.282 # noe-37C.171
12 TRP HD1 11 LEU HN      4.508 # noe-37C.773
12 TRP HD1 11 LEU HN      4.508 # noe-37C.848
12 TRP HE1 11 LEU HB2      4.350 # noe-37C.0
12 TRP HE1 11 LEU QD2      5.159 # noe-37C.708
11 LEU HA 12 TRP HN      3.769 # noe-37C.765
11 LEU HA 12 TRP HN      3.769 # noe-37C.838
11 LEU HB3 12 TRP HN      3.801 # noe-37C.783
11 LEU HB3 12 TRP HN      3.801 # noe-37C.858
12 TRP HN 11 LEU QD1      4.742 # noe-37C.76
12 TRP HZ2 11 LEU HB2      4.308 # noe-37C.164
12 TRP HZ2 11 LEU QD1      4.719 # noe-37C.747
12 TRP HZ2 11 LEU QD1      4.719 # noe-37C.904
12 TRP HZ2 11 LEU HG      4.379 # noe-37C.165
12 TRP HZ3 11 LEU QD1      4.500 # noe-37C.911
12 TRP HA 12 TRP HB3      3.327 # noe-37C.210
12 TRP HB3 12 TRP HA      3.367 # noe-37C.291
12 TRP HA 12 TRP HB2      3.535 # noe-37C.209
12 TRP HB2 12 TRP HA      3.360 # noe-37C.285
12 TRP HB2 12 TRP HB3      2.717 # noe-37C.287
12 TRP HD1 12 TRP HA      3.510 # noe-37C.172
12 TRP HA 12 TRP HD1      4.119 # noe-37C.455
12 TRP HD1 12 TRP HB3      3.430 # noe-37C.175
12 TRP HB3 12 TRP HD1      3.801 # noe-37C.509
12 TRP HD1 12 TRP HB2      3.434 # noe-37C.174
12 TRP HB2 12 TRP HD1      3.602 # noe-37C.501
12 TRP HD1 12 TRP HE1      2.610 # noe-37C.605
12 TRP HE1 12 TRP HD1      2.691 # noe-37C.608
12 TRP HE3 12 TRP HA      3.169 # noe-37C.162
12 TRP HA 12 TRP HE3      3.145 # noe-37C.454
12 TRP HB3 12 TRP HE3      3.579 # noe-37C.512
12 TRP HE3 12 TRP HB2      3.945 # noe-37C.161
12 TRP HB2 12 TRP HE3      3.898 # noe-37C.500
12 TRP HN 12 TRP HA      3.263 # noe-37C.69
12 TRP HA 12 TRP HN      3.206 # noe-37C.452
12 TRP HB3 12 TRP HN      3.445 # noe-37C.507
12 TRP HN 12 TRP HB2      3.357 # noe-37C.73
12 TRP HB2 12 TRP HN      3.423 # noe-37C.498
12 TRP HN 12 TRP HD1      3.970 # noe-37C.631
12 TRP HD1 12 TRP HN      3.602 # noe-37C.672
12 TRP HN 12 TRP HE3      4.582 # noe-37C.736
12 TRP HN 12 TRP HE3      4.582 # noe-37C.807
12 TRP HZ2 12 TRP HE1      3.287 # noe-37C.717
12 TRP HZ2 12 TRP HE1      3.287 # noe-37C.788
12 TRP HZ2 12 TRP HH2      2.521 # noe-37C.666
12 TRP HH2 12 TRP HZ2      2.634 # noe-37C.675
12 TRP HE3 12 TRP HZ3      2.791 # noe-37C.664
12 TRP HZ3 12 TRP HE3      2.779 # noe-37C.689
12 TRP HH2 12 TRP HZ3      2.517 # noe-37C.682
12 TRP HZ3 12 TRP HH2      2.558 # noe-37C.690
13 LYS+ HN 10 ASP- HA      4.350 # noe-37C.144
13 LYS+ HA 11 LEU HB2      4.089 # noe-37C.273
11 LEU HB2 13 LYS+ HA      4.544 # noe-37C.385
12 TRP HA 13 LYS+ HA      4.379 # noe-37C.212
12 TRP HD1 13 LYS+ HA      4.457 # noe-37C.714
12 TRP HE3 13 LYS+ HA      4.491 # noe-37C.738
12 TRP HE3 13 LYS+ HA      4.491 # noe-37C.809
12 TRP HD1 13 LYS+ HB2      4.563 # noe-37C.170
13 LYS+ HN 12 TRP HA      3.891 # noe-37C.145
12 TRP HA 13 LYS+ HN      3.801 # noe-37C.453
13 LYS+ HN 12 TRP HB3      4.004 # noe-37C.148
12 TRP HB3 13 LYS+ HN      4.040 # noe-37C.508
13 LYS+ HN 12 TRP HB2      3.814 # noe-37C.147
12 TRP HB2 13 LYS+ HN      3.775 # noe-37C.499
12 TRP HD1 13 LYS+ HN      4.269 # noe-37C.673
13 LYS+ HN 12 TRP HN      3.403 # noe-37C.655
13 LYS+ HA 13 LYS+ HB3      3.376 # noe-37C.272
13 LYS+ HA 13 LYS+ HB2      3.069 # noe-37C.271
13 LYS+ HB2 13 LYS+ HA      3.086 # noe-37C.366
13 LYS+ HE3 13 LYS+ HB3      3.290 # noe-37C.305
13 LYS+ HB3 13 LYS+ HE3      3.318 # noe-37C.380
13 LYS+ HA 13 LYS+ HG3      4.040 # noe-37C.270
13 LYS+ HG3 13 LYS+ HA      4.013 # noe-37C.418
13 LYS+ HA 13 LYS+ HG2      4.410 # noe-37C.274
13 LYS+ HG2 13 LYS+ HA      4.295 # noe-37C.404
13 LYS+ HN 13 LYS+ HA      3.206 # noe-37C.146
13 LYS+ HA 13 LYS+ HN      3.245 # noe-37C.491
13 LYS+ HN 13 LYS+ HB2      3.024 # noe-37C.140
13 LYS+ HB2 13 LYS+ HN      3.121 # noe-37C.559
13 LYS+ HN 13 LYS+ HG3      4.474 # noe-37C.143
13 LYS+ HN 13 LYS+ HG2      4.040 # noe-37C.142
13 LYS+ HG2 13 LYS+ HN      4.184 # noe-37C.944
11 LEU HA 14 LEU HB2      3.621 # noe-37C.921
14 LEU QD2 11 LEU HA      4.036 # noe-37C.431
11 LEU HA 14 LEU QD2      4.018 # noe-37C.757
11 LEU HA 14 LEU QD2      4.018 # noe-37C.830
14 LEU HN 11 LEU HA      3.693 # noe-37C.133
11 LEU HA 14 LEU HN      3.794 # noe-37C.479
12 TRP HE3 14 LEU HB2      4.004 # noe-37C.163
14 LEU QD1 12 TRP HA      4.250 # noe-37C.947
12 TRP HE3 14 LEU QD1      4.269 # noe-37C.903
12 TRP HZ3 14 LEU QD1      4.457 # noe-37C.910
12 TRP HD1 14 LEU QD2      4.803 # noe-37C.905
12 TRP HZ3 14 LEU QD2      5.068 # noe-37C.913
14 LEU HN 12 TRP HN      4.151 # noe-37C.653
12 TRP HN 14 LEU HN      4.130 # noe-37C.730
12 TRP HN 14 LEU HN      4.130 # noe-37C.801
13 LYS+ HB2 14 LEU QD1      4.754 # noe-37C.365
13 LYS+ HB2 14 LEU QD2      4.911 # noe-37C.364
13 LYS+ HN 14 LEU HG      4.622 # noe-37C.141
14 LEU HN 13 LYS+ HA      3.535 # noe-37C.138
13 LYS+ HA 14 LEU HN      3.518 # noe-37C.839
14 LEU HN 13 LYS+ HB2      3.290 # noe-37C.139
13 LYS+ HB2 14 LEU HN      3.399 # noe-37C.774
13 LYS+ HB2 14 LEU HN      3.399 # noe-37C.849
13 LYS+ HB2 14 LEU HN      3.399 # noe-37C.935
14 LEU HA 14 LEU HB3      3.522 # noe-37C.249
14 LEU QD1 14 LEU HA      3.502 # noe-37C.440
14 LEU HA 14 LEU QD1      3.445 # noe-37C.756
14 LEU HA 14 LEU QD1      3.445 # noe-37C.829
14 LEU HA 14 LEU QD2      3.970 # noe-37C.250
14 LEU QD2 14 LEU HA      3.953 # noe-37C.430
14 LEU HB3 14 LEU QD2      4.055 # noe-37C.396
14 LEU QD2 14 LEU HB3      4.089 # noe-37C.436
14 LEU HG 14 LEU QD2      3.638 # noe-37C.390
14 LEU HN 14 LEU HA      3.185 # noe-37C.132
14 LEU HA 14 LEU HN      3.255 # noe-37C.474
14 LEU HN 14 LEU HB3      3.290 # noe-37C.136
14 LEU HB3 14 LEU HN      3.367 # noe-37C.580
14 LEU HN 14 LEU HB2      3.006 # noe-37C.134
14 LEU HB2 14 LEU HN      3.039 # noe-37C.563
14 LEU QD1 14 LEU HN      4.474 # noe-37C.595
14 LEU HN 14 LEU QD1      4.295 # noe-37C.900
14 LEU HN 14 LEU QD2      4.425 # noe-37C.137
14 LEU QD2 14 LEU HN      4.592 # noe-37C.768
14 LEU QD2 14 LEU HN      4.592 # noe-37C.842
14 LEU QD2 14 LEU HN      4.582 # noe-37C.956
14 LEU HN 14 LEU HG      3.370 # noe-37C.135
14 LEU HG 14 LEU HN      3.423 # noe-37C.575
15 LEU HB3 12 TRP HA      4.069 # noe-37C.393
12 TRP HA 15 LEU HB2      3.570 # noe-37C.213
12 TRP HE3 15 LEU QD1      4.719 # noe-37C.819
15 LEU HG 12 TRP HA      3.656 # noe-37C.938
13 LYS+ HN 15 LEU HN      4.365 # noe-37C.721
15 LEU HN 13 LYS+ HN      4.140 # noe-37C.729
15 LEU HN 13 LYS+ HN      4.140 # noe-37C.800
14 LEU HN 15 LEU QD1      5.218 # noe-37C.746
14 LEU HN 15 LEU QD1      5.218 # noe-37C.818
15 LEU HN 14 LEU QD1      4.099 # noe-37C.743
15 LEU HN 14 LEU QD1      4.099 # noe-37C.815
15 LEU HN 14 LEU HN      3.047 # noe-37C.639
14 LEU HN 15 LEU HN      3.082 # noe-37C.652
15 LEU HA 15 LEU HB3      3.416 # noe-37C.247
15 LEU HB3 15 LEU HA      3.452 # noe-37C.394
15 LEU HA 15 LEU HB2      3.127 # noe-37C.246
15 LEU HB2 15 LEU HA      3.133 # noe-37C.373
15 LEU HB2 15 LEU HB3      2.519 # noe-37C.374
15 LEU HB3 15 LEU HB2      2.531 # noe-37C.395
15 LEU HA 15 LEU QD1      3.506 # noe-37C.248
15 LEU QD1 15 LEU HA      3.548 # noe-37C.444
15 LEU HB2 15 LEU QD2      3.144 # noe-37C.375
15 LEU HN 15 LEU HA      2.775 # noe-37C.94
15 LEU HA 15 LEU HN      2.772 # noe-37C.472
15 LEU HN 15 LEU HB3      3.386 # noe-37C.96
15 LEU HB3 15 LEU HN      3.434 # noe-37C.850
15 LEU HN 15 LEU HB2      2.778 # noe-37C.95
15 LEU HN 15 LEU QD1      4.394 # noe-37C.97
15 LEU QD2 15 LEU HN      4.146 # noe-37C.594
15 LEU HG 15 LEU HN      2.858 # noe-37C.936
16 LYS+ HN 12 TRP HA      4.365 # noe-37C.105
16 LYS+ HB2 13 LYS+ HA      3.452 # noe-37C.376
16 LYS+ HN 13 LYS+ HA      3.937 # noe-37C.107
13 LYS+ HA 16 LYS+ HN      3.929 # noe-37C.490
16 LYS+ HN 13 LYS+ HB2      4.196 # noe-37C.108
13 LYS+ HB2 16 LYS+ HN      4.089 # noe-37C.558
16 LYS+ HN 14 LEU HN      4.173 # noe-37C.643
14 LEU HN 16 LYS+ HN      4.425 # noe-37C.654
16 LYS+ HE3 15 LEU HN      4.184 # noe-37C.778
16 LYS+ HE3 15 LEU HN      4.184 # noe-37C.853
15 LEU HA 16 LYS+ HN      3.413 # noe-37C.473
16 LYS+ HN 15 LEU HB3      3.801 # noe-37C.109
15 LEU HB3 16 LYS+ HN      3.862 # noe-37C.578
16 LYS+ HN 15 LEU QD1      5.085 # noe-37C.112
15 LEU HN 16 LYS+ HN      2.963 # noe-37C.638
16 LYS+ HN 15 LEU HN      3.095 # noe-37C.641
16 LYS+ HA 16 LYS+ HB2      2.883 # noe-37C.260
16 LYS+ HA 16 LYS+ HD3      3.794 # noe-37C.261
16 LYS+ HD3 16 LYS+ HA      3.962 # noe-37C.954
16 LYS+ HA 16 LYS+ HG3      3.978 # noe-37C.262
16 LYS+ HG3 16 LYS+ HA      4.295 # noe-37C.411
16 LYS+ HB2 16 LYS+ HG3      3.354 # noe-37C.378
16 LYS+ HD3 16 LYS+ HG3      3.282 # noe-37C.382
16 LYS+ HA 16 LYS+ HG2      4.109 # noe-37C.264
16 LYS+ HG2 16 LYS+ HA      4.140 # noe-37C.406
16 LYS+ HB2 16 LYS+ HG2      3.178 # noe-37C.377
16 LYS+ HN 16 LYS+ HA      3.109 # noe-37C.106
16 LYS+ HA 16 LYS+ HN      3.208 # noe-37C.483
16 LYS+ HB2 16 LYS+ HN      2.680 # noe-37C.565
16 LYS+ HN 16 LYS+ HG3      4.089 # noe-37C.111
16 LYS+ HG3 16 LYS+ HN      4.308 # noe-37C.582
16 LYS+ HN 16 LYS+ HG2      4.022 # noe-37C.110
17 LYS+ HN 14 LEU HN      4.622 # noe-37C.699
17 LYS+ HN 15 LEU HN      4.642 # noe-37C.719
15 LEU HN 17 LYS+ HN      4.269 # noe-37C.724
17 LYS+ HN 15 LEU HN      4.642 # noe-37C.790
15 LEU HN 17 LYS+ HN      4.269 # noe-37C.795
17 LYS+ HA 16 LYS+ HA      4.441 # noe-37C.241
16 LYS+ HA 17 LYS+ HB2      3.914 # noe-37C.263
17 LYS+ HB2 16 LYS+ HA      4.059 # noe-37C.941
17 LYS+ HN 16 LYS+ HA      3.486 # noe-37C.122
16 LYS+ HA 17 LYS+ HN      3.535 # noe-37C.481
17 LYS+ HN 16 LYS+ HB3      4.336 # noe-37C.120
17 LYS+ HN 16 LYS+ HB2      3.266 # noe-37C.119
16 LYS+ HB2 17 LYS+ HN      3.304 # noe-37C.566
16 LYS+ HN 17 LYS+ HN      3.042 # noe-37C.642
17 LYS+ HN 16 LYS+ HN      3.087 # noe-37C.649
17 LYS+ HA 17 LYS+ HB3      3.745 # noe-37C.920
17 LYS+ HA 17 LYS+ HB2      2.900 # noe-37C.238
17 LYS+ HB2 17 LYS+ HA      2.908 # noe-37C.362
17 LYS+ HE3 17 LYS+ HB3      3.119 # noe-37C.308
17 LYS+ HA 17 LYS+ HG3      3.929 # noe-37C.240
17 LYS+ HG3 17 LYS+ HA      4.079 # noe-37C.415
17 LYS+ HB2 17 LYS+ HG3      3.583 # noe-37C.368
17 LYS+ HA 17 LYS+ HG2      4.140 # noe-37C.239
17 LYS+ HG2 17 LYS+ HA      4.336 # noe-37C.398
17 LYS+ HB3 17 LYS+ HG2      3.062 # noe-37C.387
17 LYS+ HB2 17 LYS+ HG2      3.180 # noe-37C.367
17 LYS+ HA 17 LYS+ HN      3.060 # noe-37C.470
17 LYS+ HN 17 LYS+ HB2      2.898 # noe-37C.123
17 LYS+ HB2 17 LYS+ HN      2.970 # noe-37C.556
17 LYS+ HN 17 LYS+ HG3      4.410 # noe-37C.124
17 LYS+ HN 17 LYS+ HG2      4.140 # noe-37C.121
17 LYS+ HG2 17 LYS+ HN      4.425 # noe-37C.581
18 TRP HD1 14 LEU QD2      4.295 # noe-37C.187
18 TRP HE1 14 LEU QD2      4.940 # noe-37C.2
18 TRP HZ2 14 LEU QD2      5.068 # noe-37C.167
15 LEU HA 18 TRP HB3      3.921 # noe-37C.245
15 LEU HA 18 TRP HB2      4.109 # noe-37C.242
18 TRP HD1 15 LEU HA      4.050 # noe-37C.917
18 TRP HD1 15 LEU QD1      4.225 # noe-37C.749
18 TRP HD1 15 LEU QD1      4.225 # noe-37C.821
18 TRP HE3 15 LEU QD2      4.707 # noe-37C.154
18 TRP HZ2 15 LEU QD2      5.198 # noe-37C.168
18 TRP HD1 16 LYS+ HA      4.582 # noe-37C.716
18 TRP HE3 16 LYS+ HB2      4.563 # noe-37C.740
18 TRP HE3 16 LYS+ HB2      4.563 # noe-37C.812
18 TRP HE3 16 LYS+ HD3      4.642 # noe-37C.153
18 TRP HN 16 LYS+ HA      4.031 # noe-37C.71
16 LYS+ HB2 18 TRP HN      3.745 # noe-37C.564
16 LYS+ HD3 18 TRP HN      3.733 # noe-37C.782
16 LYS+ HD3 18 TRP HN      3.733 # noe-37C.857
18 TRP HN 16 LYS+ HN      3.884 # noe-37C.628
16 LYS+ HN 18 TRP HN      4.022 # noe-37C.640
18 TRP HZ3 16 LYS+ HD3      4.508 # noe-37C.199
18 TRP HD1 17 LYS+ HG2      4.730 # noe-37C.715
18 TRP HE3 17 LYS+ HA      4.119 # noe-37C.151
18 TRP HN 17 LYS+ HA      3.125 # noe-37C.75
17 LYS+ HA 18 TRP HN      3.121 # noe-37C.469
18 TRP HN 17 LYS+ HB2      3.180 # noe-37C.74
17 LYS+ HB2 18 TRP HN      3.199 # noe-37C.568
18 TRP HN 17 LYS+ HN      3.041 # noe-37C.629
17 LYS+ HN 18 TRP HN      3.080 # noe-37C.648
18 TRP HB3 18 TRP HA      3.463 # noe-37C.289
18 TRP HB2 18 TRP HA      3.510 # noe-37C.283
18 TRP HB2 18 TRP HB3      2.696 # noe-37C.284
18 TRP HB3 18 TRP HB2      2.711 # noe-37C.290
18 TRP HD1 18 TRP HA      3.208 # noe-37C.184
18 TRP HD1 18 TRP HB3      3.621 # noe-37C.183
18 TRP HB3 18 TRP HD1      3.876 # noe-37C.772
18 TRP HB3 18 TRP HD1      3.876 # noe-37C.847
18 TRP HD1 18 TRP HB2      3.884 # noe-37C.186
18 TRP HB2 18 TRP HD1      3.841 # noe-37C.497
18 TRP HD1 18 TRP HE1      2.759 # noe-37C.607
18 TRP HE1 18 TRP HD1      2.727 # noe-37C.610
18 TRP HE3 18 TRP HA      3.929 # noe-37C.150
18 TRP HE3 18 TRP HB3      3.869 # noe-37C.152
18 TRP HB3 18 TRP HE3      3.914 # noe-37C.505
18 TRP HE3 18 TRP HB2      3.710 # noe-37C.149
18 TRP HB2 18 TRP HE3      3.710 # noe-37C.496
18 TRP HE3 18 TRP HH2      4.040 # noe-37C.658
18 TRP HH2 18 TRP HE3      3.855 # noe-37C.683
18 TRP HB3 18 TRP HN      3.117 # noe-37C.779
18 TRP HB3 18 TRP HN      3.117 # noe-37C.854
18 TRP HN 18 TRP HB2      3.235 # noe-37C.72
18 TRP HB2 18 TRP HN      3.235 # noe-37C.495
18 TRP HN 18 TRP HD1      3.814 # noe-37C.632
18 TRP HD1 18 TRP HN      3.579 # noe-37C.677
18 TRP HN 18 TRP HE3      4.474 # noe-37C.630
18 TRP HE3 18 TRP HN      4.269 # noe-37C.656
18 TRP HZ2 18 TRP HH2      2.721 # noe-37C.667
18 TRP HH2 18 TRP HZ2      2.826 # noe-37C.678
18 TRP HE3 18 TRP HZ3      2.960 # noe-37C.659
18 TRP HZ3 18 TRP HE3      2.903 # noe-37C.691
18 TRP HZ2 18 TRP HZ3      3.862 # noe-37C.668
19 LYS+ HN 16 LYS+ HN      4.394 # noe-37C.624
17 LYS+ HA 19 LYS+ HN      3.710 # noe-37C.764
17 LYS+ HA 19 LYS+ HN      3.710 # noe-37C.837
17 LYS+ HA 19 LYS+ HN      3.710 # noe-37C.923
19 LYS+ HN 17 LYS+ HB3      3.656 # noe-37C.62
19 LYS+ HN 17 LYS+ HN      4.379 # noe-37C.625
17 LYS+ HN 19 LYS+ HN      4.336 # noe-37C.720
17 LYS+ HN 19 LYS+ HN      4.336 # noe-37C.791
18 TRP HD1 19 LYS+ HA      4.707 # noe-37C.713
19 LYS+ HN 18 TRP HA      3.129 # noe-37C.65
19 LYS+ HN 18 TRP HB3      3.716 # noe-37C.68
18 TRP HB3 19 LYS+ HN      3.631 # noe-37C.770
18 TRP HB3 19 LYS+ HN      3.631 # noe-37C.845
19 LYS+ HN 18 TRP HB2      3.666 # noe-37C.67
18 TRP HB2 19 LYS+ HN      3.561 # noe-37C.771
18 TRP HB2 19 LYS+ HN      3.561 # noe-37C.846
19 LYS+ HN 18 TRP HD1      4.244 # noe-37C.627
18 TRP HD1 19 LYS+ HN      4.004 # noe-37C.711
19 LYS+ HN 18 TRP HE3      4.151 # noe-37C.626
18 TRP HE3 19 LYS+ HN      4.109 # noe-37C.657
19 LYS+ HB3 19 LYS+ HA      3.651 # noe-37C.369
19 LYS+ HA 19 LYS+ HB3      3.606 # noe-37C.758
19 LYS+ HA 19 LYS+ HB3      3.606 # noe-37C.831
19 LYS+ HA 19 LYS+ HB3      3.606 # noe-37C.922
19 LYS+ HA 19 LYS+ HG3      4.269 # noe-37C.253
19 LYS+ HA 19 LYS+ HG3      4.441 # noe-37C.254
19 LYS+ HG3 19 LYS+ HA      4.441 # noe-37C.403
19 LYS+ HN 19 LYS+ HA      3.086 # noe-37C.66
19 LYS+ HA 19 LYS+ HN      3.131 # noe-37C.476
19 LYS+ HN 19 LYS+ HG3      4.069 # noe-37C.63
20 MET HB3 17 LYS+ HA      4.394 # noe-37C.341
17 LYS+ HN 20 MET HN      4.208 # noe-37C.700
20 MET HN 19 LYS+ HA      3.131 # noe-37C.99
19 LYS+ HA 20 MET HN      3.135 # noe-37C.477
19 LYS+ HB3 20 MET HN      3.841 # noe-37C.560
19 LYS+ HN 20 MET HN      2.754 # noe-37C.623
20 MET HA 20 MET HB3      3.232 # noe-37C.211
20 MET HB3 20 MET HA      3.301 # noe-37C.338
20 MET HA 20 MET HB2      3.268 # noe-37C.208
20 MET QE 20 MET HA      4.099 # noe-37C.332
20 MET HA 20 MET HG3      4.196 # noe-37C.207
20 MET HG3 20 MET HA      3.987 # noe-37C.315
20 MET HB3 20 MET HN      3.178 # noe-37C.545
20 MET HN 20 MET HB2      3.570 # noe-37C.102
20 MET QE 20 MET HN      4.642 # noe-37C.543
20 MET HN 20 MET HG3      4.151 # noe-37C.101
20 MET HG3 20 MET HN      4.256 # noe-37C.537
20 MET HN 20 MET HG2      4.119 # noe-37C.100
20 MET HG2 20 MET HN      4.173 # noe-37C.536
21 ARG+ HN 20 MET HA      2.900 # noe-37C.53
20 MET HA 21 ARG+ HN      2.838 # noe-37C.451
21 ARG+ HN 20 MET HB3      4.013 # noe-37C.58
21 ARG+ HN 20 MET HB2      4.069 # noe-37C.57
21 ARG+ HA 21 ARG+ HB3      3.456 # noe-37C.223
21 ARG+ HB3 21 ARG+ HA      3.474 # noe-37C.359
21 ARG+ HA 21 ARG+ HB2      3.420 # noe-37C.222
21 ARG+ HB2 21 ARG+ HA      3.380 # noe-37C.351
21 ARG+ HB2 21 ARG+ HB3      2.489 # noe-37C.350
21 ARG+ HA 21 ARG+ HD3      3.937 # noe-37C.221
21 ARG+ HD3 21 ARG+ HB3      3.953 # noe-37C.296
21 ARG+ HB3 21 ARG+ HD3      4.050 # noe-37C.363
21 ARG+ HD3 21 ARG+ HB2      4.099 # noe-37C.295
21 ARG+ HB2 21 ARG+ HD3      4.059 # noe-37C.353
21 ARG+ HE 21 ARG+ HD3      3.182 # noe-37C.182
21 ARG+ HD3 21 ARG+ HE      3.274 # noe-37C.514
21 ARG+ HA 21 ARG+ HG3      3.459 # noe-37C.220
21 ARG+ HG3 21 ARG+ HB3      3.046 # noe-37C.386
21 ARG+ HD3 21 ARG+ HG3      3.502 # noe-37C.294
21 ARG+ HA 21 ARG+ HG2      3.592 # noe-37C.219
21 ARG+ HG2 21 ARG+ HA      3.656 # noe-37C.383
21 ARG+ HB2 21 ARG+ HG2      3.310 # noe-37C.352
21 ARG+ HG2 21 ARG+ HB2      3.413 # noe-37C.381
21 ARG+ HN 21 ARG+ HA      3.182 # noe-37C.54
21 ARG+ HA 21 ARG+ HN      3.222 # noe-37C.459
21 ARG+ HN 21 ARG+ HB3      2.856 # noe-37C.60
21 ARG+ HN 21 ARG+ HB2      3.602 # noe-37C.59
21 ARG+ HB2 21 ARG+ HN      3.606 # noe-37C.552
21 ARG+ HG3 21 ARG+ HN      3.757 # noe-37C.571
19 LYS+ HA 22 ARG+ HB2      3.498 # noe-37C.252
22 ARG+ HB2 19 LYS+ HA      3.535 # noe-37C.356
21 ARG+ HB3 22 ARG+ HE      4.022 # noe-37C.557
22 ARG+ HN 21 ARG+ HA      2.623 # noe-37C.30
21 ARG+ HA 22 ARG+ HN      2.637 # noe-37C.458
21 ARG+ HB3 22 ARG+ HN      3.467 # noe-37C.554
22 ARG+ HN 21 ARG+ HB2      3.970 # noe-37C.31
21 ARG+ HB2 22 ARG+ HN      3.978 # noe-37C.551
21 ARG+ HG3 22 ARG+ HN      4.109 # noe-37C.784
21 ARG+ HG3 22 ARG+ HN      4.109 # noe-37C.859
21 ARG+ HG3 22 ARG+ HN      4.109 # noe-37C.863
21 ARG+ HN 22 ARG+ HN      3.301 # noe-37C.621
22 ARG+ HA 22 ARG+ HB3      3.651 # noe-37C.237
22 ARG+ HB3 22 ARG+ HA      3.606 # noe-37C.371
22 ARG+ HA 22 ARG+ HB2      3.535 # noe-37C.236
22 ARG+ HB2 22 ARG+ HA      3.535 # noe-37C.357
22 ARG+ HA 22 ARG+ HD3      4.425 # noe-37C.234
22 ARG+ HD3 22 ARG+ HA      4.244 # noe-37C.298
22 ARG+ HD3 22 ARG+ HB3      4.244 # noe-37C.300
22 ARG+ HB3 22 ARG+ HD3      4.379 # noe-37C.370
22 ARG+ HD3 22 ARG+ HB2      4.140 # noe-37C.299
22 ARG+ HB2 22 ARG+ HD3      4.099 # noe-37C.358
22 ARG+ HE 22 ARG+ HB3      4.350 # noe-37C.742
22 ARG+ HE 22 ARG+ HB3      4.350 # noe-37C.814
22 ARG+ HE 22 ARG+ HB2      4.295 # noe-37C.741
22 ARG+ HE 22 ARG+ HB2      4.295 # noe-37C.813
22 ARG+ HE 22 ARG+ HD3      3.263 # noe-37C.192
22 ARG+ HD3 22 ARG+ HE      3.339 # noe-37C.517
22 ARG+ HA 22 ARG+ HG3      3.855 # noe-37C.235
22 ARG+ HG3 22 ARG+ HA      4.079 # noe-37C.391
22 ARG+ HD3 22 ARG+ HG3      3.522 # noe-37C.301
22 ARG+ HG3 22 ARG+ HD3      3.631 # noe-37C.392
22 ARG+ HE 22 ARG+ HG3      3.862 # noe-37C.193
22 ARG+ HA 22 ARG+ HN      3.024 # noe-37C.480
22 ARG+ HN 22 ARG+ HA      3.069 # noe-37C.825
22 ARG+ HN 22 ARG+ HB3      3.393 # noe-37C.33
22 ARG+ HB3 22 ARG+ HN      3.535 # noe-37C.561
22 ARG+ HN 22 ARG+ HB2      3.327 # noe-37C.32
22 ARG+ HN 22 ARG+ HG3      3.733 # noe-37C.34
22 ARG+ HG3 22 ARG+ HN      3.855 # noe-37C.576
23 ASN HN 21 ARG+ HA      2.734 # noe-37C.886
21 ARG+ HG3 23 ASN HN      4.162 # noe-37C.785
21 ARG+ HG3 23 ASN HN      4.162 # noe-37C.860
21 ARG+ HG3 23 ASN HN      4.162 # noe-37C.864
23 ASN HB3 22 ARG+ HN      3.953 # noe-37C.844
22 ARG+ HA 23 ASN HN      2.762 # noe-37C.467
23 ASN HN 22 ARG+ HA      2.789 # noe-37C.752
23 ASN HN 22 ARG+ HB3      3.862 # noe-37C.23
22 ARG+ HB3 23 ASN HN      4.130 # noe-37C.851
23 ASN HN 22 ARG+ HB2      3.820 # noe-37C.22
22 ARG+ HB2 23 ASN HN      3.794 # noe-37C.843
23 ASN HB2 23 ASN HA      2.711 # noe-37C.952
23 ASN QD2 23 ASN HB3      3.565 # noe-37C.200
23 ASN HB3 23 ASN QD2      3.848 # noe-37C.535
23 ASN HD22 23 ASN HB3      3.427 # noe-37C.155
23 ASN HB2 23 ASN HD22      3.682 # noe-37C.534
23 ASN HD22 23 ASN QD2      2.200 # noe-37C.660
23 ASN QD2 23 ASN HD22      2.200 # noe-37C.692
23 ASN HN 23 ASN HA      3.113 # noe-37C.16
23 ASN HN 23 ASN HB3      2.799 # noe-37C.18
23 ASN HB2 23 ASN HN      2.809 # noe-37C.532
24 GLN HN 23 ASN HA      3.002 # noe-37C.48
24 GLN HN 23 ASN HB3      3.312 # noe-37C.50
23 ASN HB2 24 GLN HN      3.336 # noe-37C.533
23 ASN HN 24 GLN HN      3.185 # noe-37C.614
24 GLN HN 23 ASN HN      3.266 # noe-37C.619
24 GLN HA 24 GLN HB3      2.964 # noe-37C.244
24 GLN HB3 24 GLN HA      3.029 # noe-37C.355
24 GLN HE22 24 GLN HE21      2.535 # noe-37C.670
24 GLN HE21 24 GLN HE22      2.560 # noe-37C.695
24 GLN HA 24 GLN HG3      3.579 # noe-37C.243
24 GLN HG3 24 GLN HB2      2.937 # noe-37C.328
24 GLN HB2 24 GLN HG3      2.933 # noe-37C.354
24 GLN HE21 24 GLN HG3      4.602 # noe-37C.710
24 GLN HE22 24 GLN HG2      4.602 # noe-37C.709
24 GLN HN 24 GLN HA      3.222 # noe-37C.49
24 GLN HA 24 GLN HN      3.187 # noe-37C.471
24 GLN HN 24 GLN HB2      2.979 # noe-37C.52
24 GLN HN 24 GLN HG2      3.727 # noe-37C.51
24 GLN HB3 25 PHE HN      3.641 # noe-37C.553
25 PHE HN 24 GLN HB2      3.579 # noe-37C.93
24 GLN HN 25 PHE HN      3.143 # noe-37C.620
25 PHE HN 24 GLN HN      3.150 # noe-37C.635
25 PHE HB3 25 PHE HA      3.423 # noe-37C.302
25 PHE HB2 25 PHE HA      3.814 # noe-37C.306
25 PHE HD1 25 PHE HA      3.522 # noe-37C.195
25 PHE HD1 25 PHE HB3      3.282 # noe-37C.196
25 PHE HB3 25 PHE HD1      3.423 # noe-37C.520
25 PHE HD1 25 PHE HB2      3.258 # noe-37C.197
25 PHE HB2 25 PHE HD1      3.486 # noe-37C.526
25 PHE HD1 25 PHE HE1      2.392 # noe-37C.687
25 PHE HN 25 PHE HA      3.403 # noe-37C.90
25 PHE HN 25 PHE HB3      3.441 # noe-37C.91
25 PHE HB3 25 PHE HN      3.364 # noe-37C.518
25 PHE HN 25 PHE HB2      3.315 # noe-37C.92
25 PHE HB2 25 PHE HN      3.282 # noe-37C.524
25 PHE HN 25 PHE HD1      3.807 # noe-37C.637
25 PHE HD1 25 PHE HN      3.616 # noe-37C.688
26 TRP HD1 23 ASN HB2      4.394 # noe-37C.739
26 TRP HD1 23 ASN HB2      4.394 # noe-37C.811
26 TRP HH2 24 GLN HB2      4.365 # noe-37C.181
26 TRP HE3 25 PHE HE1      3.794 # noe-37C.661
25 PHE HE1 26 TRP HE3      4.031 # noe-37C.684
26 TRP HN 25 PHE HA      3.171 # noe-37C.114
26 TRP HN 25 PHE HB3      3.970 # noe-37C.117
25 PHE HB3 26 TRP HN      3.953 # noe-37C.519
26 TRP HN 25 PHE HB2      4.244 # noe-37C.118
25 PHE HB2 26 TRP HN      4.196 # noe-37C.525
25 PHE HD1 26 TRP HN      4.322 # noe-37C.732
26 TRP HN 25 PHE HD1      4.563 # noe-37C.735
26 TRP HN 25 PHE HD1      4.563 # noe-37C.806
25 PHE HN 26 TRP HN      3.180 # noe-37C.636
26 TRP HN 25 PHE HN      3.225 # noe-37C.644
26 TRP HB3 26 TRP HA      3.621 # noe-37C.288
26 TRP HB2 26 TRP HA      3.775 # noe-37C.293
26 TRP HD1 26 TRP HA      3.937 # noe-37C.177
26 TRP HD1 26 TRP HB3      3.498 # noe-37C.178
26 TRP HB3 26 TRP HD1      3.597 # noe-37C.504
26 TRP HD1 26 TRP HB2      3.570 # noe-37C.179
26 TRP HB2 26 TRP HD1      3.716 # noe-37C.513
26 TRP HD1 26 TRP HE1      2.822 # noe-37C.606
26 TRP HE3 26 TRP HA      3.721 # noe-37C.157
26 TRP HB3 26 TRP HE3      3.574 # noe-37C.506
26 TRP HE3 26 TRP HB2      3.383 # noe-37C.158
26 TRP HE1 26 TRP HH2      2.785 # noe-37C.948
26 TRP HN 26 TRP HA      3.621 # noe-37C.113
26 TRP HN 26 TRP HB3      3.502 # noe-37C.115
26 TRP HB3 26 TRP HN      3.526 # noe-37C.502
26 TRP HN 26 TRP HB2      3.441 # noe-37C.116
26 TRP HB2 26 TRP HN      3.413 # noe-37C.510
26 TRP HN 26 TRP HD1      3.820 # noe-37C.646
26 TRP HD1 26 TRP HN      3.565 # noe-37C.674
26 TRP HN 26 TRP HE3      4.099 # noe-37C.647
26 TRP HE3 26 TRP HN      4.069 # noe-37C.662
26 TRP HZ2 26 TRP HE1      3.459 # noe-37C.604
26 TRP HE3 26 TRP HZ3      2.903 # noe-37C.663
26 TRP HZ3 26 TRP HE3      2.900 # noe-37C.685
26 TRP HH2 26 TRP HZ3      2.821 # noe-37C.676
26 TRP HZ3 26 TRP HH2      2.918 # noe-37C.686
27 VAL HB 24 GLN HA      4.474 # noe-37C.342
27 VAL HN 24 GLN HA      4.563 # noe-37C.126
26 TRP HE3 27 VAL QG1      5.140 # noe-37C.160
27 VAL HN 26 TRP HA      3.242 # noe-37C.125
27 VAL HN 26 TRP HB3      4.308 # noe-37C.128
26 TRP HB3 27 VAL HN      4.269 # noe-37C.503
27 VAL HN 26 TRP HB2      4.256 # noe-37C.129
26 TRP HB2 27 VAL HN      4.336 # noe-37C.511
26 TRP HN 27 VAL HN      3.445 # noe-37C.645
27 VAL HN 26 TRP HN      3.552 # noe-37C.651
27 VAL HA 27 VAL HB      3.514 # noe-37C.266
27 VAL HB 27 VAL HA      3.522 # noe-37C.343
27 VAL QG1 27 VAL HB      3.305 # noe-37C.438
27 VAL HA 27 VAL QG2      3.502 # noe-37C.267
27 VAL QG2 27 VAL HA      3.556 # noe-37C.432
27 VAL HB 27 VAL QG2      3.286 # noe-37C.346
27 VAL HN 27 VAL HA      3.490 # noe-37C.127
27 VAL HA 27 VAL HN      3.467 # noe-37C.484
27 VAL HN 27 VAL HB      3.386 # noe-37C.130
27 VAL QG1 27 VAL HN      3.781 # noe-37C.590
27 VAL HN 27 VAL QG2      3.666 # noe-37C.131
28 LYS+ HA 27 VAL HA      4.295 # noe-37C.228
27 VAL HA 28 LYS+ HA      4.379 # noe-37C.265
28 LYS+ HA 27 VAL QG2      4.940 # noe-37C.230
28 LYS+ HB3 27 VAL QG2      3.769 # noe-37C.372
28 LYS+ HN 27 VAL HA      2.698 # noe-37C.56
27 VAL HA 28 LYS+ HN      2.676 # noe-37C.482
27 VAL HB 28 LYS+ HN      3.834 # noe-37C.548
28 LYS+ HN 27 VAL HB      3.862 # noe-37C.704
28 LYS+ HN 27 VAL QG2      4.238 # noe-37C.64
28 LYS+ HN 27 VAL HN      3.682 # noe-37C.622
27 VAL HN 28 LYS+ HN      3.688 # noe-37C.650
28 LYS+ HA 28 LYS+ HB3      3.763 # noe-37C.232
28 LYS+ HB3 28 LYS+ HA      3.827 # noe-37C.786
28 LYS+ HB3 28 LYS+ HA      3.827 # noe-37C.861
28 LYS+ HB3 28 LYS+ HA      3.827 # noe-37C.865
28 LYS+ HA 28 LYS+ HB2      3.641 # noe-37C.229
28 LYS+ HB2 28 LYS+ HA      3.716 # noe-37C.361
28 LYS+ HA 28 LYS+ HE3      4.441 # noe-37C.231
28 LYS+ HN 28 LYS+ HA      3.389 # noe-37C.55
28 LYS+ HA 28 LYS+ HN      3.459 # noe-37C.465
28 LYS+ HN 28 LYS+ HB3      3.459 # noe-37C.61
28 LYS+ HB3 28 LYS+ HN      3.543 # noe-37C.562
26 TRP HE3 29 VAL QG1      5.103 # noe-37C.159
29 VAL HN 27 VAL HA      4.282 # noe-37C.87
29 VAL HN 28 LYS+ HA      2.818 # noe-37C.86
28 LYS+ HA 29 VAL HN      2.797 # noe-37C.466
28 LYS+ HN 29 VAL HN      3.203 # noe-37C.731
28 LYS+ HN 29 VAL HN      3.203 # noe-37C.802
29 VAL HA 29 VAL HB      3.693 # noe-37C.251
29 VAL HB 29 VAL HA      3.769 # noe-37C.335
29 VAL HA 29 VAL QG1      3.707 # noe-37C.255
29 VAL QG1 29 VAL HA      3.834 # noe-37C.428
29 VAL HB 29 VAL QG1      3.409 # noe-37C.340
29 VAL QG1 29 VAL HB      3.478 # noe-37C.425
29 VAL HN 29 VAL HB      3.494 # noe-37C.88
29 VAL HB 29 VAL HN      3.427 # noe-37C.572
29 VAL HN 29 VAL QG1      3.837 # noe-37C.89
29 VAL QG1 29 VAL HN      3.766 # noe-37C.585
30 GLN HN 28 LYS+ HA      4.119 # noe-37C.889
28 LYS+ HB2 30 GLN HN      4.295 # noe-37C.555
30 GLN HN 29 VAL HA      2.898 # noe-37C.10
29 VAL HA 30 GLN HN      2.834 # noe-37C.475
30 GLN HN 29 VAL HB      4.031 # noe-37C.12
29 VAL HB 30 GLN HN      4.013 # noe-37C.544
30 GLN HN 29 VAL QG1      4.466 # noe-37C.15
30 GLN HN 29 VAL HN      3.677 # noe-37C.612
29 VAL HN 30 GLN HN      3.688 # noe-37C.634
30 GLN HG3 30 GLN HA      4.059 # noe-37C.323
30 GLN HB3 30 GLN HG3      3.869 # noe-37C.345
30 GLN HG3 30 GLN HB2      3.287 # noe-37C.324
30 GLN HA 30 GLN HN      2.873 # noe-37C.456
30 GLN HN 30 GLN HB3      3.769 # noe-37C.13
30 GLN HB3 30 GLN HN      3.841 # noe-37C.550
30 GLN HB2 30 GLN HN      3.978 # noe-37C.542
30 GLN HN 30 GLN HB2      4.173 # noe-37C.745
30 GLN HN 30 GLN HB2      4.173 # noe-37C.817
30 GLN HN 30 GLN HG3      4.269 # noe-37C.11
30 GLN HG3 30 GLN HN      4.308 # noe-37C.780
30 GLN HG3 30 GLN HN      4.308 # noe-37C.855
31 ARG+ HB2 31 ARG+ HA      4.491 # noe-37C.349
31 ARG+ HB3 31 ARG+ HB2      2.480 # noe-37C.360
31 ARG+ HN 31 ARG+ HB3      4.256 # noe-37C.14

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    HA   PRO   1           HA       PRO   1 -11.242   9.053  -7.106
    2   1HB   PRO   1          1HB       PRO   1 -13.167  10.004  -5.428
    3   2HB   PRO   1          2HB       PRO   1 -13.470   9.774  -7.181
    4   1HG   PRO   1          1HG       PRO   1 -14.136   7.852  -4.933
    5   2HG   PRO   1          2HG       PRO   1 -15.241   8.458  -6.210
    6   1HD   PRO   1          1HD       PRO   1 -13.963   6.063  -6.454
    7   2HD   PRO   1          2HD       PRO   1 -14.149   7.141  -7.871
    8    HA   PRO   2           HA       PRO   2  -9.191   8.579  -3.239
    9   1HB   PRO   2          1HB       PRO   2  -9.031  11.105  -2.232
   10   2HB   PRO   2          2HB       PRO   2  -8.221  10.646  -3.766
   11   1HG   PRO   2          1HG       PRO   2 -10.932  11.965  -3.442
   12   2HG   PRO   2          2HG       PRO   2  -9.571  12.513  -4.475
   13   1HD   PRO   2          1HD       PRO   2 -11.606  11.006  -5.485
   14   2HD   PRO   2          2HD       PRO   2  -9.917  10.711  -5.999
   15    H    LEU   3           H        LEU   3 -10.083   7.519  -1.553
   16    HA   LEU   3           HA       LEU   3 -11.444   8.694   0.549
   17   1HB   LEU   3          1HB       LEU   3 -13.155   8.400  -1.758
   18   2HB   LEU   3          2HB       LEU   3 -13.725   7.330  -0.455
   19    HG   LEU   3           HG       LEU   3 -12.889  10.004   0.483
   20   1HD1  LEU   3          1HD1      LEU   3 -13.836  10.624  -1.722
   21   2HD1  LEU   3          2HD1      LEU   3 -15.312   9.703  -1.344
   22   3HD1  LEU   3          3HD1      LEU   3 -14.898  11.150  -0.394
   23   1HD2  LEU   3          1HD2      LEU   3 -15.529   8.510   0.738
   24   2HD2  LEU   3          2HD2      LEU   3 -14.114   8.182   1.766
   25   3HD2  LEU   3          3HD2      LEU   3 -14.894   9.782   1.809
   26    H    SER   4           H        SER   4 -11.679   7.227   2.209
   27    HA   SER   4           HA       SER   4 -11.895   4.375   1.643
   28   1HB   SER   4          1HB       SER   4  -9.663   4.040   1.530
   29   2HB   SER   4          2HB       SER   4  -9.300   5.670   2.148
   30    HG   SER   4           HG       SER   4  -9.340   4.939   4.158
   31    H    GLN   5           H        GLN   5 -13.359   3.740   3.103
   32    HA   GLN   5           HA       GLN   5 -12.964   4.481   5.921
   33   1HB   GLN   5          1HB       GLN   5 -14.495   6.191   4.652
   34   2HB   GLN   5          2HB       GLN   5 -15.701   4.884   4.716
   35   1HG   GLN   5          1HG       GLN   5 -14.176   5.831   7.166
   36   2HG   GLN   5          2HG       GLN   5 -15.724   6.547   6.667
   37   1HE2  GLN   5          1HE2      GLN   5 -14.149   3.886   8.242
   38   2HE2  GLN   5          2HE2      GLN   5 -15.583   2.950   8.605
   39    H    GLU   6           H        GLU   6 -16.005   3.369   4.486
   40    HA   GLU   6           HA       GLU   6 -15.384   0.628   5.483
   41   1HB   GLU   6          1HB       GLU   6 -17.701   0.460   6.242
   42   2HB   GLU   6          2HB       GLU   6 -16.921   1.868   7.003
   43   1HG   GLU   6          1HG       GLU   6 -17.869   3.209   4.986
   44   2HG   GLU   6          2HG       GLU   6 -18.928   1.804   4.736
   45    H    THR   7           H        THR   7 -14.875   1.451   2.837
   46    HA   THR   7           HA       THR   7 -16.451  -0.475   1.406
   47    HB   THR   7           HB       THR   7 -17.267   2.378   1.349
   48    HG1  THR   7           1HG      THR   7 -18.611   0.633   1.960
   49   1HG2  THR   7          1HG2      THR   7 -16.267   1.001  -1.043
   50   2HG2  THR   7          2HG2      THR   7 -17.972   1.484  -1.205
   51   3HG2  THR   7          3HG2      THR   7 -16.734   2.705  -0.827
   52    H    PHE   8           H        PHE   8 -15.361   2.560  -0.058
   53    HA   PHE   8           HA       PHE   8 -13.717   1.379  -1.965
   54   1HB   PHE   8          1HB       PHE   8 -12.496   3.791  -1.525
   55   2HB   PHE   8          2HB       PHE   8 -13.941   3.546  -2.521
   56    HD1  PHE   8           1HD      PHE   8 -13.713   3.384   1.201
   57    HD2  PHE   8           2HD      PHE   8 -15.089   5.585  -2.221
   58    HE1  PHE   8           1HE      PHE   8 -14.999   4.895   2.690
   59    HE2  PHE   8           2HE      PHE   8 -16.374   7.096  -0.732
   60    HZ   PHE   8           HZ       PHE   8 -16.329   6.751   1.723
   61    H    SER   9           H        SER   9 -13.188   1.741   1.440
   62    HA   SER   9           HA       SER   9 -10.287   1.648   1.303
   63   1HB   SER   9          1HB       SER   9 -11.697   2.663   3.172
   64   2HB   SER   9          2HB       SER   9 -12.075   0.997   3.669
   65    HG   SER   9           HG       SER   9 -10.211   1.959   4.709
   66    H    ASP  10           H        ASP  10 -12.945  -0.633   1.286
   67    HA   ASP  10           HA       ASP  10 -11.546  -2.915   2.266
   68   1HB   ASP  10          1HB       ASP  10 -14.123  -2.335   1.535
   69   2HB   ASP  10          2HB       ASP  10 -13.593  -3.340   0.169
   70    H    LEU  11           H        LEU  11 -11.500  -1.185  -0.779
   71    HA   LEU  11           HA       LEU  11 -10.271  -3.423  -2.223
   72   1HB   LEU  11          1HB       LEU  11  -9.997  -1.112  -3.755
   73   2HB   LEU  11          2HB       LEU  11 -11.324  -2.293  -3.865
   74    HG   LEU  11           HG       LEU  11 -12.520  -0.329  -3.489
   75   1HD1  LEU  11          1HD1      LEU  11 -11.948  -0.749  -0.576
   76   2HD1  LEU  11          2HD1      LEU  11 -13.508  -0.636  -1.425
   77   3HD1  LEU  11          3HD1      LEU  11 -12.560  -2.141  -1.502
   78   1HD2  LEU  11          1HD2      LEU  11 -11.738   1.532  -2.129
   79   2HD2  LEU  11          2HD2      LEU  11 -10.379   0.562  -1.512
   80   3HD2  LEU  11          3HD2      LEU  11 -10.423   1.043  -3.225
   81    H    TRP  12           H        TRP  12  -9.034  -0.230  -2.822
   82    HA   TRP  12           HA       TRP  12  -6.618  -0.060  -3.108
   83   1HB   TRP  12          1HB       TRP  12  -6.947   0.649  -0.221
   84   2HB   TRP  12          2HB       TRP  12  -6.175   1.556  -1.529
   85    HD1  TRP  12           HD       TRP  12  -8.735   2.194   0.670
   86    HE1  TRP  12           1HE      TRP  12 -10.697   3.517  -0.272
   87    HE3  TRP  12           3HE      TRP  12  -7.900   1.433  -4.322
   88    HZ2  TRP  12           2HZ      TRP  12 -11.782   4.172  -2.874
   89    HZ3  TRP  12           3HZ      TRP  12  -9.416   2.421  -5.999
   90    HH2  TRP  12           HH       TRP  12 -11.357   3.789  -5.294
   91    H    LYS  13           H        LYS  13  -7.732  -2.037  -0.369
   92    HA   LYS  13           HA       LYS  13  -5.273  -2.804   0.716
   93   1HB   LYS  13          1HB       LYS  13  -7.148  -3.526   1.900
   94   2HB   LYS  13          2HB       LYS  13  -7.971  -4.120   0.437
   95   1HG   LYS  13          1HG       LYS  13  -6.631  -6.061   0.324
   96   2HG   LYS  13          2HG       LYS  13  -5.371  -5.364   1.369
   97   1HD   LYS  13          1HD       LYS  13  -7.210  -5.293   3.200
   98   2HD   LYS  13          2HD       LYS  13  -8.112  -6.406   2.144
   99   1HE   LYS  13          1HE       LYS  13  -6.225  -7.981   2.158
  100   2HE   LYS  13          2HE       LYS  13  -5.275  -6.859   3.157
  101   1HZ   LYS  13          1HZ       LYS  13  -6.613  -8.769   4.214
  102   2HZ   LYS  13          2HZ       LYS  13  -6.531  -7.299   4.957
  103   3HZ   LYS  13          3HZ       LYS  13  -7.878  -7.717   4.101
  104    H    LEU  14           H        LEU  14  -6.344  -3.205  -2.468
  105    HA   LEU  14           HA       LEU  14  -4.988  -5.753  -2.948
  106   1HB   LEU  14          1HB       LEU  14  -5.514  -4.957  -5.400
  107   2HB   LEU  14          2HB       LEU  14  -6.841  -5.489  -4.339
  108    HG   LEU  14           HG       LEU  14  -7.092  -3.228  -5.640
  109   1HD1  LEU  14          1HD1      LEU  14  -8.800  -3.632  -4.121
  110   2HD1  LEU  14          2HD1      LEU  14  -7.678  -3.852  -2.757
  111   3HD1  LEU  14          3HD1      LEU  14  -8.038  -2.216  -3.358
  112   1HD2  LEU  14          1HD2      LEU  14  -4.713  -2.604  -4.626
  113   2HD2  LEU  14          2HD2      LEU  14  -5.967  -1.359  -4.833
  114   3HD2  LEU  14          3HD2      LEU  14  -5.691  -2.086  -3.232
  115    H    LEU  15           H        LEU  15  -4.476  -2.262  -3.580
  116    HA   LEU  15           HA       LEU  15  -2.084  -2.579  -5.096
  117   1HB   LEU  15          1HB       LEU  15  -3.533  -0.388  -3.689
  118   2HB   LEU  15          2HB       LEU  15  -1.794  -0.131  -3.966
  119    HG   LEU  15           HG       LEU  15  -3.682   0.453  -5.823
  120   1HD1  LEU  15          1HD1      LEU  15  -0.816  -0.154  -5.794
  121   2HD1  LEU  15          2HD1      LEU  15  -1.549  -0.483  -7.382
  122   3HD1  LEU  15          3HD1      LEU  15  -1.692   1.135  -6.654
  123   1HD2  LEU  15          1HD2      LEU  15  -3.809  -2.332  -5.705
  124   2HD2  LEU  15          2HD2      LEU  15  -4.390  -1.317  -7.047
  125   3HD2  LEU  15          3HD2      LEU  15  -2.758  -2.024  -7.108
  126    H    LYS  16           H        LYS  16  -2.797  -2.970  -1.730
  127    HA   LYS  16           HA       LYS  16  -0.470  -2.201  -0.439
  128   1HB   LYS  16          1HB       LYS  16  -1.993  -3.046   1.047
  129   2HB   LYS  16          2HB       LYS  16  -2.523  -4.333  -0.062
  130   1HG   LYS  16          1HG       LYS  16   0.287  -4.448   0.991
  131   2HG   LYS  16          2HG       LYS  16  -1.038  -4.874   2.101
  132   1HD   LYS  16          1HD       LYS  16  -0.252  -6.183  -0.515
  133   2HD   LYS  16          2HD       LYS  16  -0.507  -6.934   1.079
  134   1HE   LYS  16          1HE       LYS  16  -2.962  -5.948   0.762
  135   2HE   LYS  16          2HE       LYS  16  -2.523  -6.024  -0.958
  136   1HZ   LYS  16          1HZ       LYS  16  -3.500  -8.048   0.450
  137   2HZ   LYS  16          2HZ       LYS  16  -2.614  -8.213  -0.932
  138   3HZ   LYS  16          3HZ       LYS  16  -1.884  -8.365   0.539
  139    H    LYS  17           H        LYS  17  -1.079  -5.543  -1.676
  140    HA   LYS  17           HA       LYS  17   1.472  -6.557  -1.350
  141   1HB   LYS  17          1HB       LYS  17  -0.202  -8.059  -2.045
  142   2HB   LYS  17          2HB       LYS  17  -0.679  -7.038  -3.422
  143   1HG   LYS  17          1HG       LYS  17   0.626  -8.463  -4.633
  144   2HG   LYS  17          2HG       LYS  17   1.971  -7.495  -3.985
  145   1HD   LYS  17          1HD       LYS  17   0.863 -10.106  -2.878
  146   2HD   LYS  17          2HD       LYS  17   2.485  -9.816  -3.552
  147   1HE   LYS  17          1HE       LYS  17   3.004  -8.275  -1.719
  148   2HE   LYS  17          2HE       LYS  17   1.360  -8.459  -1.069
  149   1HZ   LYS  17          1HZ       LYS  17   3.112  -9.826  -0.014
  150   2HZ   LYS  17          2HZ       LYS  17   1.794 -10.666  -0.541
  151   3HZ   LYS  17          3HZ       LYS  17   3.200 -10.712  -1.402
  152    H    TRP  18           H        TRP  18   0.338  -4.178  -3.674
  153    HA   TRP  18           HA       TRP  18   3.012  -4.264  -4.990
  154   1HB   TRP  18          1HB       TRP  18   1.434  -2.719  -6.599
  155   2HB   TRP  18          2HB       TRP  18   1.743  -4.445  -6.831
  156    HD1  TRP  18           HD       TRP  18  -0.990  -2.044  -6.530
  157    HE1  TRP  18           1HE      TRP  18  -3.243  -3.180  -6.180
  158    HE3  TRP  18           3HE      TRP  18   0.651  -6.749  -5.360
  159    HZ2  TRP  18           2HZ      TRP  18  -4.225  -5.810  -5.477
  160    HZ3  TRP  18           3HZ      TRP  18  -0.970  -8.540  -4.857
  161    HH2  TRP  18           HH       TRP  18  -3.405  -8.088  -4.911
  162    H    LYS  19           H        LYS  19   0.990  -2.564  -2.830
  163    HA   LYS  19           HA       LYS  19   2.385   0.000  -3.395
  164   1HB   LYS  19          1HB       LYS  19  -0.159  -0.116  -3.308
  165   2HB   LYS  19          2HB       LYS  19   0.003  -0.476  -1.573
  166   1HG   LYS  19          1HG       LYS  19   1.691   1.700  -1.895
  167   2HG   LYS  19          2HG       LYS  19   0.359   2.077  -3.014
  168   1HD   LYS  19          1HD       LYS  19  -1.179   2.292  -1.324
  169   2HD   LYS  19          2HD       LYS  19  -0.428   1.015  -0.337
  170   1HE   LYS  19          1HE       LYS  19   1.466   2.588   0.156
  171   2HE   LYS  19          2HE       LYS  19   0.585   3.862  -0.716
  172   1HZ   LYS  19          1HZ       LYS  19  -1.018   2.582   1.220
  173   2HZ   LYS  19          2HZ       LYS  19   0.336   3.237   1.897
  174   3HZ   LYS  19          3HZ       LYS  19  -0.688   4.185   1.018
  175    H    MET  20           H        MET  20   2.849  -2.733  -1.638
  176    HA   MET  20           HA       MET  20   3.203  -1.954   1.022
  177   1HB   MET  20          1HB       MET  20   3.914  -4.147  -0.670
  178   2HB   MET  20          2HB       MET  20   5.369  -3.666   0.235
  179   1HG   MET  20          1HG       MET  20   2.642  -4.405   1.340
  180   2HG   MET  20          2HG       MET  20   4.173  -5.263   1.577
  181   1HE   MET  20          1HE       MET  20   1.790  -2.758   2.265
  182   2HE   MET  20          2HE       MET  20   1.888  -2.914   4.035
  183   3HE   MET  20          3HE       MET  20   2.528  -1.460   3.233
  184    H    ARG  21           H        ARG  21   6.038  -2.497   1.422
  185    HA   ARG  21           HA       ARG  21   7.027   0.143   1.472
  186   1HB   ARG  21          1HB       ARG  21   7.823  -2.423   2.358
  187   2HB   ARG  21          2HB       ARG  21   9.159  -1.818   1.350
  188   1HG   ARG  21          1HG       ARG  21   9.573  -0.011   2.741
  189   2HG   ARG  21          2HG       ARG  21   7.886   0.080   3.302
  190   1HD   ARG  21          1HD       ARG  21   9.866  -2.116   4.034
  191   2HD   ARG  21          2HD       ARG  21   9.433  -0.742   5.075
  192    HE   ARG  21           HE       ARG  21   7.832  -3.127   4.531
  193   1HH1  ARG  21          2HH2      ARG  21   7.864   0.240   5.609
  194   2HH1  ARG  21          1HH2      ARG  21   6.377   0.105   6.521
  195   1HH2  ARG  21          2HH1      ARG  21   5.869  -3.306   5.736
  196   2HH2  ARG  21          1HH1      ARG  21   5.240  -1.917   6.593
  197    H    ARG  22           H        ARG  22   6.291  -1.522  -1.229
  198    HA   ARG  22           HA       ARG  22   8.707  -1.021  -2.785
  199   1HB   ARG  22          1HB       ARG  22   5.899  -1.973  -3.445
  200   2HB   ARG  22          2HB       ARG  22   7.151  -1.714  -4.685
  201   1HG   ARG  22          1HG       ARG  22   7.447  -3.980  -4.172
  202   2HG   ARG  22          2HG       ARG  22   8.635  -3.205  -3.096
  203   1HD   ARG  22          1HD       ARG  22   6.005  -3.292  -1.849
  204   2HD   ARG  22          2HD       ARG  22   6.518  -4.918  -2.349
  205    HE   ARG  22           HE       ARG  22   8.569  -3.376  -0.944
  206   1HH1  ARG  22          2HH2      ARG  22   5.843  -5.614  -0.691
  207   2HH1  ARG  22          1HH2      ARG  22   6.335  -6.253   0.862
  208   1HH2  ARG  22          2HH1      ARG  22   9.218  -4.219   1.107
  209   2HH2  ARG  22          1HH1      ARG  22   8.260  -5.458   1.887
  210    H    ASN  23           H        ASN  23   8.531   1.347  -1.882
  211    HA   ASN  23           HA       ASN  23   6.707   2.954  -3.580
  212   1HB   ASN  23          1HB       ASN  23   6.569   3.566  -1.288
  213   2HB   ASN  23          2HB       ASN  23   8.334   3.517  -1.086
  214   1HD2  ASN  23          1HD2      ASN  23   5.822   5.158  -3.100
  215   2HD2  ASN  23          2HD2      ASN  23   6.597   6.727  -3.088
  216    H    GLN  24           H        GLN  24   9.720   4.233  -2.320
  217    HA   GLN  24           HA       GLN  24  11.152   3.891  -4.842
  218   1HB   GLN  24          1HB       GLN  24   9.411   6.018  -4.720
  219   2HB   GLN  24          2HB       GLN  24  10.921   6.748  -4.124
  220   1HG   GLN  24          1HG       GLN  24  11.952   5.391  -6.187
  221   2HG   GLN  24          2HG       GLN  24  10.294   5.554  -6.806
  222   1HE2  GLN  24          1HE2      GLN  24  10.494   7.097  -8.375
  223   2HE2  GLN  24          2HE2      GLN  24  11.125   8.708  -8.103
  224    H    PHE  25           H        PHE  25  11.024   6.078  -1.966
  225    HA   PHE  25           HA       PHE  25  13.927   5.833  -1.658
  226   1HB   PHE  25          1HB       PHE  25  13.096   7.992  -1.244
  227   2HB   PHE  25          2HB       PHE  25  11.718   7.386  -0.310
  228    HD1  PHE  25           1HD      PHE  25  12.521   5.883   1.822
  229    HD2  PHE  25           2HD      PHE  25  14.754   9.047  -0.036
  230    HE1  PHE  25           1HE      PHE  25  13.796   6.216   3.923
  231    HE2  PHE  25           2HE      PHE  25  16.029   9.381   2.065
  232    HZ   PHE  25           HZ       PHE  25  15.550   7.965   4.044
  233    H    TRP  26           H        TRP  26  10.937   4.610  -0.188
  234    HA   TRP  26           HA       TRP  26  12.574   3.172   1.835
  235   1HB   TRP  26          1HB       TRP  26  10.300   2.749   2.866
  236   2HB   TRP  26          2HB       TRP  26  10.867   4.424   2.881
  237    HD1  TRP  26           HD       TRP  26   8.092   2.223   1.649
  238    HE1  TRP  26           1HE      TRP  26   6.286   3.598   0.494
  239    HE3  TRP  26           3HE      TRP  26  10.555   6.700   1.345
  240    HZ2  TRP  26           2HZ      TRP  26   5.941   6.312  -0.452
  241    HZ3  TRP  26           3HZ      TRP  26   9.458   8.653   0.312
  242    HH2  TRP  26           HH       TRP  26   7.157   8.477  -0.589
  243    H    VAL  27           H        VAL  27  12.916   2.168  -0.669
  244    HA   VAL  27           HA       VAL  27  11.062  -0.159  -0.799
  245    HB   VAL  27           HB       VAL  27  11.926  -0.375  -3.143
  246   1HG1  VAL  27          1HG1      VAL  27  10.422   1.973  -2.063
  247   2HG1  VAL  27          2HG1      VAL  27  10.945   2.072  -3.762
  248   3HG1  VAL  27          3HG1      VAL  27   9.909   0.727  -3.226
  249   1HG2  VAL  27          1HG2      VAL  27  13.062   1.777  -4.004
  250   2HG2  VAL  27          2HG2      VAL  27  13.399   2.141  -2.294
  251   3HG2  VAL  27          3HG2      VAL  27  14.065   0.668  -3.039
  252    H    LYS  28           H        LYS  28  12.096  -1.406   0.813
  253    HA   LYS  28           HA       LYS  28  13.501  -3.195   1.278
  254   1HB   LYS  28          1HB       LYS  28  14.110  -2.717  -1.399
  255   2HB   LYS  28          2HB       LYS  28  15.682  -2.567  -0.578
  256   1HG   LYS  28          1HG       LYS  28  14.706  -4.765   0.689
  257   2HG   LYS  28          2HG       LYS  28  13.907  -4.946  -0.892
  258   1HD   LYS  28          1HD       LYS  28  16.896  -4.573  -0.419
  259   2HD   LYS  28          2HD       LYS  28  16.090  -6.083  -0.907
  260   1HE   LYS  28          1HE       LYS  28  15.801  -3.536  -2.523
  261   2HE   LYS  28          2HE       LYS  28  17.174  -4.638  -2.767
  262   1HZ   LYS  28          1HZ       LYS  28  14.811  -6.097  -2.705
  263   2HZ   LYS  28          2HZ       LYS  28  14.627  -4.857  -3.776
  264   3HZ   LYS  28          3HZ       LYS  28  15.880  -5.916  -3.946
  265    H    VAL  29           H        VAL  29  13.485  -0.694   2.584
  266    HA   VAL  29           HA       VAL  29  16.376  -0.290   3.183
  267    HB   VAL  29           HB       VAL  29  14.041   1.575   3.748
  268   1HG1  VAL  29          1HG1      VAL  29  15.562   2.867   4.810
  269   2HG1  VAL  29          2HG1      VAL  29  16.657   1.465   4.764
  270   3HG1  VAL  29          3HG1      VAL  29  16.731   2.695   3.479
  271   1HG2  VAL  29          1HG2      VAL  29  15.468   2.833   1.831
  272   2HG2  VAL  29          2HG2      VAL  29  15.774   1.148   1.345
  273   3HG2  VAL  29          3HG2      VAL  29  14.103   1.754   1.452
  274    H    GLN  30           H        GLN  30  14.576  -2.459   4.179
  275    HA   GLN  30           HA       GLN  30  15.279  -2.233   6.968
  276   1HB   GLN  30          1HB       GLN  30  12.982  -0.920   6.451
  277   2HB   GLN  30          2HB       GLN  30  12.331  -2.567   6.625
  278   1HG   GLN  30          1HG       GLN  30  13.974  -2.560   8.752
  279   2HG   GLN  30          2HG       GLN  30  13.676  -0.811   8.647
  280   1HE2  GLN  30          1HE2      GLN  30  12.705  -1.456  10.869
  281   2HE2  GLN  30          2HE2      GLN  30  11.001  -1.858  10.868
  282    H    ARG  31           H        ARG  31  14.890  -4.235   8.118
  283    HA   ARG  31           HA       ARG  31  15.189  -6.533   6.438
  284   1HB   ARG  31          1HB       ARG  31  15.037  -5.927   9.354
  285   2HB   ARG  31          2HB       ARG  31  14.625  -7.589   8.866
  286   1HG   ARG  31          1HG       ARG  31  16.956  -6.692   7.399
  287   2HG   ARG  31          2HG       ARG  31  17.219  -6.456   9.144
  288   1HD   ARG  31          1HD       ARG  31  17.134  -8.704   9.601
  289   2HD   ARG  31          2HD       ARG  31  15.944  -9.027   8.322
  290    HE   ARG  31           HE       ARG  31  18.816  -9.222   8.112
  291   1HH1  ARG  31          2HH2      ARG  31  15.862  -8.409   6.349
  292   2HH1  ARG  31          1HH2      ARG  31  16.521  -8.822   4.781
  293   1HH2  ARG  31          2HH1      ARG  31  19.687  -9.767   6.042
  294   2HH2  ARG  31          1HH1      ARG  31  18.702  -9.596   4.607
  295    H    GLY  32           H        GLY  32  13.771  -8.500   6.604
  296   1HA   GLY  32          1HA       GLY  32  11.558  -9.384   7.081
  297   2HA   GLY  32          2HA       GLY  32  10.900  -7.744   6.879
  Start of MODEL    2
    1    HA   PRO   1           HA       PRO   1  -5.551  11.124  -3.469
    2   1HB   PRO   1          1HB       PRO   1  -7.462   9.970  -1.907
    3   2HB   PRO   1          2HB       PRO   1  -6.522  11.394  -1.354
    4   1HG   PRO   1          1HG       PRO   1  -9.265  11.391  -2.646
    5   2HG   PRO   1          2HG       PRO   1  -8.785  12.188  -1.112
    6   1HD   PRO   1          1HD       PRO   1  -8.844  13.558  -3.467
    7   2HD   PRO   1          2HD       PRO   1  -7.529  13.840  -2.286
    8    HA   PRO   2           HA       PRO   2  -7.225   8.514  -6.613
    9   1HB   PRO   2          1HB       PRO   2  -5.947   6.179  -6.034
   10   2HB   PRO   2          2HB       PRO   2  -5.056   7.630  -6.597
   11   1HG   PRO   2          1HG       PRO   2  -5.476   6.728  -3.733
   12   2HG   PRO   2          2HG       PRO   2  -3.922   7.143  -4.527
   13   1HD   PRO   2          1HD       PRO   2  -5.287   8.970  -3.034
   14   2HD   PRO   2          2HD       PRO   2  -4.477   9.462  -4.553
   15    H    LEU   3           H        LEU   3  -9.180   9.010  -4.831
   16    HA   LEU   3           HA       LEU   3 -10.957   8.141  -3.656
   17   1HB   LEU   3          1HB       LEU   3 -11.042   5.583  -5.058
   18   2HB   LEU   3          2HB       LEU   3 -12.166   6.961  -5.143
   19    HG   LEU   3           HG       LEU   3  -9.466   6.984  -6.537
   20   1HD1  LEU   3          1HD1      LEU   3 -12.092   5.755  -7.350
   21   2HD1  LEU   3          2HD1      LEU   3 -11.105   6.565  -8.590
   22   3HD1  LEU   3          3HD1      LEU   3 -10.433   5.197  -7.671
   23   1HD2  LEU   3          1HD2      LEU   3 -11.677   8.431  -7.760
   24   2HD2  LEU   3          2HD2      LEU   3 -11.474   8.915  -6.060
   25   3HD2  LEU   3          3HD2      LEU   3 -10.106   9.046  -7.191
   26    H    SER   4           H        SER   4 -10.049   7.836  -1.599
   27    HA   SER   4           HA       SER   4  -9.976   5.096  -0.712
   28   1HB   SER   4          1HB       SER   4  -7.790   4.712  -1.139
   29   2HB   SER   4          2HB       SER   4  -7.461   6.431  -1.462
   30    HG   SER   4           HG       SER   4  -6.395   6.012   0.384
   31    H    GLN   5           H        GLN   5 -11.248   5.424   1.025
   32    HA   GLN   5           HA       GLN   5 -10.248   7.078   3.194
   33   1HB   GLN   5          1HB       GLN   5 -12.196   8.143   1.314
   34   2HB   GLN   5          2HB       GLN   5 -12.891   8.020   2.948
   35   1HG   GLN   5          1HG       GLN   5 -10.126   9.008   2.970
   36   2HG   GLN   5          2HG       GLN   5 -11.210  10.048   2.020
   37   1HE2  GLN   5          1HE2      GLN   5 -10.894  11.696   3.677
   38   2HE2  GLN   5          2HE2      GLN   5 -11.799  11.610   5.173
   39    H    GLU   6           H        GLU   6 -13.680   6.428   2.578
   40    HA   GLU   6           HA       GLU   6 -13.526   4.235   4.594
   41   1HB   GLU   6          1HB       GLU   6 -15.814   4.959   5.277
   42   2HB   GLU   6          2HB       GLU   6 -14.584   6.216   5.548
   43   1HG   GLU   6          1HG       GLU   6 -15.292   7.481   3.684
   44   2HG   GLU   6          2HG       GLU   6 -16.159   6.106   2.966
   45    H    THR   7           H        THR   7 -13.153   3.691   1.877
   46    HA   THR   7           HA       THR   7 -15.256   1.799   1.429
   47    HB   THR   7           HB       THR   7 -15.437   4.467   0.123
   48    HG1  THR   7           1HG      THR   7 -17.177   3.943   1.243
   49   1HG2  THR   7          1HG2      THR   7 -15.082   1.998  -1.403
   50   2HG2  THR   7          2HG2      THR   7 -16.679   2.725  -1.700
   51   3HG2  THR   7          3HG2      THR   7 -15.202   3.677  -1.982
   52    H    PHE   8           H        PHE   8 -13.807   3.540  -1.274
   53    HA   PHE   8           HA       PHE   8 -12.640   1.313  -2.455
   54   1HB   PHE   8          1HB       PHE   8 -10.961   3.330  -3.219
   55   2HB   PHE   8          2HB       PHE   8 -12.546   3.003  -3.939
   56    HD1  PHE   8           1HD      PHE   8 -11.893   4.443  -0.562
   57    HD2  PHE   8           2HD      PHE   8 -13.209   5.181  -4.583
   58    HE1  PHE   8           1HE      PHE   8 -12.665   6.703   0.106
   59    HE2  PHE   8           2HE      PHE   8 -13.981   7.441  -3.916
   60    HZ   PHE   8           HZ       PHE   8 -13.709   8.202  -1.571
   61    H    SER   9           H        SER   9 -11.653   3.022   0.389
   62    HA   SER   9           HA       SER   9  -8.850   2.283   0.243
   63   1HB   SER   9          1HB       SER   9  -8.760   3.166   2.517
   64   2HB   SER   9          2HB       SER   9  -9.704   4.269   1.488
   65    HG   SER   9           HG       SER   9 -10.709   2.302   3.273
   66    H    ASP  10           H        ASP  10 -11.849   0.862   1.437
   67    HA   ASP  10           HA       ASP  10 -10.758  -1.023   3.245
   68   1HB   ASP  10          1HB       ASP  10 -13.224  -0.336   2.706
   69   2HB   ASP  10          2HB       ASP  10 -13.128  -1.610   1.472
   70    H    LEU  11           H        LEU  11 -10.778  -0.852  -0.259
   71    HA   LEU  11           HA       LEU  11 -10.091  -3.687  -0.561
   72   1HB   LEU  11          1HB       LEU  11  -9.633  -2.415  -2.989
   73   2HB   LEU  11          2HB       LEU  11 -11.149  -3.208  -2.496
   74    HG   LEU  11           HG       LEU  11 -11.921  -1.075  -3.043
   75   1HD1  LEU  11          1HD1      LEU  11 -12.695  -0.215  -1.043
   76   2HD1  LEU  11          2HD1      LEU  11 -12.054  -1.766  -0.449
   77   3HD1  LEU  11          3HD1      LEU  11 -11.092  -0.279  -0.272
   78   1HD2  LEU  11          1HD2      LEU  11  -9.443   0.127  -1.739
   79   2HD2  LEU  11          2HD2      LEU  11  -9.590  -0.212  -3.480
   80   3HD2  LEU  11          3HD2      LEU  11 -10.665   0.980  -2.711
   81    H    TRP  12           H        TRP  12  -8.435  -1.443  -2.617
   82    HA   TRP  12           HA       TRP  12  -6.078  -1.858  -3.016
   83   1HB   TRP  12          1HB       TRP  12  -5.965   0.080  -0.736
   84   2HB   TRP  12          2HB       TRP  12  -5.189   0.156  -2.324
   85    HD1  TRP  12           HD       TRP  12  -7.369   2.173  -0.594
   86    HE1  TRP  12           1HE      TRP  12  -9.162   3.317  -1.995
   87    HE3  TRP  12           3HE      TRP  12  -7.180  -0.817  -4.744
   88    HZ2  TRP  12           2HZ      TRP  12 -10.376   2.982  -4.601
   89    HZ3  TRP  12           3HZ      TRP  12  -8.668  -0.374  -6.662
   90    HH2  TRP  12           HH       TRP  12 -10.268   1.516  -6.607
   91    H    LYS  13           H        LYS  13  -7.118  -2.126   0.386
   92    HA   LYS  13           HA       LYS  13  -4.714  -2.838   1.595
   93   1HB   LYS  13          1HB       LYS  13  -7.039  -2.508   2.626
   94   2HB   LYS  13          2HB       LYS  13  -7.363  -4.199   2.173
   95   1HG   LYS  13          1HG       LYS  13  -4.875  -4.388   3.359
   96   2HG   LYS  13          2HG       LYS  13  -5.650  -3.110   4.325
   97   1HD   LYS  13          1HD       LYS  13  -7.708  -4.719   4.375
   98   2HD   LYS  13          2HD       LYS  13  -6.539  -5.971   3.893
   99   1HE   LYS  13          1HE       LYS  13  -6.085  -4.120   6.258
  100   2HE   LYS  13          2HE       LYS  13  -6.915  -5.684   6.411
  101   1HZ   LYS  13          1HZ       LYS  13  -4.360  -5.630   5.063
  102   2HZ   LYS  13          2HZ       LYS  13  -4.362  -5.452   6.703
  103   3HZ   LYS  13          3HZ       LYS  13  -5.028  -6.797   6.018
  104    H    LEU  14           H        LEU  14  -6.230  -4.374  -1.017
  105    HA   LEU  14           HA       LEU  14  -5.310  -7.076  -0.341
  106   1HB   LEU  14          1HB       LEU  14  -6.140  -7.471  -2.758
  107   2HB   LEU  14          2HB       LEU  14  -7.353  -7.035  -1.531
  108    HG   LEU  14           HG       LEU  14  -7.579  -5.745  -3.687
  109   1HD1  LEU  14          1HD1      LEU  14  -6.868  -3.550  -1.910
  110   2HD1  LEU  14          2HD1      LEU  14  -8.479  -4.110  -2.418
  111   3HD1  LEU  14          3HD1      LEU  14  -7.682  -4.851  -1.009
  112   1HD2  LEU  14          1HD2      LEU  14  -4.778  -5.525  -3.390
  113   2HD2  LEU  14          2HD2      LEU  14  -5.791  -4.733  -4.622
  114   3HD2  LEU  14          3HD2      LEU  14  -5.413  -3.887  -3.102
  115    H    LEU  15           H        LEU  15  -4.469  -4.376  -2.538
  116    HA   LEU  15           HA       LEU  15  -2.503  -5.633  -4.073
  117   1HB   LEU  15          1HB       LEU  15  -3.133  -2.855  -3.206
  118   2HB   LEU  15          2HB       LEU  15  -1.475  -3.136  -3.789
  119    HG   LEU  15           HG       LEU  15  -3.283  -2.502  -5.544
  120   1HD1  LEU  15          1HD1      LEU  15  -2.213  -4.991  -6.596
  121   2HD1  LEU  15          2HD1      LEU  15  -1.745  -3.317  -6.979
  122   3HD1  LEU  15          3HD1      LEU  15  -0.988  -4.161  -5.606
  123   1HD2  LEU  15          1HD2      LEU  15  -5.129  -3.851  -5.120
  124   2HD2  LEU  15          2HD2      LEU  15  -4.304  -4.821  -6.364
  125   3HD2  LEU  15          3HD2      LEU  15  -4.131  -5.246  -4.644
  126    H    LYS  16           H        LYS  16  -2.456  -4.623  -0.700
  127    HA   LYS  16           HA       LYS  16   0.269  -4.390  -0.198
  128   1HB   LYS  16          1HB       LYS  16  -0.925  -3.965   1.702
  129   2HB   LYS  16          2HB       LYS  16  -2.146  -5.210   1.340
  130   1HG   LYS  16          1HG       LYS  16   0.675  -6.041   2.023
  131   2HG   LYS  16          2HG       LYS  16  -0.446  -5.579   3.327
  132   1HD   LYS  16          1HD       LYS  16  -0.724  -7.826   1.306
  133   2HD   LYS  16          2HD       LYS  16  -0.743  -7.926   3.083
  134   1HE   LYS  16          1HE       LYS  16  -2.815  -6.235   2.734
  135   2HE   LYS  16          2HE       LYS  16  -2.903  -7.099   1.183
  136   1HZ   LYS  16          1HZ       LYS  16  -2.639  -9.115   2.794
  137   2HZ   LYS  16          2HZ       LYS  16  -3.345  -8.074   3.860
  138   3HZ   LYS  16          3HZ       LYS  16  -4.112  -8.458   2.452
  139    H    LYS  17           H        LYS  17  -1.705  -7.411  -0.004
  140    HA   LYS  17           HA       LYS  17   0.242  -9.239   0.601
  141   1HB   LYS  17          1HB       LYS  17  -1.912 -10.108   0.373
  142   2HB   LYS  17          2HB       LYS  17  -2.166  -9.336  -1.211
  143   1HG   LYS  17          1HG       LYS  17  -1.636 -11.358  -2.095
  144   2HG   LYS  17          2HG       LYS  17   0.044 -10.962  -1.659
  145   1HD   LYS  17          1HD       LYS  17   0.080 -12.523  -0.020
  146   2HD   LYS  17          2HD       LYS  17  -1.484 -11.977   0.630
  147   1HE   LYS  17          1HE       LYS  17  -2.618 -13.613  -0.442
  148   2HE   LYS  17          2HE       LYS  17  -1.747 -13.327  -1.964
  149   1HZ   LYS  17          1HZ       LYS  17  -1.297 -15.282   0.026
  150   2HZ   LYS  17          2HZ       LYS  17  -0.766 -15.223  -1.534
  151   3HZ   LYS  17          3HZ       LYS  17   0.081 -14.456  -0.346
  152    H    TRP  18           H        TRP  18  -0.055  -7.346  -2.331
  153    HA   TRP  18           HA       TRP  18   2.275  -8.838  -3.444
  154   1HB   TRP  18          1HB       TRP  18   1.272  -7.748  -5.643
  155   2HB   TRP  18          2HB       TRP  18   0.712  -9.311  -5.036
  156    HD1  TRP  18           HD       TRP  18  -0.496  -5.989  -6.066
  157    HE1  TRP  18           1HE      TRP  18  -2.973  -5.680  -5.559
  158    HE3  TRP  18           3HE      TRP  18  -1.200 -10.020  -2.992
  159    HZ2  TRP  18           2HZ      TRP  18  -5.021  -7.014  -4.009
  160    HZ3  TRP  18           3HZ      TRP  18  -3.424 -10.468  -2.021
  161    HH2  TRP  18           HH       TRP  18  -5.340  -8.978  -2.518
  162    H    LYS  19           H        LYS  19   1.055  -5.925  -2.165
  163    HA   LYS  19           HA       LYS  19   3.099  -4.310  -3.595
  164   1HB   LYS  19          1HB       LYS  19   0.508  -3.725  -2.190
  165   2HB   LYS  19          2HB       LYS  19   1.765  -2.465  -2.223
  166   1HG   LYS  19          1HG       LYS  19   1.913  -2.999  -4.773
  167   2HG   LYS  19          2HG       LYS  19   0.330  -3.781  -4.543
  168   1HD   LYS  19          1HD       LYS  19  -0.383  -1.582  -3.383
  169   2HD   LYS  19          2HD       LYS  19   1.084  -0.874  -4.102
  170   1HE   LYS  19          1HE       LYS  19  -0.200  -2.364  -6.158
  171   2HE   LYS  19          2HE       LYS  19  -1.469  -1.423  -5.345
  172   1HZ   LYS  19          1HZ       LYS  19   0.888  -0.488  -6.760
  173   2HZ   LYS  19          2HZ       LYS  19  -0.674   0.028  -6.866
  174   3HZ   LYS  19          3HZ       LYS  19   0.245   0.445  -5.561
  175    H    MET  20           H        MET  20   2.841  -6.219  -0.906
  176    HA   MET  20           HA       MET  20   3.535  -5.078   1.379
  177   1HB   MET  20          1HB       MET  20   4.890  -7.320  -0.114
  178   2HB   MET  20          2HB       MET  20   5.521  -6.798   1.466
  179   1HG   MET  20          1HG       MET  20   2.575  -7.151   1.285
  180   2HG   MET  20          2HG       MET  20   3.535  -8.634   1.146
  181   1HE   MET  20          1HE       MET  20   4.229  -5.342   3.593
  182   2HE   MET  20          2HE       MET  20   2.557  -5.579   3.033
  183   3HE   MET  20          3HE       MET  20   2.973  -5.867   4.739
  184    H    ARG  21           H        ARG  21   5.151  -3.881   2.354
  185    HA   ARG  21           HA       ARG  21   7.088  -2.635   2.526
  186   1HB   ARG  21          1HB       ARG  21   7.952  -4.511   0.856
  187   2HB   ARG  21          2HB       ARG  21   7.866  -3.182  -0.325
  188   1HG   ARG  21          1HG       ARG  21   9.633  -2.087   0.603
  189   2HG   ARG  21          2HG       ARG  21   9.089  -2.427   2.264
  190   1HD   ARG  21          1HD       ARG  21   9.957  -4.837   0.814
  191   2HD   ARG  21          2HD       ARG  21  11.246  -3.626   0.981
  192    HE   ARG  21           HE       ARG  21  10.244  -3.712   3.502
  193   1HH1  ARG  21          2HH2      ARG  21  11.203  -6.229   1.212
  194   2HH1  ARG  21          1HH2      ARG  21  11.688  -7.363   2.452
  195   1HH2  ARG  21          2HH1      ARG  21  10.885  -5.210   5.140
  196   2HH2  ARG  21          1HH1      ARG  21  11.507  -6.783   4.691
  197    H    ARG  22           H        ARG  22   4.410  -2.143   0.797
  198    HA   ARG  22           HA       ARG  22   5.318   0.378  -0.477
  199   1HB   ARG  22          1HB       ARG  22   3.121  -1.573  -0.907
  200   2HB   ARG  22          2HB       ARG  22   2.671   0.139  -1.097
  201   1HG   ARG  22          1HG       ARG  22   3.480  -0.863  -3.233
  202   2HG   ARG  22          2HG       ARG  22   4.519   0.474  -2.683
  203   1HD   ARG  22          1HD       ARG  22   6.273  -0.933  -2.772
  204   2HD   ARG  22          2HD       ARG  22   5.541  -1.849  -1.437
  205    HE   ARG  22           HE       ARG  22   4.727  -3.439  -2.969
  206   1HH1  ARG  22          2HH2      ARG  22   6.313  -0.713  -4.568
  207   2HH1  ARG  22          1HH2      ARG  22   6.426  -1.513  -6.120
  208   1HH2  ARG  22          2HH1      ARG  22   4.878  -4.496  -5.018
  209   2HH2  ARG  22          1HH1      ARG  22   5.608  -3.670  -6.376
  210    H    ASN  23           H        ASN  23   5.634   0.981   1.967
  211    HA   ASN  23           HA       ASN  23   3.067   1.828   3.175
  212   1HB   ASN  23          1HB       ASN  23   4.554   0.666   4.670
  213   2HB   ASN  23          2HB       ASN  23   5.924   1.694   4.196
  214   1HD2  ASN  23          1HD2      ASN  23   2.622   1.857   5.629
  215   2HD2  ASN  23          2HD2      ASN  23   2.967   3.195   6.703
  216    H    GLN  24           H        GLN  24   5.936   3.603   3.959
  217    HA   GLN  24           HA       GLN  24   5.563   5.700   1.991
  218   1HB   GLN  24          1HB       GLN  24   3.827   5.752   4.182
  219   2HB   GLN  24          2HB       GLN  24   5.130   6.878   4.634
  220   1HG   GLN  24          1HG       GLN  24   4.812   7.659   2.088
  221   2HG   GLN  24          2HG       GLN  24   3.178   7.014   2.361
  222   1HE2  GLN  24          1HE2      GLN  24   2.959   9.529   1.886
  223   2HE2  GLN  24          2HE2      GLN  24   2.848  10.527   3.320
  224    H    PHE  25           H        PHE  25   6.739   4.926   5.309
  225    HA   PHE  25           HA       PHE  25   9.215   6.443   4.691
  226   1HB   PHE  25          1HB       PHE  25   8.225   7.144   6.730
  227   2HB   PHE  25          2HB       PHE  25   7.901   5.478   7.239
  228    HD1  PHE  25           1HD      PHE  25  10.199   3.978   7.242
  229    HD2  PHE  25           2HD      PHE  25   9.917   8.217   7.871
  230    HE1  PHE  25           1HE      PHE  25  12.347   3.936   8.482
  231    HE2  PHE  25           2HE      PHE  25  12.065   8.176   9.110
  232    HZ   PHE  25           HZ       PHE  25  13.280   6.036   9.415
  233    H    TRP  26           H        TRP  26   7.931   3.234   5.543
  234    HA   TRP  26           HA       TRP  26  10.682   2.131   5.423
  235   1HB   TRP  26          1HB       TRP  26   9.368   0.026   6.165
  236   2HB   TRP  26          2HB       TRP  26   9.646   1.325   7.333
  237    HD1  TRP  26           HD       TRP  26   6.945  -0.634   5.653
  238    HE1  TRP  26           1HE      TRP  26   4.643   0.095   6.463
  239    HE3  TRP  26           3HE      TRP  26   8.286   3.608   8.185
  240    HZ2  TRP  26           2HZ      TRP  26   3.510   2.256   8.020
  241    HZ3  TRP  26           3HZ      TRP  26   6.571   4.973   9.317
  242    HH2  TRP  26           HH       TRP  26   4.184   4.313   9.244
  243    H    VAL  27           H        VAL  27   9.298   3.137   3.038
  244    HA   VAL  27           HA       VAL  27   8.394   0.750   1.606
  245    HB   VAL  27           HB       VAL  27   8.232   2.397  -0.304
  246   1HG1  VAL  27          1HG1      VAL  27   6.824   2.511   2.310
  247   2HG1  VAL  27          2HG1      VAL  27   6.596   3.936   1.268
  248   3HG1  VAL  27          3HG1      VAL  27   6.167   2.317   0.667
  249   1HG2  VAL  27          1HG2      VAL  27   8.765   4.666  -0.005
  250   2HG2  VAL  27          2HG2      VAL  27   8.757   4.534   1.770
  251   3HG2  VAL  27          3HG2      VAL  27  10.104   3.844   0.833
  252    H    LYS  28           H        LYS  28   9.930   2.484  -0.692
  253    HA   LYS  28           HA       LYS  28  12.120   0.553  -0.840
  254   1HB   LYS  28          1HB       LYS  28  11.245   2.844  -2.642
  255   2HB   LYS  28          2HB       LYS  28  12.557   1.701  -3.018
  256   1HG   LYS  28          1HG       LYS  28  11.109  -0.043  -3.414
  257   2HG   LYS  28          2HG       LYS  28   9.933   0.519  -2.201
  258   1HD   LYS  28          1HD       LYS  28   8.948   0.814  -4.401
  259   2HD   LYS  28          2HD       LYS  28   9.354   2.423  -3.757
  260   1HE   LYS  28          1HE       LYS  28  11.571   1.165  -5.233
  261   2HE   LYS  28          2HE       LYS  28  10.126   1.425  -6.233
  262   1HZ   LYS  28          1HZ       LYS  28  11.609   3.309  -6.225
  263   2HZ   LYS  28          2HZ       LYS  28  10.140   3.703  -5.588
  264   3HZ   LYS  28          3HZ       LYS  28  11.436   3.477  -4.594
  265    H    VAL  29           H        VAL  29  12.405   2.087   1.456
  266    HA   VAL  29           HA       VAL  29  14.310   4.243   0.822
  267    HB   VAL  29           HB       VAL  29  13.484   3.203   3.551
  268   1HG1  VAL  29          1HG1      VAL  29  15.104   4.740   4.034
  269   2HG1  VAL  29          2HG1      VAL  29  14.991   5.509   2.433
  270   3HG1  VAL  29          3HG1      VAL  29  13.811   5.917   3.701
  271   1HG2  VAL  29          1HG2      VAL  29  11.376   3.760   2.825
  272   2HG2  VAL  29          2HG2      VAL  29  11.946   5.406   3.192
  273   3HG2  VAL  29          3HG2      VAL  29  11.988   4.802   1.518
  274    H    GLN  30           H        GLN  30  14.885   1.386   0.159
  275    HA   GLN  30           HA       GLN  30  16.923   0.269   0.080
  276   1HB   GLN  30          1HB       GLN  30  17.781   2.563   1.152
  277   2HB   GLN  30          2HB       GLN  30  17.929   1.540   2.601
  278   1HG   GLN  30          1HG       GLN  30  19.617   0.283   1.705
  279   2HG   GLN  30          2HG       GLN  30  18.937   0.351   0.065
  280   1HE2  GLN  30          1HE2      GLN  30  19.034   2.582  -1.011
  281   2HE2  GLN  30          2HE2      GLN  30  20.506   3.500  -0.778
  282    H    ARG  31           H        ARG  31  16.031  -1.711   0.524
  283    HA   ARG  31           HA       ARG  31  15.569  -2.381   3.382
  284   1HB   ARG  31          1HB       ARG  31  14.238  -4.246   2.506
  285   2HB   ARG  31          2HB       ARG  31  13.684  -2.709   1.799
  286   1HG   ARG  31          1HG       ARG  31  13.985  -3.644  -0.234
  287   2HG   ARG  31          2HG       ARG  31  15.736  -3.597   0.085
  288   1HD   ARG  31          1HD       ARG  31  15.691  -5.818   1.040
  289   2HD   ARG  31          2HD       ARG  31  13.915  -5.857   0.997
  290    HE   ARG  31           HE       ARG  31  14.637  -5.450  -1.635
  291   1HH1  ARG  31          2HH2      ARG  31  15.438  -7.817   0.866
  292   2HH1  ARG  31          1HH2      ARG  31  15.695  -9.127  -0.264
  293   1HH2  ARG  31          2HH1      ARG  31  14.977  -7.182  -3.128
  294   2HH2  ARG  31          1HH1      ARG  31  15.432  -8.765  -2.541
  295    H    GLY  32           H        GLY  32  17.492  -3.119   0.513
  296   1HA   GLY  32          1HA       GLY  32  19.509  -4.430   2.061
  297   2HA   GLY  32          2HA       GLY  32  18.526  -5.630   1.192
  Start of MODEL    3
    1    HA   PRO   1           HA       PRO   1 -15.471  11.617  -4.550
    2   1HB   PRO   1          1HB       PRO   1 -14.703   9.041  -4.992
    3   2HB   PRO   1          2HB       PRO   1 -16.288   9.665  -5.554
    4   1HG   PRO   1          1HG       PRO   1 -13.724   9.451  -7.157
    5   2HG   PRO   1          2HG       PRO   1 -15.345   8.828  -7.608
    6   1HD   PRO   1          1HD       PRO   1 -14.452  11.244  -8.499
    7   2HD   PRO   1          2HD       PRO   1 -16.157  11.036  -7.997
    8    HA   PRO   2           HA       PRO   2 -11.309  11.935  -3.147
    9   1HB   PRO   2          1HB       PRO   2 -11.321  10.437  -0.872
   10   2HB   PRO   2          2HB       PRO   2 -12.310  11.926  -1.029
   11   1HG   PRO   2          1HG       PRO   2 -13.205   9.067  -1.497
   12   2HG   PRO   2          2HG       PRO   2 -13.987  10.294  -0.448
   13   1HD   PRO   2          1HD       PRO   2 -14.836   9.859  -3.001
   14   2HD   PRO   2          2HD       PRO   2 -14.755  11.521  -2.343
   15    H    LEU   3           H        LEU   3  -9.617  10.161  -1.967
   16    HA   LEU   3           HA       LEU   3  -9.512   7.876  -3.880
   17   1HB   LEU   3          1HB       LEU   3  -7.344   9.777  -2.943
   18   2HB   LEU   3          2HB       LEU   3  -6.972   8.181  -3.635
   19    HG   LEU   3           HG       LEU   3  -8.093   8.740  -5.706
   20   1HD1  LEU   3          1HD1      LEU   3  -9.981   9.993  -5.264
   21   2HD1  LEU   3          2HD1      LEU   3  -9.166  10.980  -4.027
   22   3HD1  LEU   3          3HD1      LEU   3  -8.888  11.310  -5.754
   23   1HD2  LEU   3          1HD2      LEU   3  -6.415  11.096  -4.741
   24   2HD2  LEU   3          2HD2      LEU   3  -5.784   9.589  -5.446
   25   3HD2  LEU   3          3HD2      LEU   3  -6.759  10.697  -6.441
   26    H    SER   4           H        SER   4 -10.002   6.113  -2.694
   27    HA   SER   4           HA       SER   4  -9.856   4.520  -1.057
   28   1HB   SER   4          1HB       SER   4  -7.270   5.364  -1.493
   29   2HB   SER   4          2HB       SER   4  -7.449   5.612   0.261
   30    HG   SER   4           HG       SER   4  -7.705   3.522   0.548
   31    H    GLN   5           H        GLN   5 -11.493   4.768   0.362
   32    HA   GLN   5           HA       GLN   5 -10.967   6.174   2.851
   33   1HB   GLN   5          1HB       GLN   5 -12.533   7.423   0.689
   34   2HB   GLN   5          2HB       GLN   5 -13.407   7.319   2.236
   35   1HG   GLN   5          1HG       GLN   5 -10.619   8.110   2.619
   36   2HG   GLN   5          2HG       GLN   5 -11.470   9.225   1.528
   37   1HE2  GLN   5          1HE2      GLN   5 -10.669  10.308   3.855
   38   2HE2  GLN   5          2HE2      GLN   5 -12.009  10.519   4.962
   39    H    GLU   6           H        GLU   6 -14.218   5.835   1.531
   40    HA   GLU   6           HA       GLU   6 -14.578   3.439   3.271
   41   1HB   GLU   6          1HB       GLU   6 -16.246   5.891   2.772
   42   2HB   GLU   6          2HB       GLU   6 -17.062   4.353   3.143
   43   1HG   GLU   6          1HG       GLU   6 -14.896   4.543   4.957
   44   2HG   GLU   6          2HG       GLU   6 -15.641   6.156   4.923
   45    H    THR   7           H        THR   7 -13.624   3.114   0.659
   46    HA   THR   7           HA       THR   7 -15.677   1.411  -0.422
   47    HB   THR   7           HB       THR   7 -15.310   4.157  -1.522
   48    HG1  THR   7           1HG      THR   7 -17.276   3.536  -0.702
   49   1HG2  THR   7          1HG2      THR   7 -14.793   1.752  -3.095
   50   2HG2  THR   7          2HG2      THR   7 -16.218   2.627  -3.705
   51   3HG2  THR   7          3HG2      THR   7 -14.652   3.462  -3.568
   52    H    PHE   8           H        PHE   8 -13.487   3.157  -2.557
   53    HA   PHE   8           HA       PHE   8 -12.216   0.897  -3.561
   54   1HB   PHE   8          1HB       PHE   8 -10.278   2.821  -3.768
   55   2HB   PHE   8          2HB       PHE   8 -11.647   2.630  -4.877
   56    HD1  PHE   8           1HD      PHE   8 -11.779   3.888  -1.369
   57    HD2  PHE   8           2HD      PHE   8 -12.012   4.869  -5.544
   58    HE1  PHE   8           1HE      PHE   8 -12.569   6.166  -0.789
   59    HE2  PHE   8           2HE      PHE   8 -12.802   7.147  -4.965
   60    HZ   PHE   8           HZ       PHE   8 -13.080   7.796  -2.587
   61    H    SER   9           H        SER   9 -11.838   2.408  -0.468
   62    HA   SER   9           HA       SER   9  -9.139   1.448   0.013
   63   1HB   SER   9          1HB       SER   9 -10.228   3.465   1.102
   64   2HB   SER   9          2HB       SER   9 -11.231   2.327   2.034
   65    HG   SER   9           HG       SER   9  -9.034   1.339   2.502
   66    H    ASP  10           H        ASP  10 -12.408   0.206   0.290
   67    HA   ASP  10           HA       ASP  10 -11.928  -1.812   2.241
   68   1HB   ASP  10          1HB       ASP  10 -14.130  -0.870   1.090
   69   2HB   ASP  10          2HB       ASP  10 -13.852  -2.223  -0.028
   70    H    LEU  11           H        LEU  11 -11.086  -1.496  -1.144
   71    HA   LEU  11           HA       LEU  11 -10.578  -4.371  -1.450
   72   1HB   LEU  11          1HB       LEU  11  -9.462  -3.044  -3.624
   73   2HB   LEU  11          2HB       LEU  11 -11.103  -3.728  -3.548
   74    HG   LEU  11           HG       LEU  11 -11.566  -1.516  -4.133
   75   1HD1  LEU  11          1HD1      LEU  11 -11.379  -0.901  -1.205
   76   2HD1  LEU  11          2HD1      LEU  11 -12.744  -0.691  -2.328
   77   3HD1  LEU  11          3HD1      LEU  11 -12.361  -2.306  -1.685
   78   1HD2  LEU  11          1HD2      LEU  11  -9.146  -0.831  -3.952
   79   2HD2  LEU  11          2HD2      LEU  11 -10.287   0.412  -3.384
   80   3HD2  LEU  11          3HD2      LEU  11  -9.397  -0.584  -2.207
   81    H    TRP  12           H        TRP  12  -8.319  -2.184  -2.917
   82    HA   TRP  12           HA       TRP  12  -5.971  -2.788  -2.787
   83   1HB   TRP  12          1HB       TRP  12  -6.256  -0.979  -0.419
   84   2HB   TRP  12          2HB       TRP  12  -5.123  -0.896  -1.775
   85    HD1  TRP  12           HD       TRP  12  -7.475   1.234  -0.470
   86    HE1  TRP  12           1HE      TRP  12  -8.802   2.593  -2.167
   87    HE3  TRP  12           3HE      TRP  12  -6.579  -1.590  -4.644
   88    HZ2  TRP  12           2HZ      TRP  12  -9.409   2.477  -4.994
   89    HZ3  TRP  12           3HZ      TRP  12  -7.547  -0.936  -6.817
   90    HH2  TRP  12           HH       TRP  12  -8.961   1.090  -7.009
   91    H    LYS  13           H        LYS  13  -7.820  -3.155   0.237
   92    HA   LYS  13           HA       LYS  13  -5.792  -4.151   1.896
   93   1HB   LYS  13          1HB       LYS  13  -8.010  -3.593   2.727
   94   2HB   LYS  13          2HB       LYS  13  -8.743  -4.874   1.731
   95   1HG   LYS  13          1HG       LYS  13  -7.776  -6.600   3.025
   96   2HG   LYS  13          2HG       LYS  13  -6.561  -5.510   3.734
   97   1HD   LYS  13          1HD       LYS  13  -7.985  -4.787   5.357
   98   2HD   LYS  13          2HD       LYS  13  -9.364  -4.698   4.235
   99   1HE   LYS  13          1HE       LYS  13  -9.761  -7.065   4.407
  100   2HE   LYS  13          2HE       LYS  13  -8.232  -7.321   5.275
  101   1HZ   LYS  13          1HZ       LYS  13 -10.246  -7.274   6.664
  102   2HZ   LYS  13          2HZ       LYS  13  -9.082  -6.199   7.121
  103   3HZ   LYS  13          3HZ       LYS  13 -10.419  -5.671   6.314
  104    H    LEU  14           H        LEU  14  -6.465  -5.287  -1.095
  105    HA   LEU  14           HA       LEU  14  -6.066  -8.140  -0.360
  106   1HB   LEU  14          1HB       LEU  14  -6.649  -8.486  -2.814
  107   2HB   LEU  14          2HB       LEU  14  -7.960  -7.844  -1.796
  108    HG   LEU  14           HG       LEU  14  -7.456  -6.705  -4.112
  109   1HD1  LEU  14          1HD1      LEU  14  -8.069  -5.529  -1.431
  110   2HD1  LEU  14          2HD1      LEU  14  -7.710  -4.383  -2.744
  111   3HD1  LEU  14          3HD1      LEU  14  -9.046  -5.546  -2.919
  112   1HD2  LEU  14          1HD2      LEU  14  -5.654  -5.235  -4.234
  113   2HD2  LEU  14          2HD2      LEU  14  -5.536  -5.068  -2.466
  114   3HD2  LEU  14          3HD2      LEU  14  -4.943  -6.546  -3.262
  115    H    LEU  15           H        LEU  15  -4.607  -5.318  -1.848
  116    HA   LEU  15           HA       LEU  15  -2.394  -6.957  -2.933
  117   1HB   LEU  15          1HB       LEU  15  -2.314  -5.366  -4.513
  118   2HB   LEU  15          2HB       LEU  15  -3.714  -4.576  -3.748
  119    HG   LEU  15           HG       LEU  15  -1.984  -3.558  -2.100
  120   1HD1  LEU  15          1HD1      LEU  15  -0.088  -4.080  -4.410
  121   2HD1  LEU  15          2HD1      LEU  15   0.290  -3.485  -2.775
  122   3HD1  LEU  15          3HD1      LEU  15  -0.184  -5.183  -3.016
  123   1HD2  LEU  15          1HD2      LEU  15  -1.237  -2.221  -4.522
  124   2HD2  LEU  15          2HD2      LEU  15  -2.912  -2.792  -4.712
  125   3HD2  LEU  15          3HD2      LEU  15  -2.479  -1.744  -3.339
  126    H    LYS  16           H        LYS  16  -3.299  -5.379  -0.082
  127    HA   LYS  16           HA       LYS  16  -1.279  -3.915   0.914
  128   1HB   LYS  16          1HB       LYS  16  -1.710  -6.031   2.820
  129   2HB   LYS  16          2HB       LYS  16  -2.369  -4.377   2.820
  130   1HG   LYS  16          1HG       LYS  16  -4.238  -5.920   2.787
  131   2HG   LYS  16          2HG       LYS  16  -4.126  -5.167   1.178
  132   1HD   LYS  16          1HD       LYS  16  -4.124  -7.283   0.364
  133   2HD   LYS  16          2HD       LYS  16  -2.448  -7.376   0.957
  134   1HE   LYS  16          1HE       LYS  16  -4.492  -7.828   3.043
  135   2HE   LYS  16          2HE       LYS  16  -4.509  -9.040   1.744
  136   1HZ   LYS  16          1HZ       LYS  16  -2.484  -9.760   2.301
  137   2HZ   LYS  16          2HZ       LYS  16  -1.948  -8.298   2.844
  138   3HZ   LYS  16          3HZ       LYS  16  -2.935  -9.218   3.792
  139    H    LYS  17           H        LYS  17  -1.151  -7.528   1.004
  140    HA   LYS  17           HA       LYS  17   1.410  -7.885   1.914
  141   1HB   LYS  17          1HB       LYS  17   0.167  -9.832   1.522
  142   2HB   LYS  17          2HB       LYS  17  -0.245  -9.353  -0.142
  143   1HG   LYS  17          1HG       LYS  17   1.462 -10.722  -0.759
  144   2HG   LYS  17          2HG       LYS  17   2.524  -9.405  -0.208
  145   1HD   LYS  17          1HD       LYS  17   3.335 -10.747   1.409
  146   2HD   LYS  17          2HD       LYS  17   1.702 -10.887   2.103
  147   1HE   LYS  17          1HE       LYS  17   1.356 -12.943   1.191
  148   2HE   LYS  17          2HE       LYS  17   2.147 -12.504  -0.339
  149   1HZ   LYS  17          1HZ       LYS  17   3.168 -14.075   1.600
  150   2HZ   LYS  17          2HZ       LYS  17   4.005 -13.405   0.348
  151   3HZ   LYS  17          3HZ       LYS  17   3.967 -12.648   1.813
  152    H    TRP  18           H        TRP  18   0.392  -6.795  -1.313
  153    HA   TRP  18           HA       TRP  18   3.246  -6.672  -2.128
  154   1HB   TRP  18          1HB       TRP  18   1.797  -5.955  -4.322
  155   2HB   TRP  18          2HB       TRP  18   2.329  -7.602  -3.954
  156    HD1  TRP  18           HD       TRP  18  -0.645  -5.737  -4.863
  157    HE1  TRP  18           1HE      TRP  18  -2.792  -7.038  -4.431
  158    HE3  TRP  18           3HE      TRP  18   1.239  -9.429  -1.861
  159    HZ2  TRP  18           2HZ      TRP  18  -3.604  -9.395  -2.962
  160    HZ3  TRP  18           3HZ      TRP  18  -0.249 -11.182  -0.965
  161    HH2  TRP  18           HH       TRP  18  -2.667 -11.179  -1.504
  162    H    LYS  19           H        LYS  19   0.631  -4.789  -0.944
  163    HA   LYS  19           HA       LYS  19   1.659  -2.300  -2.157
  164   1HB   LYS  19          1HB       LYS  19  -0.624  -2.116  -2.189
  165   2HB   LYS  19          2HB       LYS  19  -0.839  -3.189  -0.785
  166   1HG   LYS  19          1HG       LYS  19  -0.048  -1.403   0.719
  167   2HG   LYS  19          2HG       LYS  19   0.221  -0.331  -0.676
  168   1HD   LYS  19          1HD       LYS  19  -2.462  -1.419  -0.784
  169   2HD   LYS  19          2HD       LYS  19  -2.180  -0.676   0.809
  170   1HE   LYS  19          1HE       LYS  19  -1.142   1.294  -0.547
  171   2HE   LYS  19          2HE       LYS  19  -1.991   0.584  -1.937
  172   1HZ   LYS  19          1HZ       LYS  19  -3.580   0.875   0.415
  173   2HZ   LYS  19          2HZ       LYS  19  -3.060   2.302  -0.228
  174   3HZ   LYS  19          3HZ       LYS  19  -3.927   1.248  -1.153
  175    H    MET  20           H        MET  20   2.443  -4.261   0.408
  176    HA   MET  20           HA       MET  20   2.677  -2.361   2.541
  177   1HB   MET  20          1HB       MET  20   3.318  -5.148   2.008
  178   2HB   MET  20          2HB       MET  20   4.649  -4.343   2.872
  179   1HG   MET  20          1HG       MET  20   3.050  -5.255   4.475
  180   2HG   MET  20          2HG       MET  20   3.043  -3.484   4.539
  181   1HE   MET  20          1HE       MET  20   0.315  -2.127   3.050
  182   2HE   MET  20          2HE       MET  20  -0.121  -2.494   4.736
  183   3HE   MET  20          3HE       MET  20   1.564  -2.104   4.318
  184    H    ARG  21           H        ARG  21   4.793  -1.652   3.470
  185    HA   ARG  21           HA       ARG  21   6.741  -0.468   3.280
  186   1HB   ARG  21          1HB       ARG  21   7.284  -2.860   2.178
  187   2HB   ARG  21          2HB       ARG  21   7.508  -1.841   0.735
  188   1HG   ARG  21          1HG       ARG  21   9.323  -0.731   1.631
  189   2HG   ARG  21          2HG       ARG  21   8.728  -0.885   3.301
  190   1HD   ARG  21          1HD       ARG  21   9.221  -3.515   2.216
  191   2HD   ARG  21          2HD       ARG  21  10.662  -2.504   1.972
  192    HE   ARG  21           HE       ARG  21  10.065  -1.968   4.559
  193   1HH1  ARG  21          2HH2      ARG  21  10.290  -4.991   2.739
  194   2HH1  ARG  21          1HH2      ARG  21  10.799  -5.942   4.117
  195   1HH2  ARG  21          2HH1      ARG  21  10.737  -3.225   6.379
  196   2HH2  ARG  21          1HH1      ARG  21  11.053  -4.935   6.192
  197    H    ARG  22           H        ARG  22   4.170  -0.037   1.445
  198    HA   ARG  22           HA       ARG  22   5.387   1.689  -0.613
  199   1HB   ARG  22          1HB       ARG  22   2.504   0.930   0.006
  200   2HB   ARG  22          2HB       ARG  22   3.024   1.944  -1.362
  201   1HG   ARG  22          1HG       ARG  22   4.257  -0.783  -0.928
  202   2HG   ARG  22          2HG       ARG  22   2.685  -0.627  -1.748
  203   1HD   ARG  22          1HD       ARG  22   4.070  -0.438  -3.582
  204   2HD   ARG  22          2HD       ARG  22   4.005   1.271  -3.099
  205    HE   ARG  22           HE       ARG  22   6.155  -0.171  -1.793
  206   1HH1  ARG  22          2HH2      ARG  22   5.144   1.474  -4.755
  207   2HH1  ARG  22          1HH2      ARG  22   6.773   1.882  -5.247
  208   1HH2  ARG  22          2HH1      ARG  22   8.306   0.367  -2.444
  209   2HH2  ARG  22          1HH1      ARG  22   8.575   1.250  -3.929
  210    H    ASN  23           H        ASN  23   6.279   2.934   1.398
  211    HA   ASN  23           HA       ASN  23   4.234   4.801   2.455
  212   1HB   ASN  23          1HB       ASN  23   5.627   3.792   4.140
  213   2HB   ASN  23          2HB       ASN  23   7.103   4.182   3.232
  214   1HD2  ASN  23          1HD2      ASN  23   4.237   5.719   4.780
  215   2HD2  ASN  23          2HD2      ASN  23   5.072   7.171   5.287
  216    H    GLN  24           H        GLN  24   7.556   5.801   2.314
  217    HA   GLN  24           HA       GLN  24   7.228   7.292  -0.185
  218   1HB   GLN  24          1HB       GLN  24   6.319   8.475   2.159
  219   2HB   GLN  24          2HB       GLN  24   7.977   9.105   2.001
  220   1HG   GLN  24          1HG       GLN  24   7.412   9.614  -0.437
  221   2HG   GLN  24          2HG       GLN  24   5.720   9.256  -0.029
  222   1HE2  GLN  24          1HE2      GLN  24   5.831  11.672  -0.905
  223   2HE2  GLN  24          2HE2      GLN  24   5.914  12.889   0.351
  224    H    PHE  25           H        PHE  25   9.165   7.592   2.849
  225    HA   PHE  25           HA       PHE  25  11.615   7.745   1.270
  226   1HB   PHE  25          1HB       PHE  25  11.545   9.153   3.161
  227   2HB   PHE  25          2HB       PHE  25  10.911   7.870   4.205
  228    HD1  PHE  25           1HD      PHE  25  12.560   5.689   4.235
  229    HD2  PHE  25           2HD      PHE  25  13.739   9.759   3.529
  230    HE1  PHE  25           1HE      PHE  25  14.865   5.150   4.974
  231    HE2  PHE  25           2HE      PHE  25  16.045   9.219   4.268
  232    HZ   PHE  25           HZ       PHE  25  16.608   6.915   4.990
  233    H    TRP  26           H        TRP  26   9.876   5.385   3.282
  234    HA   TRP  26           HA       TRP  26  12.094   3.454   2.882
  235   1HB   TRP  26          1HB       TRP  26  10.652   2.098   4.513
  236   2HB   TRP  26          2HB       TRP  26  11.500   3.518   5.140
  237    HD1  TRP  26           HD       TRP  26   8.085   2.042   4.685
  238    HE1  TRP  26           1HE      TRP  26   6.301   3.540   5.715
  239    HE3  TRP  26           3HE      TRP  26  10.942   6.189   5.599
  240    HZ2  TRP  26           2HZ      TRP  26   6.124   6.215   6.805
  241    HZ3  TRP  26           3HZ      TRP  26   9.933   8.189   6.632
  242    HH2  TRP  26           HH       TRP  26   7.531   8.219   7.240
  243    H    VAL  27           H        VAL  27  10.809   4.041   0.540
  244    HA   VAL  27           HA       VAL  27   8.862   1.819   0.176
  245    HB   VAL  27           HB       VAL  27   8.264   3.036  -1.919
  246   1HG1  VAL  27          1HG1      VAL  27   7.587   5.248  -0.495
  247   2HG1  VAL  27          2HG1      VAL  27   6.756   3.685  -0.315
  248   3HG1  VAL  27          3HG1      VAL  27   8.028   4.154   0.838
  249   1HG2  VAL  27          1HG2      VAL  27  10.416   4.896  -0.867
  250   2HG2  VAL  27          2HG2      VAL  27  10.239   4.212  -2.501
  251   3HG2  VAL  27          3HG2      VAL  27   9.126   5.485  -1.944
  252    H    LYS  28           H        LYS  28  10.329   0.099  -0.025
  253    HA   LYS  28           HA       LYS  28  11.375  -1.350  -1.542
  254   1HB   LYS  28          1HB       LYS  28  10.728   0.581  -3.287
  255   2HB   LYS  28          2HB       LYS  28  12.480   0.882  -3.203
  256   1HG   LYS  28          1HG       LYS  28  12.319  -1.894  -3.359
  257   2HG   LYS  28          2HG       LYS  28  11.015  -1.350  -4.441
  258   1HD   LYS  28          1HD       LYS  28  12.620   0.159  -5.594
  259   2HD   LYS  28          2HD       LYS  28  13.920  -0.430  -4.531
  260   1HE   LYS  28          1HE       LYS  28  12.550  -2.700  -5.640
  261   2HE   LYS  28          2HE       LYS  28  12.955  -1.588  -6.966
  262   1HZ   LYS  28          1HZ       LYS  28  15.163  -1.754  -6.505
  263   2HZ   LYS  28          2HZ       LYS  28  14.945  -2.266  -4.952
  264   3HZ   LYS  28          3HZ       LYS  28  14.654  -3.294  -6.208
  265    H    VAL  29           H        VAL  29  12.403  -0.691   0.847
  266    HA   VAL  29           HA       VAL  29  15.153   0.298   0.444
  267    HB   VAL  29           HB       VAL  29  13.694  -0.577   2.968
  268   1HG1  VAL  29          1HG1      VAL  29  15.658  -0.242   4.024
  269   2HG1  VAL  29          2HG1      VAL  29  16.436  -0.085   2.431
  270   3HG1  VAL  29          3HG1      VAL  29  15.832   1.362   3.273
  271   1HG2  VAL  29          1HG2      VAL  29  12.515   1.319   2.191
  272   2HG2  VAL  29          2HG2      VAL  29  13.732   2.008   3.292
  273   3HG2  VAL  29          3HG2      VAL  29  13.985   2.075   1.532
  274    H    GLN  30           H        GLN  30  14.189  -2.282  -0.720
  275    HA   GLN  30           HA       GLN  30  14.911  -4.443  -0.934
  276   1HB   GLN  30          1HB       GLN  30  17.181  -2.800  -0.383
  277   2HB   GLN  30          2HB       GLN  30  17.404  -4.334   0.492
  278   1HG   GLN  30          1HG       GLN  30  16.823  -5.556  -1.627
  279   2HG   GLN  30          2HG       GLN  30  16.784  -3.991  -2.469
  280   1HE2  GLN  30          1HE2      GLN  30  18.571  -3.822  -3.706
  281   2HE2  GLN  30          2HE2      GLN  30  20.201  -4.195  -3.188
  282    H    ARG  31           H        ARG  31  16.163  -6.288   0.532
  283    HA   ARG  31           HA       ARG  31  15.791  -7.747   2.259
  284   1HB   ARG  31          1HB       ARG  31  15.844  -5.088   3.728
  285   2HB   ARG  31          2HB       ARG  31  15.790  -6.661   4.560
  286   1HG   ARG  31          1HG       ARG  31  17.898  -5.887   2.501
  287   2HG   ARG  31          2HG       ARG  31  18.123  -5.750   4.262
  288   1HD   ARG  31          1HD       ARG  31  17.078  -8.368   3.623
  289   2HD   ARG  31          2HD       ARG  31  18.510  -8.046   2.622
  290    HE   ARG  31           HE       ARG  31  19.107  -7.260   5.274
  291   1HH1  ARG  31          2HH2      ARG  31  18.375 -10.169   3.402
  292   2HH1  ARG  31          1HH2      ARG  31  19.311 -11.231   4.430
  293   1HH2  ARG  31          2HH1      ARG  31  20.343  -8.664   6.632
  294   2HH2  ARG  31          1HH1      ARG  31  20.433 -10.373   6.271
  295    H    GLY  32           H        GLY  32  13.695  -8.278   1.253
  296   1HA   GLY  32          1HA       GLY  32  11.615  -8.596   2.998
  297   2HA   GLY  32          2HA       GLY  32  11.300  -6.994   2.293
  Start of MODEL    4
    1    HA   PRO   1           HA       PRO   1 -13.284   7.188  -9.176
    2   1HB   PRO   1          1HB       PRO   1 -13.572   5.735  -6.889
    3   2HB   PRO   1          2HB       PRO   1 -14.159   5.132  -8.473
    4   1HG   PRO   1          1HG       PRO   1 -11.516   4.499  -7.130
    5   2HG   PRO   1          2HG       PRO   1 -12.714   3.331  -7.778
    6   1HD   PRO   1          1HD       PRO   1 -10.564   4.127  -9.252
    7   2HD   PRO   1          2HD       PRO   1 -12.165   3.913 -10.024
    8    HA   PRO   2           HA       PRO   2 -10.236   9.562  -6.906
    9   1HB   PRO   2          1HB       PRO   2 -11.733  11.821  -6.626
   10   2HB   PRO   2          2HB       PRO   2 -11.065  11.321  -8.214
   11   1HG   PRO   2          1HG       PRO   2 -13.845  10.773  -7.135
   12   2HG   PRO   2          2HG       PRO   2 -13.416  11.502  -8.717
   13   1HD   PRO   2          1HD       PRO   2 -13.949   8.840  -8.476
   14   2HD   PRO   2          2HD       PRO   2 -12.628   9.407  -9.542
   15    H    LEU   3           H        LEU   3 -10.740   7.772  -5.235
   16    HA   LEU   3           HA       LEU   3 -11.127   8.804  -2.728
   17   1HB   LEU   3          1HB       LEU   3 -13.701   8.427  -4.150
   18   2HB   LEU   3          2HB       LEU   3 -13.628   7.708  -2.523
   19    HG   LEU   3           HG       LEU   3 -12.427  10.402  -2.685
   20   1HD1  LEU   3          1HD1      LEU   3 -14.211  11.627  -3.405
   21   2HD1  LEU   3          2HD1      LEU   3 -14.679  10.124  -4.236
   22   3HD1  LEU   3          3HD1      LEU   3 -15.391  10.525  -2.655
   23   1HD2  LEU   3          1HD2      LEU   3 -13.042  10.374  -0.506
   24   2HD2  LEU   3          2HD2      LEU   3 -14.723   9.950  -0.911
   25   3HD2  LEU   3          3HD2      LEU   3 -13.493   8.672  -0.766
   26    H    SER   4           H        SER   4 -10.587   7.252  -1.263
   27    HA   SER   4           HA       SER   4 -11.342   4.499  -1.539
   28   1HB   SER   4          1HB       SER   4  -9.769   3.920  -3.066
   29   2HB   SER   4          2HB       SER   4  -8.836   5.415  -2.812
   30    HG   SER   4           HG       SER   4  -7.720   3.556  -2.080
   31    H    GLN   5           H        GLN   5 -11.928   4.691   0.623
   32    HA   GLN   5           HA       GLN   5 -10.244   3.937   2.614
   33   1HB   GLN   5          1HB       GLN   5  -9.783   6.238   3.747
   34   2HB   GLN   5          2HB       GLN   5  -8.722   5.716   2.416
   35   1HG   GLN   5          1HG       GLN   5  -9.410   7.400   1.068
   36   2HG   GLN   5          2HG       GLN   5 -11.119   7.137   1.478
   37   1HE2  GLN   5          1HE2      GLN   5 -11.348   9.486   1.508
   38   2HE2  GLN   5          2HE2      GLN   5 -10.841  10.391   2.919
   39    H    GLU   6           H        GLU   6 -12.878   6.013   1.572
   40    HA   GLU   6           HA       GLU   6 -14.296   5.343   4.107
   41   1HB   GLU   6          1HB       GLU   6 -15.448   7.521   3.913
   42   2HB   GLU   6          2HB       GLU   6 -13.688   7.729   4.071
   43   1HG   GLU   6          1HG       GLU   6 -13.446   8.487   1.919
   44   2HG   GLU   6          2HG       GLU   6 -14.753   7.458   1.296
   45    H    THR   7           H        THR   7 -14.562   3.478   2.284
   46    HA   THR   7           HA       THR   7 -17.273   3.357   1.672
   47    HB   THR   7           HB       THR   7 -15.853   5.080  -0.147
   48    HG1  THR   7           1HG      THR   7 -17.900   5.523  -0.708
   49   1HG2  THR   7          1HG2      THR   7 -17.107   3.572  -2.107
   50   2HG2  THR   7          2HG2      THR   7 -15.352   3.617  -1.810
   51   3HG2  THR   7          3HG2      THR   7 -16.343   2.327  -1.089
   52    H    PHE   8           H        PHE   8 -14.672   2.708  -0.704
   53    HA   PHE   8           HA       PHE   8 -15.279  -0.167  -0.466
   54   1HB   PHE   8          1HB       PHE   8 -13.287   0.162  -2.367
   55   2HB   PHE   8          2HB       PHE   8 -15.028   0.050  -2.679
   56    HD1  PHE   8           1HD      PHE   8 -13.017   2.833  -1.171
   57    HD2  PHE   8           2HD      PHE   8 -15.463   1.510  -4.445
   58    HE1  PHE   8           1HE      PHE   8 -12.998   5.128  -2.112
   59    HE2  PHE   8           2HE      PHE   8 -15.444   3.805  -5.386
   60    HZ   PHE   8           HZ       PHE   8 -14.211   5.613  -4.220
   61    H    SER   9           H        SER   9 -13.098   2.140   0.796
   62    HA   SER   9           HA       SER   9 -10.624   1.394   1.002
   63   1HB   SER   9          1HB       SER   9 -12.031   2.736   2.716
   64   2HB   SER   9          2HB       SER   9 -12.189   1.190   3.584
   65    HG   SER   9           HG       SER   9 -10.172   1.310   4.150
   66    H    ASP  10           H        ASP  10 -13.262  -0.743   2.131
   67    HA   ASP  10           HA       ASP  10 -11.972  -2.789   3.363
   68   1HB   ASP  10          1HB       ASP  10 -13.588  -4.173   1.601
   69   2HB   ASP  10          2HB       ASP  10 -14.121  -3.433   3.127
   70    H    LEU  11           H        LEU  11 -12.015  -2.190  -0.178
   71    HA   LEU  11           HA       LEU  11 -10.458  -4.506  -0.832
   72   1HB   LEU  11          1HB       LEU  11 -10.011  -2.875  -2.920
   73   2HB   LEU  11          2HB       LEU  11 -11.562  -3.717  -2.686
   74    HG   LEU  11           HG       LEU  11 -11.617  -1.154  -3.149
   75   1HD1  LEU  11          1HD1      LEU  11 -13.725  -1.501  -2.435
   76   2HD1  LEU  11          2HD1      LEU  11 -13.185  -2.909  -1.490
   77   3HD1  LEU  11          3HD1      LEU  11 -13.179  -1.288  -0.754
   78   1HD2  LEU  11          1HD2      LEU  11 -11.392   0.207  -1.067
   79   2HD2  LEU  11          2HD2      LEU  11 -10.775  -1.231  -0.220
   80   3HD2  LEU  11          3HD2      LEU  11  -9.849  -0.527  -1.567
   81    H    TRP  12           H        TRP  12  -9.004  -1.816  -2.292
   82    HA   TRP  12           HA       TRP  12  -6.631  -1.582  -2.291
   83   1HB   TRP  12          1HB       TRP  12  -7.228  -0.193   0.294
   84   2HB   TRP  12          2HB       TRP  12  -6.288   0.365  -1.097
   85    HD1  TRP  12           HD       TRP  12  -9.088   1.483   0.584
   86    HE1  TRP  12           1HE      TRP  12 -10.880   2.561  -0.870
   87    HE3  TRP  12           3HE      TRP  12  -7.651  -0.364  -3.968
   88    HZ2  TRP  12           2HZ      TRP  12 -11.610   2.620  -3.670
   89    HZ3  TRP  12           3HZ      TRP  12  -8.917   0.225  -6.002
   90    HH2  TRP  12           HH       TRP  12 -10.894   1.712  -5.871
   91    H    LYS  13           H        LYS  13  -7.988  -2.749   0.798
   92    HA   LYS  13           HA       LYS  13  -5.643  -3.246   2.215
   93   1HB   LYS  13          1HB       LYS  13  -7.844  -3.549   3.194
   94   2HB   LYS  13          2HB       LYS  13  -8.215  -4.863   2.053
   95   1HG   LYS  13          1HG       LYS  13  -6.904  -6.385   3.169
   96   2HG   LYS  13          2HG       LYS  13  -5.710  -5.158   3.653
   97   1HD   LYS  13          1HD       LYS  13  -8.416  -4.827   4.839
   98   2HD   LYS  13          2HD       LYS  13  -7.530  -6.279   5.364
   99   1HE   LYS  13          1HE       LYS  13  -5.626  -4.938   6.050
  100   2HE   LYS  13          2HE       LYS  13  -6.356  -3.471   5.363
  101   1HZ   LYS  13          1HZ       LYS  13  -8.236  -4.340   7.030
  102   2HZ   LYS  13          2HZ       LYS  13  -6.868  -4.770   7.846
  103   3HZ   LYS  13          3HZ       LYS  13  -7.105  -3.199   7.402
  104    H    LEU  14           H        LEU  14  -6.462  -4.431  -0.840
  105    HA   LEU  14           HA       LEU  14  -5.148  -7.030  -0.545
  106   1HB   LEU  14          1HB       LEU  14  -5.455  -6.868  -3.158
  107   2HB   LEU  14          2HB       LEU  14  -6.871  -7.125  -2.109
  108    HG   LEU  14           HG       LEU  14  -7.173  -5.315  -3.860
  109   1HD1  LEU  14          1HD1      LEU  14  -7.425  -3.670  -1.497
  110   2HD1  LEU  14          2HD1      LEU  14  -8.699  -4.517  -2.407
  111   3HD1  LEU  14          3HD1      LEU  14  -7.841  -5.352  -1.089
  112   1HD2  LEU  14          1HD2      LEU  14  -5.802  -3.489  -3.959
  113   2HD2  LEU  14          2HD2      LEU  14  -5.597  -3.423  -2.192
  114   3HD2  LEU  14          3HD2      LEU  14  -4.637  -4.569  -3.157
  115    H    LEU  15           H        LEU  15  -4.505  -3.839  -2.062
  116    HA   LEU  15           HA       LEU  15  -2.006  -4.545  -3.215
  117   1HB   LEU  15          1HB       LEU  15  -3.512  -2.062  -2.565
  118   2HB   LEU  15          2HB       LEU  15  -1.749  -1.884  -2.730
  119    HG   LEU  15           HG       LEU  15  -3.446  -1.809  -4.847
  120   1HD1  LEU  15          1HD1      LEU  15  -1.341  -1.311  -5.544
  121   2HD1  LEU  15          2HD1      LEU  15  -0.598  -2.461  -4.406
  122   3HD1  LEU  15          3HD1      LEU  15  -1.232  -3.037  -5.966
  123   1HD2  LEU  15          1HD2      LEU  15  -2.451  -4.518  -5.375
  124   2HD2  LEU  15          2HD2      LEU  15  -3.611  -4.479  -4.025
  125   3HD2  LEU  15          3HD2      LEU  15  -4.079  -3.840  -5.619
  126    H    LYS  16           H        LYS  16  -2.993  -4.025   0.065
  127    HA   LYS  16           HA       LYS  16  -0.752  -2.961   1.296
  128   1HB   LYS  16          1HB       LYS  16  -2.415  -3.369   2.818
  129   2HB   LYS  16          2HB       LYS  16  -2.888  -4.905   2.052
  130   1HG   LYS  16          1HG       LYS  16  -0.176  -4.739   3.335
  131   2HG   LYS  16          2HG       LYS  16  -1.600  -4.857   4.397
  132   1HD   LYS  16          1HD       LYS  16  -0.634  -6.808   2.290
  133   2HD   LYS  16          2HD       LYS  16  -1.022  -7.113   4.000
  134   1HE   LYS  16          1HE       LYS  16  -3.427  -6.245   3.238
  135   2HE   LYS  16          2HE       LYS  16  -2.859  -6.786   1.644
  136   1HZ   LYS  16          1HZ       LYS  16  -3.048  -8.400   4.085
  137   2HZ   LYS  16          2HZ       LYS  16  -3.962  -8.548   2.720
  138   3HZ   LYS  16          3HZ       LYS  16  -2.355  -8.919   2.682
  139    H    LYS  17           H        LYS  17  -1.361  -6.505   0.938
  140    HA   LYS  17           HA       LYS  17   1.122  -7.420   1.733
  141   1HB   LYS  17          1HB       LYS  17  -0.554  -9.027   1.308
  142   2HB   LYS  17          2HB       LYS  17  -0.853  -8.413  -0.336
  143   1HG   LYS  17          1HG       LYS  17   0.454 -10.254  -0.849
  144   2HG   LYS  17          2HG       LYS  17   1.734  -9.035  -0.639
  145   1HD   LYS  17          1HD       LYS  17   2.091  -9.747   1.672
  146   2HD   LYS  17          2HD       LYS  17   0.726 -10.884   1.564
  147   1HE   LYS  17          1HE       LYS  17   1.958 -11.994  -0.371
  148   2HE   LYS  17          2HE       LYS  17   3.361 -10.990   0.052
  149   1HZ   LYS  17          1HZ       LYS  17   2.068 -12.589   2.104
  150   2HZ   LYS  17          2HZ       LYS  17   3.099 -13.317   1.041
  151   3HZ   LYS  17          3HZ       LYS  17   3.635 -12.085   1.998
  152    H    TRP  18           H        TRP  18   0.263  -5.703  -1.204
  153    HA   TRP  18           HA       TRP  18   3.028  -6.160  -2.221
  154   1HB   TRP  18          1HB       TRP  18   1.630  -5.076  -4.307
  155   2HB   TRP  18          2HB       TRP  18   1.916  -6.804  -4.058
  156    HD1  TRP  18           HD       TRP  18  -0.775  -4.404  -4.624
  157    HE1  TRP  18           1HE      TRP  18  -3.075  -5.407  -4.188
  158    HE3  TRP  18           3HE      TRP  18   0.651  -8.647  -2.141
  159    HZ2  TRP  18           2HZ      TRP  18  -4.174  -7.763  -2.917
  160    HZ3  TRP  18           3HZ      TRP  18  -1.048 -10.243  -1.334
  161    HH2  TRP  18           HH       TRP  18  -3.459  -9.818  -1.713
  162    H    LYS  19           H        LYS  19   0.873  -3.935  -0.780
  163    HA   LYS  19           HA       LYS  19   2.331  -1.607  -1.900
  164   1HB   LYS  19          1HB       LYS  19  -0.221  -1.720  -1.830
  165   2HB   LYS  19          2HB       LYS  19  -0.082  -1.597  -0.059
  166   1HG   LYS  19          1HG       LYS  19   1.608   0.418  -0.940
  167   2HG   LYS  19          2HG       LYS  19   0.287   0.473  -2.131
  168   1HD   LYS  19          1HD       LYS  19  -1.370   0.724  -0.389
  169   2HD   LYS  19          2HD       LYS  19  -0.162   0.407   0.880
  170   1HE   LYS  19          1HE       LYS  19  -0.421   2.774   0.841
  171   2HE   LYS  19          2HE       LYS  19   1.098   2.453  -0.024
  172   1HZ   LYS  19          1HZ       LYS  19  -0.549   4.026  -1.055
  173   2HZ   LYS  19          2HZ       LYS  19   0.096   2.862  -2.029
  174   3HZ   LYS  19          3HZ       LYS  19  -1.438   2.694  -1.447
  175    H    MET  20           H        MET  20   2.684  -3.801   0.545
  176    HA   MET  20           HA       MET  20   3.119  -2.128   2.823
  177   1HB   MET  20          1HB       MET  20   2.944  -4.801   2.417
  178   2HB   MET  20          2HB       MET  20   4.714  -4.626   2.503
  179   1HG   MET  20          1HG       MET  20   4.320  -4.801   4.742
  180   2HG   MET  20          2HG       MET  20   4.040  -3.059   4.580
  181   1HE   MET  20          1HE       MET  20   0.586  -2.395   5.525
  182   2HE   MET  20          2HE       MET  20   2.247  -1.870   5.157
  183   3HE   MET  20          3HE       MET  20   1.139  -2.309   3.835
  184    H    ARG  21           H        ARG  21   5.283  -1.800   3.858
  185    HA   ARG  21           HA       ARG  21   7.393  -0.917   3.817
  186   1HB   ARG  21          1HB       ARG  21   7.605  -3.206   2.406
  187   2HB   ARG  21          2HB       ARG  21   8.021  -2.043   1.123
  188   1HG   ARG  21          1HG       ARG  21   9.798  -1.093   2.466
  189   2HG   ARG  21          2HG       ARG  21   9.298  -2.040   3.888
  190   1HD   ARG  21          1HD       ARG  21  11.265  -3.039   2.728
  191   2HD   ARG  21          2HD       ARG  21   9.859  -4.126   2.741
  192    HE   ARG  21           HE       ARG  21  10.098  -2.434   0.359
  193   1HH1  ARG  21          2HH2      ARG  21  10.862  -5.511   1.924
  194   2HH1  ARG  21          1HH2      ARG  21  11.114  -6.370   0.421
  195   1HH2  ARG  21          2HH1      ARG  21  10.432  -3.568  -1.626
  196   2HH2  ARG  21          1HH1      ARG  21  10.869  -5.262  -1.603
  197    H    ARG  22           H        ARG  22   4.935   0.044   1.985
  198    HA   ARG  22           HA       ARG  22   6.457   1.896   0.254
  199   1HB   ARG  22          1HB       ARG  22   3.482   1.310   0.524
  200   2HB   ARG  22          2HB       ARG  22   4.201   2.444  -0.645
  201   1HG   ARG  22          1HG       ARG  22   5.346  -0.320  -0.554
  202   2HG   ARG  22          2HG       ARG  22   3.717  -0.143  -1.249
  203   1HD   ARG  22          1HD       ARG  22   5.015   0.238  -3.133
  204   2HD   ARG  22          2HD       ARG  22   4.839   1.898  -2.524
  205    HE   ARG  22           HE       ARG  22   7.174   0.477  -1.490
  206   1HH1  ARG  22          2HH2      ARG  22   5.841   2.511  -4.056
  207   2HH1  ARG  22          1HH2      ARG  22   7.394   3.154  -4.541
  208   1HH2  ARG  22          2HH1      ARG  22   9.225   1.326  -2.130
  209   2HH2  ARG  22          1HH1      ARG  22   9.324   2.478  -3.443
  210    H    ASN  23           H        ASN  23   7.248   2.779   2.486
  211    HA   ASN  23           HA       ASN  23   5.253   4.631   3.652
  212   1HB   ASN  23          1HB       ASN  23   6.412   3.397   5.312
  213   2HB   ASN  23          2HB       ASN  23   7.978   3.620   4.502
  214   1HD2  ASN  23          1HD2      ASN  23   5.276   5.570   5.898
  215   2HD2  ASN  23          2HD2      ASN  23   6.305   6.787   6.623
  216    H    GLN  24           H        GLN  24   8.700   5.299   3.689
  217    HA   GLN  24           HA       GLN  24   8.537   7.222   1.491
  218   1HB   GLN  24          1HB       GLN  24   7.692   8.117   3.945
  219   2HB   GLN  24          2HB       GLN  24   9.429   8.500   4.007
  220   1HG   GLN  24          1HG       GLN  24   8.635   9.216   1.409
  221   2HG   GLN  24          2HG       GLN  24   7.300   9.757   2.449
  222   1HE2  GLN  24          1HE2      GLN  24   7.505  11.719   3.371
  223   2HE2  GLN  24          2HE2      GLN  24   9.016  12.562   3.640
  224    H    PHE  25           H        PHE  25  10.444   6.602   4.499
  225    HA   PHE  25           HA       PHE  25  12.931   6.899   2.997
  226   1HB   PHE  25          1HB       PHE  25  13.013   7.773   5.171
  227   2HB   PHE  25          2HB       PHE  25  12.162   6.384   5.867
  228    HD1  PHE  25           1HD      PHE  25  13.485   4.043   5.379
  229    HD2  PHE  25           2HD      PHE  25  15.255   7.945   5.686
  230    HE1  PHE  25           1HE      PHE  25  15.658   3.010   5.977
  231    HE2  PHE  25           2HE      PHE  25  17.428   6.912   6.284
  232    HZ   PHE  25           HZ       PHE  25  17.630   4.444   6.430
  233    H    TRP  26           H        TRP  26  10.860   4.313   4.244
  234    HA   TRP  26           HA       TRP  26  12.878   2.324   3.332
  235   1HB   TRP  26          1HB       TRP  26  11.446   0.736   4.669
  236   2HB   TRP  26          2HB       TRP  26  12.314   1.961   5.604
  237    HD1  TRP  26           HD       TRP  26   8.870   0.700   4.801
  238    HE1  TRP  26           1HE      TRP  26   7.110   1.935   6.166
  239    HE3  TRP  26           3HE      TRP  26  11.807   4.429   6.715
  240    HZ2  TRP  26           2HZ      TRP  26   6.982   4.261   7.884
  241    HZ3  TRP  26           3HZ      TRP  26  10.832   6.134   8.209
  242    HH2  TRP  26           HH       TRP  26   8.428   6.065   8.802
  243    H    VAL  27           H        VAL  27  11.690   3.540   1.246
  244    HA   VAL  27           HA       VAL  27   9.500   1.682   0.447
  245    HB   VAL  27           HB       VAL  27   8.903   3.471  -1.195
  246   1HG1  VAL  27          1HG1      VAL  27   8.405   5.215   0.814
  247   2HG1  VAL  27          2HG1      VAL  27   7.511   3.688   0.624
  248   3HG1  VAL  27          3HG1      VAL  27   8.861   3.790   1.779
  249   1HG2  VAL  27          1HG2      VAL  27   9.931   5.781  -0.523
  250   2HG2  VAL  27          2HG2      VAL  27  11.238   4.807   0.192
  251   3HG2  VAL  27          3HG2      VAL  27  10.889   4.688  -1.549
  252    H    LYS  28           H        LYS  28  10.834   0.008  -0.312
  253    HA   LYS  28           HA       LYS  28  11.723  -1.031  -2.207
  254   1HB   LYS  28          1HB       LYS  28  11.095   1.382  -3.300
  255   2HB   LYS  28          2HB       LYS  28  12.872   1.443  -3.387
  256   1HG   LYS  28          1HG       LYS  28  12.924  -0.706  -4.559
  257   2HG   LYS  28          2HG       LYS  28  11.161  -0.873  -4.388
  258   1HD   LYS  28          1HD       LYS  28  10.888   1.258  -5.693
  259   2HD   LYS  28          2HD       LYS  28  12.648   1.274  -5.958
  260   1HE   LYS  28          1HE       LYS  28  11.936  -1.316  -6.664
  261   2HE   LYS  28          2HE       LYS  28  10.561  -0.355  -7.249
  262   1HZ   LYS  28          1HZ       LYS  28  13.383   0.178  -7.855
  263   2HZ   LYS  28          2HZ       LYS  28  12.305  -0.543  -8.874
  264   3HZ   LYS  28          3HZ       LYS  28  12.090   1.029  -8.424
  265    H    VAL  29           H        VAL  29  12.953  -1.044   0.173
  266    HA   VAL  29           HA       VAL  29  15.704  -0.044  -0.170
  267    HB   VAL  29           HB       VAL  29  14.569  -1.651   2.139
  268   1HG1  VAL  29          1HG1      VAL  29  16.807   0.404   1.881
  269   2HG1  VAL  29          2HG1      VAL  29  16.327  -0.423   3.383
  270   3HG1  VAL  29          3HG1      VAL  29  17.022  -1.357   2.036
  271   1HG2  VAL  29          1HG2      VAL  29  14.437   1.343   1.592
  272   2HG2  VAL  29          2HG2      VAL  29  13.065   0.231   1.815
  273   3HG2  VAL  29          3HG2      VAL  29  14.138   0.606   3.184
  274    H    GLN  30           H        GLN  30  14.559  -2.183  -1.918
  275    HA   GLN  30           HA       GLN  30  15.000  -4.361  -2.576
  276   1HB   GLN  30          1HB       GLN  30  17.740  -3.217  -1.921
  277   2HB   GLN  30          2HB       GLN  30  17.480  -4.711  -2.853
  278   1HG   GLN  30          1HG       GLN  30  15.756  -2.761  -3.981
  279   2HG   GLN  30          2HG       GLN  30  17.318  -1.951  -3.732
  280   1HE2  GLN  30          1HE2      GLN  30  18.909  -2.279  -5.201
  281   2HE2  GLN  30          2HE2      GLN  30  18.908  -3.536  -6.420
  282    H    ARG  31           H        ARG  31  13.956  -5.563  -0.926
  283    HA   ARG  31           HA       ARG  31  15.875  -6.860   0.934
  284   1HB   ARG  31          1HB       ARG  31  14.077  -4.985   1.804
  285   2HB   ARG  31          2HB       ARG  31  13.119  -6.478   1.954
  286   1HG   ARG  31          1HG       ARG  31  15.946  -6.625   2.900
  287   2HG   ARG  31          2HG       ARG  31  14.843  -5.622   3.872
  288   1HD   ARG  31          1HD       ARG  31  13.470  -7.420   4.420
  289   2HD   ARG  31          2HD       ARG  31  13.928  -8.345   2.974
  290    HE   ARG  31           HE       ARG  31  16.094  -7.916   4.899
  291   1HH1  ARG  31          2HH2      ARG  31  13.423  -9.971   3.828
  292   2HH1  ARG  31          1HH2      ARG  31  14.055 -11.419   4.580
  293   1HH2  ARG  31          2HH1      ARG  31  16.928  -9.829   5.893
  294   2HH2  ARG  31          1HH1      ARG  31  16.053 -11.337   5.757
  295    H    GLY  32           H        GLY  32  15.971  -8.757  -0.255
  296   1HA   GLY  32          1HA       GLY  32  13.512 -10.011  -1.217
  297   2HA   GLY  32          2HA       GLY  32  15.169 -10.641  -1.361
  Start of MODEL    5
    1    HA   PRO   1           HA       PRO   1  -2.696   7.579  -2.467
    2   1HB   PRO   1          1HB       PRO   1  -3.550   5.615  -0.782
    3   2HB   PRO   1          2HB       PRO   1  -1.973   5.513  -1.631
    4   1HG   PRO   1          1HG       PRO   1  -2.481   6.509   1.187
    5   2HG   PRO   1          2HG       PRO   1  -1.297   5.265   0.669
    6   1HD   PRO   1          1HD       PRO   1  -0.564   7.867   1.017
    7   2HD   PRO   1          2HD       PRO   1   0.091   6.915  -0.350
    8    HA   PRO   2           HA       PRO   2  -6.342   9.459  -0.868
    9   1HB   PRO   2          1HB       PRO   2  -8.360   7.767  -1.569
   10   2HB   PRO   2          2HB       PRO   2  -7.354   8.601  -2.799
   11   1HG   PRO   2          1HG       PRO   2  -6.979   5.795  -1.713
   12   2HG   PRO   2          2HG       PRO   2  -7.075   6.292  -3.434
   13   1HD   PRO   2          1HD       PRO   2  -4.677   5.956  -2.183
   14   2HD   PRO   2          2HD       PRO   2  -4.921   7.310  -3.329
   15    H    LEU   3           H        LEU   3  -5.139   8.766   1.312
   16    HA   LEU   3           HA       LEU   3  -5.459   8.178   3.501
   17   1HB   LEU   3          1HB       LEU   3  -8.290   7.729   2.491
   18   2HB   LEU   3          2HB       LEU   3  -7.819   7.572   4.200
   19    HG   LEU   3           HG       LEU   3  -8.735   9.873   3.367
   20   1HD1  LEU   3          1HD1      LEU   3  -7.866   9.822   5.551
   21   2HD1  LEU   3          2HD1      LEU   3  -6.238   9.365   4.996
   22   3HD1  LEU   3          3HD1      LEU   3  -6.827  11.027   4.752
   23   1HD2  LEU   3          1HD2      LEU   3  -5.837  10.085   2.454
   24   2HD2  LEU   3          2HD2      LEU   3  -7.211   9.862   1.344
   25   3HD2  LEU   3          3HD2      LEU   3  -7.100  11.335   2.338
   26    H    SER   4           H        SER   4  -4.724   6.390   4.505
   27    HA   SER   4           HA       SER   4  -5.777   3.756   3.793
   28   1HB   SER   4          1HB       SER   4  -4.183   3.367   2.240
   29   2HB   SER   4          2HB       SER   4  -3.239   4.796   2.727
   30    HG   SER   4           HG       SER   4  -2.864   2.208   3.359
   31    H    GLN   5           H        GLN   5  -6.172   2.925   5.754
   32    HA   GLN   5           HA       GLN   5  -3.998   2.940   7.742
   33   1HB   GLN   5          1HB       GLN   5  -6.780   4.064   8.248
   34   2HB   GLN   5          2HB       GLN   5  -5.590   3.695   9.520
   35   1HG   GLN   5          1HG       GLN   5  -3.995   5.187   8.022
   36   2HG   GLN   5          2HG       GLN   5  -5.528   5.835   7.399
   37   1HE2  GLN   5          1HE2      GLN   5  -7.012   6.874   8.875
   38   2HE2  GLN   5          2HE2      GLN   5  -6.436   7.545  10.386
   39    H    GLU   6           H        GLU   6  -7.294   2.357   8.722
   40    HA   GLU   6           HA       GLU   6  -6.749  -0.572   8.587
   41   1HB   GLU   6          1HB       GLU   6  -8.098  -0.782  10.599
   42   2HB   GLU   6          2HB       GLU   6  -6.828   0.433  10.879
   43   1HG   GLU   6          1HG       GLU   6  -8.372   2.016  11.291
   44   2HG   GLU   6          2HG       GLU   6  -9.150   1.709   9.723
   45    H    THR   7           H        THR   7  -7.800   0.770   6.341
   46    HA   THR   7           HA       THR   7 -10.285  -0.685   6.039
   47    HB   THR   7           HB       THR   7 -10.280   2.244   6.589
   48    HG1  THR   7           1HG      THR   7 -12.150   0.113   6.746
   49   1HG2  THR   7          1HG2      THR   7 -11.187   2.815   4.600
   50   2HG2  THR   7          2HG2      THR   7 -11.263   1.114   4.082
   51   3HG2  THR   7          3HG2      THR   7 -12.591   1.812   5.040
   52    H    PHE   8           H        PHE   8  -9.720   2.344   4.338
   53    HA   PHE   8           HA       PHE   8  -9.728   1.222   1.788
   54   1HB   PHE   8          1HB       PHE   8  -8.141   3.435   1.482
   55   2HB   PHE   8          2HB       PHE   8  -9.912   3.449   1.539
   56    HD1  PHE   8           1HD      PHE   8  -7.569   2.848   4.382
   57    HD2  PHE   8           2HD      PHE   8 -10.346   5.548   2.527
   58    HE1  PHE   8           1HE      PHE   8  -7.493   4.303   6.389
   59    HE2  PHE   8           2HE      PHE   8 -10.271   7.004   4.534
   60    HZ   PHE   8           HZ       PHE   8  -8.844   6.381   6.464
   61    H    SER   9           H        SER   9  -7.254   1.128   4.206
   62    HA   SER   9           HA       SER   9  -5.035   0.780   2.366
   63   1HB   SER   9          1HB       SER   9  -4.894   1.680   4.737
   64   2HB   SER   9          2HB       SER   9  -5.199   0.020   5.303
   65    HG   SER   9           HG       SER   9  -2.997   0.327   5.163
   66    H    ASP  10           H        ASP  10  -7.507  -1.228   3.824
   67    HA   ASP  10           HA       ASP  10  -6.153  -3.734   3.654
   68   1HB   ASP  10          1HB       ASP  10  -8.475  -2.898   4.740
   69   2HB   ASP  10          2HB       ASP  10  -9.104  -3.591   3.228
   70    H    LEU  11           H        LEU  11  -7.652  -1.634   1.290
   71    HA   LEU  11           HA       LEU  11  -7.868  -3.773  -0.710
   72   1HB   LEU  11          1HB       LEU  11  -8.245  -1.334  -1.990
   73   2HB   LEU  11          2HB       LEU  11  -9.526  -2.361  -1.301
   74    HG   LEU  11           HG       LEU  11  -9.937  -0.333  -0.218
   75   1HD1  LEU  11          1HD1      LEU  11  -9.074  -2.379   1.313
   76   2HD1  LEU  11          2HD1      LEU  11  -7.841  -1.173   1.751
   77   3HD1  LEU  11          3HD1      LEU  11  -9.566  -0.815   2.006
   78   1HD2  LEU  11          1HD2      LEU  11  -6.932   0.060   0.107
   79   2HD2  LEU  11          2HD2      LEU  11  -7.898   0.764  -1.212
   80   3HD2  LEU  11          3HD2      LEU  11  -8.213   1.240   0.474
   81    H    TRP  12           H        TRP  12  -6.798  -0.644  -1.781
   82    HA   TRP  12           HA       TRP  12  -5.034  -0.624  -3.458
   83   1HB   TRP  12          1HB       TRP  12  -3.477  -0.298  -0.922
   84   2HB   TRP  12          2HB       TRP  12  -3.489   0.707  -2.378
   85    HD1  TRP  12           HD       TRP  12  -4.146   1.251   0.955
   86    HE1  TRP  12           1HE      TRP  12  -6.049   2.869   1.453
   87    HE3  TRP  12           3HE      TRP  12  -6.504   1.146  -3.587
   88    HZ2  TRP  12           2HZ      TRP  12  -8.323   3.989   0.057
   89    HZ3  TRP  12           3HZ      TRP  12  -8.532   2.500  -3.964
   90    HH2  TRP  12           HH       TRP  12  -9.453   3.922  -2.157
   91    H    LYS  13           H        LYS  13  -4.516  -2.831  -0.706
   92    HA   LYS  13           HA       LYS  13  -2.062  -3.944  -1.405
   93   1HB   LYS  13          1HB       LYS  13  -3.549  -4.407   0.628
   94   2HB   LYS  13          2HB       LYS  13  -4.433  -5.553  -0.407
   95   1HG   LYS  13          1HG       LYS  13  -1.784  -6.216  -0.896
   96   2HG   LYS  13          2HG       LYS  13  -1.766  -5.799   0.834
   97   1HD   LYS  13          1HD       LYS  13  -3.757  -7.315   1.149
   98   2HD   LYS  13          2HD       LYS  13  -3.580  -7.819  -0.549
   99   1HE   LYS  13          1HE       LYS  13  -2.138  -9.386   0.197
  100   2HE   LYS  13          2HE       LYS  13  -0.997  -8.054   0.481
  101   1HZ   LYS  13          1HZ       LYS  13  -2.992  -8.774   2.483
  102   2HZ   LYS  13          2HZ       LYS  13  -1.564  -9.594   2.382
  103   3HZ   LYS  13          3HZ       LYS  13  -1.564  -7.972   2.680
  104    H    LEU  14           H        LEU  14  -4.877  -3.832  -3.288
  105    HA   LEU  14           HA       LEU  14  -4.409  -6.377  -4.669
  106   1HB   LEU  14          1HB       LEU  14  -6.274  -5.391  -6.161
  107   2HB   LEU  14          2HB       LEU  14  -6.694  -5.795  -4.479
  108    HG   LEU  14           HG       LEU  14  -7.524  -3.530  -5.226
  109   1HD1  LEU  14          1HD1      LEU  14  -5.631  -2.686  -3.179
  110   2HD1  LEU  14          2HD1      LEU  14  -7.386  -2.952  -3.049
  111   3HD1  LEU  14          3HD1      LEU  14  -6.261  -4.313  -2.825
  112   1HD2  LEU  14          1HD2      LEU  14  -4.901  -3.349  -6.259
  113   2HD2  LEU  14          2HD2      LEU  14  -6.131  -2.062  -6.225
  114   3HD2  LEU  14          3HD2      LEU  14  -4.952  -2.202  -4.899
  115    H    LEU  15           H        LEU  15  -3.998  -2.863  -5.214
  116    HA   LEU  15           HA       LEU  15  -3.250  -2.903  -7.905
  117   1HB   LEU  15          1HB       LEU  15  -2.779  -1.150  -5.547
  118   2HB   LEU  15          2HB       LEU  15  -1.646  -0.951  -6.904
  119    HG   LEU  15           HG       LEU  15  -3.828   0.457  -6.937
  120   1HD1  LEU  15          1HD1      LEU  15  -3.271   0.692  -9.109
  121   2HD1  LEU  15          2HD1      LEU  15  -2.243  -0.753  -8.957
  122   3HD1  LEU  15          3HD1      LEU  15  -3.933  -0.915  -9.491
  123   1HD2  LEU  15          1HD2      LEU  15  -4.822  -2.359  -7.336
  124   2HD2  LEU  15          2HD2      LEU  15  -5.565  -1.013  -6.439
  125   3HD2  LEU  15          3HD2      LEU  15  -5.616  -1.033  -8.218
  126    H    LYS  16           H        LYS  16  -1.439  -3.841  -5.005
  127    HA   LYS  16           HA       LYS  16   1.174  -3.810  -5.872
  128   1HB   LYS  16          1HB       LYS  16   1.051  -4.618  -3.739
  129   2HB   LYS  16          2HB       LYS  16  -0.445  -5.530  -4.057
  130   1HG   LYS  16          1HG       LYS  16   2.127  -6.387  -5.382
  131   2HG   LYS  16          2HG       LYS  16   1.831  -6.821  -3.682
  132   1HD   LYS  16          1HD       LYS  16   0.202  -7.563  -6.132
  133   2HD   LYS  16          2HD       LYS  16   0.942  -8.642  -4.925
  134   1HE   LYS  16          1HE       LYS  16  -0.642  -7.196  -3.287
  135   2HE   LYS  16          2HE       LYS  16  -1.590  -7.055  -4.783
  136   1HZ   LYS  16          1HZ       LYS  16  -2.292  -8.952  -3.627
  137   2HZ   LYS  16          2HZ       LYS  16  -1.444  -9.483  -4.938
  138   3HZ   LYS  16          3HZ       LYS  16  -0.756  -9.523  -3.440
  139    H    LYS  17           H        LYS  17  -1.133  -6.550  -6.350
  140    HA   LYS  17           HA       LYS  17   0.429  -8.238  -7.848
  141   1HB   LYS  17          1HB       LYS  17  -1.721  -9.014  -7.374
  142   2HB   LYS  17          2HB       LYS  17  -2.498  -7.518  -7.945
  143   1HG   LYS  17          1HG       LYS  17  -2.890  -8.656  -9.870
  144   2HG   LYS  17          2HG       LYS  17  -1.159  -8.421 -10.206
  145   1HD   LYS  17          1HD       LYS  17  -0.811 -10.568  -8.772
  146   2HD   LYS  17          2HD       LYS  17  -2.553 -10.837  -9.021
  147   1HE   LYS  17          1HE       LYS  17  -1.148 -10.090 -11.493
  148   2HE   LYS  17          2HE       LYS  17  -0.514 -11.584 -10.769
  149   1HZ   LYS  17          1HZ       LYS  17  -3.285 -11.016 -11.534
  150   2HZ   LYS  17          2HZ       LYS  17  -2.271 -12.140 -12.187
  151   3HZ   LYS  17          3HZ       LYS  17  -2.836 -12.333 -10.649
  152    H    TRP  18           H        TRP  18  -0.675  -5.046  -8.714
  153    HA   TRP  18           HA       TRP  18   0.512  -5.447 -11.418
  154   1HB   TRP  18          1HB       TRP  18  -1.183  -3.519 -11.984
  155   2HB   TRP  18          2HB       TRP  18  -1.692  -5.213 -12.007
  156    HD1  TRP  18           HD       TRP  18  -2.504  -1.924 -10.512
  157    HE1  TRP  18           1HE      TRP  18  -4.378  -2.111  -8.798
  158    HE3  TRP  18           3HE      TRP  18  -2.635  -7.016 -10.011
  159    HZ2  TRP  18           2HZ      TRP  18  -5.774  -4.209  -7.375
  160    HZ3  TRP  18           3HZ      TRP  18  -4.248  -8.070  -8.469
  161    HH2  TRP  18           HH       TRP  18  -5.820  -6.685  -7.147
  162    H    LYS  19           H        LYS  19   0.554  -3.849  -8.418
  163    HA   LYS  19           HA       LYS  19   2.133  -1.610  -9.596
  164   1HB   LYS  19          1HB       LYS  19   0.044  -1.730  -7.494
  165   2HB   LYS  19          2HB       LYS  19   1.478  -0.759  -7.081
  166   1HG   LYS  19          1HG       LYS  19   1.200   0.269  -9.457
  167   2HG   LYS  19          2HG       LYS  19  -0.441  -0.420  -9.403
  168   1HD   LYS  19          1HD       LYS  19  -0.630   0.740  -7.086
  169   2HD   LYS  19          2HD       LYS  19   0.796   1.675  -7.594
  170   1HE   LYS  19          1HE       LYS  19  -1.558   1.424  -9.460
  171   2HE   LYS  19          2HE       LYS  19  -1.637   2.574  -8.107
  172   1HZ   LYS  19          1HZ       LYS  19   0.681   2.547  -9.864
  173   2HZ   LYS  19          2HZ       LYS  19  -0.700   3.312 -10.341
  174   3HZ   LYS  19          3HZ       LYS  19   0.067   3.782  -8.959
  175    H    MET  20           H        MET  20   2.562  -4.544  -8.333
  176    HA   MET  20           HA       MET  20   3.937  -4.730  -6.086
  177   1HB   MET  20          1HB       MET  20   5.503  -6.250  -7.146
  178   2HB   MET  20          2HB       MET  20   3.921  -6.419  -7.944
  179   1HG   MET  20          1HG       MET  20   5.251  -4.331  -9.300
  180   2HG   MET  20          2HG       MET  20   6.475  -5.588  -9.055
  181   1HE   MET  20          1HE       MET  20   2.559  -6.402  -9.497
  182   2HE   MET  20          2HE       MET  20   2.898  -4.802 -10.199
  183   3HE   MET  20          3HE       MET  20   2.450  -6.161 -11.258
  184    H    ARG  21           H        ARG  21   5.771  -4.010  -5.055
  185    HA   ARG  21           HA       ARG  21   7.742  -2.833  -4.749
  186   1HB   ARG  21          1HB       ARG  21   8.012  -3.369  -7.332
  187   2HB   ARG  21          2HB       ARG  21   7.618  -1.642  -7.508
  188   1HG   ARG  21          1HG       ARG  21   9.549  -0.949  -6.436
  189   2HG   ARG  21          2HG       ARG  21   9.648  -2.418  -5.435
  190   1HD   ARG  21          1HD       ARG  21   9.867  -3.249  -8.151
  191   2HD   ARG  21          2HD       ARG  21  10.941  -1.847  -7.956
  192    HE   ARG  21           HE       ARG  21  11.331  -3.579  -5.745
  193   1HH1  ARG  21          2HH2      ARG  21  11.819  -3.465  -9.245
  194   2HH1  ARG  21          1HH2      ARG  21  13.206  -4.532  -9.225
  195   1HH2  ARG  21          2HH1      ARG  21  13.162  -4.989  -5.718
  196   2HH2  ARG  21          1HH1      ARG  21  13.971  -5.401  -7.213
  197    H    ARG  22           H        ARG  22   4.679  -1.748  -5.540
  198    HA   ARG  22           HA       ARG  22   5.270   1.116  -5.251
  199   1HB   ARG  22          1HB       ARG  22   2.916  -0.586  -5.963
  200   2HB   ARG  22          2HB       ARG  22   2.584   0.988  -5.201
  201   1HG   ARG  22          1HG       ARG  22   2.774   0.921  -7.789
  202   2HG   ARG  22          2HG       ARG  22   3.683   2.186  -6.927
  203   1HD   ARG  22          1HD       ARG  22   5.132  -0.379  -7.227
  204   2HD   ARG  22          2HD       ARG  22   4.770   0.440  -8.761
  205    HE   ARG  22           HE       ARG  22   5.953   2.098  -6.631
  206   1HH1  ARG  22          2HH2      ARG  22   6.388   0.180  -9.569
  207   2HH1  ARG  22          1HH2      ARG  22   7.922   0.911  -9.983
  208   1HH2  ARG  22          2HH1      ARG  22   7.979   3.064  -7.178
  209   2HH2  ARG  22          1HH1      ARG  22   8.830   2.556  -8.620
  210    H    ASN  23           H        ASN  23   6.320   0.441  -3.065
  211    HA   ASN  23           HA       ASN  23   4.677   1.420  -0.981
  212   1HB   ASN  23          1HB       ASN  23   4.004  -1.189  -1.562
  213   2HB   ASN  23          2HB       ASN  23   5.211  -1.394  -0.274
  214   1HD2  ASN  23          1HD2      ASN  23   3.787  -2.033   1.353
  215   2HD2  ASN  23          2HD2      ASN  23   2.579  -0.963   2.032
  216    H    GLN  24           H        GLN  24   7.468  -0.409  -2.118
  217    HA   GLN  24           HA       GLN  24   9.165  -0.818  -0.135
  218   1HB   GLN  24          1HB       GLN  24   9.476  -0.225  -2.795
  219   2HB   GLN  24          2HB       GLN  24  10.342   1.128  -2.030
  220   1HG   GLN  24          1HG       GLN  24  10.795  -1.671  -1.014
  221   2HG   GLN  24          2HG       GLN  24  11.586  -1.160  -2.521
  222   1HE2  GLN  24          1HE2      GLN  24  13.698  -0.931  -1.895
  223   2HE2  GLN  24          2HE2      GLN  24  14.237   0.148  -0.626
  224    H    PHE  25           H        PHE  25   8.332   2.512  -1.226
  225    HA   PHE  25           HA       PHE  25   9.777   3.646   1.064
  226   1HB   PHE  25          1HB       PHE  25  10.000   4.863  -0.952
  227   2HB   PHE  25          2HB       PHE  25   8.267   4.759  -1.307
  228    HD1  PHE  25           1HD      PHE  25   6.749   5.797   0.704
  229    HD2  PHE  25           2HD      PHE  25  10.779   6.925  -0.267
  230    HE1  PHE  25           1HE      PHE  25   6.393   8.000   1.785
  231    HE2  PHE  25           2HE      PHE  25  10.423   9.128   0.814
  232    HZ   PHE  25           HZ       PHE  25   8.230   9.666   1.840
  233    H    TRP  26           H        TRP  26   6.414   3.258  -0.124
  234    HA   TRP  26           HA       TRP  26   5.437   4.353   2.452
  235   1HB   TRP  26          1HB       TRP  26   3.213   4.219   1.253
  236   2HB   TRP  26          2HB       TRP  26   4.386   5.368   0.594
  237    HD1  TRP  26           HD       TRP  26   2.236   2.489  -0.338
  238    HE1  TRP  26           1HE      TRP  26   2.583   1.816  -2.770
  239    HE3  TRP  26           3HE      TRP  26   6.459   5.206  -1.333
  240    HZ2  TRP  26           2HZ      TRP  26   4.462   2.381  -4.898
  241    HZ3  TRP  26           3HZ      TRP  26   7.496   5.113  -3.570
  242    HH2  TRP  26           HH       TRP  26   6.514   3.709  -5.359
  243    H    VAL  27           H        VAL  27   6.703   1.970   2.825
  244    HA   VAL  27           HA       VAL  27   4.801  -0.232   2.589
  245    HB   VAL  27           HB       VAL  27   6.629  -1.388   3.985
  246   1HG1  VAL  27          1HG1      VAL  27   6.350  -0.909   1.284
  247   2HG1  VAL  27          2HG1      VAL  27   7.998  -0.312   1.589
  248   3HG1  VAL  27          3HG1      VAL  27   7.569  -1.990   2.000
  249   1HG2  VAL  27          1HG2      VAL  27   8.658  -0.270   4.381
  250   2HG2  VAL  27          2HG2      VAL  27   8.306   0.996   3.180
  251   3HG2  VAL  27          3HG2      VAL  27   7.451   0.988   4.741
  252    H    LYS  28           H        LYS  28   6.220  -0.831   5.453
  253    HA   LYS  28           HA       LYS  28   3.790  -0.089   6.929
  254   1HB   LYS  28          1HB       LYS  28   6.077  -1.983   7.266
  255   2HB   LYS  28          2HB       LYS  28   5.309  -1.366   8.749
  256   1HG   LYS  28          1HG       LYS  28   3.077  -2.030   7.800
  257   2HG   LYS  28          2HG       LYS  28   3.928  -2.770   6.423
  258   1HD   LYS  28          1HD       LYS  28   5.305  -3.936   8.422
  259   2HD   LYS  28          2HD       LYS  28   3.771  -3.659   9.280
  260   1HE   LYS  28          1HE       LYS  28   3.059  -5.569   8.300
  261   2HE   LYS  28          2HE       LYS  28   2.935  -4.608   6.810
  262   1HZ   LYS  28          1HZ       LYS  28   4.981  -5.357   6.111
  263   2HZ   LYS  28          2HZ       LYS  28   5.426  -5.915   7.597
  264   3HZ   LYS  28          3HZ       LYS  28   4.268  -6.708   6.732
  265    H    VAL  29           H        VAL  29   5.247   2.163   6.128
  266    HA   VAL  29           HA       VAL  29   6.957   2.989   8.351
  267    HB   VAL  29           HB       VAL  29   6.845   5.204   7.028
  268   1HG1  VAL  29          1HG1      VAL  29   7.815   2.767   5.486
  269   2HG1  VAL  29          2HG1      VAL  29   8.497   4.411   5.472
  270   3HG1  VAL  29          3HG1      VAL  29   8.649   3.396   6.927
  271   1HG2  VAL  29          1HG2      VAL  29   5.619   5.325   5.110
  272   2HG2  VAL  29          2HG2      VAL  29   6.000   3.649   4.649
  273   3HG2  VAL  29          3HG2      VAL  29   4.698   3.976   5.817
  274    H    GLN  30           H        GLN  30   5.101   2.499   9.906
  275    HA   GLN  30           HA       GLN  30   3.887   5.019  10.644
  276   1HB   GLN  30          1HB       GLN  30   1.537   4.092  10.592
  277   2HB   GLN  30          2HB       GLN  30   2.240   4.414   8.989
  278   1HG   GLN  30          1HG       GLN  30   2.732   2.088   8.643
  279   2HG   GLN  30          2HG       GLN  30   2.368   1.694  10.337
  280   1HE2  GLN  30          1HE2      GLN  30   1.209   1.103   7.420
  281   2HE2  GLN  30          2HE2      GLN  30  -0.518   1.205   7.689
  282    H    ARG  31           H        ARG  31   5.701   3.744  12.085
  283    HA   ARG  31           HA       ARG  31   4.100   2.539  14.274
  284   1HB   ARG  31          1HB       ARG  31   5.920   0.880  14.634
  285   2HB   ARG  31          2HB       ARG  31   5.114   0.670  13.061
  286   1HG   ARG  31          1HG       ARG  31   7.042   1.050  11.952
  287   2HG   ARG  31          2HG       ARG  31   7.312   2.567  12.843
  288   1HD   ARG  31          1HD       ARG  31   7.896   0.795  14.801
  289   2HD   ARG  31          2HD       ARG  31   8.338  -0.186  13.388
  290    HE   ARG  31           HE       ARG  31   9.546   2.230  12.884
  291   1HH1  ARG  31          2HH2      ARG  31   9.520  -0.024  15.608
  292   2HH1  ARG  31          1HH2      ARG  31  11.143   0.373  16.129
  293   1HH2  ARG  31          2HH1      ARG  31  11.689   2.754  13.572
  294   2HH2  ARG  31          1HH1      ARG  31  12.379   1.957  14.967
  295    H    GLY  32           H        GLY  32   5.596   2.384  16.314
  296   1HA   GLY  32          1HA       GLY  32   7.742   4.331  16.459
  297   2HA   GLY  32          2HA       GLY  32   6.235   4.898  17.214
  Start of MODEL    6
    1    HA   PRO   1           HA       PRO   1  -7.975   9.584  -6.337
    2   1HB   PRO   1          1HB       PRO   1  -8.193   9.501  -3.623
    3   2HB   PRO   1          2HB       PRO   1  -6.598   9.474  -4.444
    4   1HG   PRO   1          1HG       PRO   1  -8.034  11.885  -3.297
    5   2HG   PRO   1          2HG       PRO   1  -6.348  11.365  -2.971
    6   1HD   PRO   1          1HD       PRO   1  -6.915  13.252  -4.855
    7   2HD   PRO   1          2HD       PRO   1  -5.655  12.017  -5.157
    8    HA   PRO   2           HA       PRO   2 -12.202  11.104  -6.316
    9   1HB   PRO   2          1HB       PRO   2 -13.329   8.898  -7.451
   10   2HB   PRO   2          2HB       PRO   2 -12.301  10.025  -8.394
   11   1HG   PRO   2          1HG       PRO   2 -11.447   7.441  -7.059
   12   2HG   PRO   2          2HG       PRO   2 -11.177   7.925  -8.765
   13   1HD   PRO   2          1HD       PRO   2  -9.265   8.303  -6.859
   14   2HD   PRO   2          2HD       PRO   2  -9.551   9.545  -8.115
   15    H    LEU   3           H        LEU   3 -11.459  10.693  -3.837
   16    HA   LEU   3           HA       LEU   3 -12.217   9.987  -1.795
   17   1HB   LEU   3          1HB       LEU   3 -14.417   8.682  -3.447
   18   2HB   LEU   3          2HB       LEU   3 -14.426   8.864  -1.676
   19    HG   LEU   3           HG       LEU   3 -15.701  10.662  -2.947
   20   1HD1  LEU   3          1HD1      LEU   3 -14.219  10.803  -0.653
   21   2HD1  LEU   3          2HD1      LEU   3 -13.473  12.108  -1.606
   22   3HD1  LEU   3          3HD1      LEU   3 -15.221  12.139  -1.268
   23   1HD2  LEU   3          1HD2      LEU   3 -13.910  10.729  -4.790
   24   2HD2  LEU   3          2HD2      LEU   3 -14.496  12.303  -4.201
   25   3HD2  LEU   3          3HD2      LEU   3 -12.924  11.676  -3.650
   26    H    SER   4           H        SER   4 -11.406   8.417  -0.510
   27    HA   SER   4           HA       SER   4 -11.512   5.625  -1.233
   28   1HB   SER   4          1HB       SER   4  -9.364   7.119  -2.313
   29   2HB   SER   4          2HB       SER   4  -8.690   6.208  -0.940
   30    HG   SER   4           HG       SER   4  -8.669   4.948  -2.814
   31    H    GLN   5           H        GLN   5 -12.224   5.054   0.764
   32    HA   GLN   5           HA       GLN   5 -10.504   4.713   2.908
   33   1HB   GLN   5          1HB       GLN   5 -11.423   6.577   4.442
   34   2HB   GLN   5          2HB       GLN   5 -10.192   7.034   3.241
   35   1HG   GLN   5          1HG       GLN   5 -11.871   7.912   1.746
   36   2HG   GLN   5          2HG       GLN   5 -13.184   7.246   2.740
   37   1HE2  GLN   5          1HE2      GLN   5 -13.609   8.180   4.842
   38   2HE2  GLN   5          2HE2      GLN   5 -13.114   9.821   5.198
   39    H    GLU   6           H        GLU   6 -13.731   5.348   1.665
   40    HA   GLU   6           HA       GLU   6 -14.804   3.500   3.746
   41   1HB   GLU   6          1HB       GLU   6 -16.025   5.985   2.500
   42   2HB   GLU   6          2HB       GLU   6 -16.988   4.763   3.363
   43   1HG   GLU   6          1HG       GLU   6 -14.581   5.531   4.849
   44   2HG   GLU   6          2HG       GLU   6 -15.634   6.923   4.516
   45    H    THR   7           H        THR   7 -13.806   2.180   1.722
   46    HA   THR   7           HA       THR   7 -15.612   0.568   0.629
   47    HB   THR   7           HB       THR   7 -15.849   3.243  -0.689
   48    HG1  THR   7           1HG      THR   7 -17.436   2.109   0.662
   49   1HG2  THR   7          1HG2      THR   7 -15.499   2.447  -2.770
   50   2HG2  THR   7          2HG2      THR   7 -15.216   0.807  -2.138
   51   3HG2  THR   7          3HG2      THR   7 -16.870   1.339  -2.526
   52    H    PHE   8           H        PHE   8 -14.159   2.406  -1.966
   53    HA   PHE   8           HA       PHE   8 -12.625   0.342  -2.985
   54   1HB   PHE   8          1HB       PHE   8 -11.132   2.573  -3.600
   55   2HB   PHE   8          2HB       PHE   8 -12.549   1.998  -4.496
   56    HD1  PHE   8           1HD      PHE   8 -12.538   3.564  -1.111
   57    HD2  PHE   8           2HD      PHE   8 -13.452   4.038  -5.281
   58    HE1  PHE   8           1HE      PHE   8 -13.718   5.687  -0.611
   59    HE2  PHE   8           2HE      PHE   8 -14.632   6.162  -4.782
   60    HZ   PHE   8           HZ       PHE   8 -14.765   6.986  -2.446
   61    H    SER   9           H        SER   9 -12.069   2.224  -0.119
   62    HA   SER   9           HA       SER   9  -9.205   1.778  -0.010
   63   1HB   SER   9          1HB       SER   9 -10.265   3.701   1.098
   64   2HB   SER   9          2HB       SER   9 -11.218   2.600   2.121
   65    HG   SER   9           HG       SER   9  -8.407   2.421   2.009
   66    H    ASP  10           H        ASP  10 -12.119   0.045   0.915
   67    HA   ASP  10           HA       ASP  10 -10.987  -1.660   2.890
   68   1HB   ASP  10          1HB       ASP  10 -13.462  -1.241   2.175
   69   2HB   ASP  10          2HB       ASP  10 -13.156  -2.510   0.969
   70    H    LEU  11           H        LEU  11 -10.752  -1.559  -0.605
   71    HA   LEU  11           HA       LEU  11  -9.778  -4.321  -0.782
   72   1HB   LEU  11          1HB       LEU  11  -9.256  -3.039  -3.198
   73   2HB   LEU  11          2HB       LEU  11 -10.711  -3.988  -2.809
   74    HG   LEU  11           HG       LEU  11 -11.670  -1.964  -3.452
   75   1HD1  LEU  11          1HD1      LEU  11 -12.668  -1.146  -1.532
   76   2HD1  LEU  11          2HD1      LEU  11 -11.926  -2.619  -0.864
   77   3HD1  LEU  11          3HD1      LEU  11 -11.127  -1.043  -0.647
   78   1HD2  LEU  11          1HD2      LEU  11  -9.422  -0.858  -3.750
   79   2HD2  LEU  11          2HD2      LEU  11 -10.671   0.223  -3.087
   80   3HD2  LEU  11          3HD2      LEU  11  -9.436  -0.475  -2.011
   81    H    TRP  12           H        TRP  12  -8.198  -1.929  -2.743
   82    HA   TRP  12           HA       TRP  12  -5.783  -2.132  -2.957
   83   1HB   TRP  12          1HB       TRP  12  -6.029  -0.153  -0.726
   84   2HB   TRP  12          2HB       TRP  12  -5.154  -0.027  -2.259
   85    HD1  TRP  12           HD       TRP  12  -7.629   1.801  -0.735
   86    HE1  TRP  12           1HE      TRP  12  -9.426   2.734  -2.280
   87    HE3  TRP  12           3HE      TRP  12  -6.878  -1.246  -4.778
   88    HZ2  TRP  12           2HZ      TRP  12 -10.425   2.227  -4.948
   89    HZ3  TRP  12           3HZ      TRP  12  -8.269  -0.991  -6.800
   90    HH2  TRP  12           HH       TRP  12 -10.043   0.735  -6.901
   91    H    LYS  13           H        LYS  13  -7.065  -2.460   0.353
   92    HA   LYS  13           HA       LYS  13  -4.708  -2.902   1.767
   93   1HB   LYS  13          1HB       LYS  13  -6.758  -2.772   2.963
   94   2HB   LYS  13          2HB       LYS  13  -7.489  -4.086   2.010
   95   1HG   LYS  13          1HG       LYS  13  -6.327  -5.742   3.145
   96   2HG   LYS  13          2HG       LYS  13  -4.962  -4.667   3.532
   97   1HD   LYS  13          1HD       LYS  13  -6.090  -4.982   5.603
   98   2HD   LYS  13          2HD       LYS  13  -6.630  -3.385   5.032
   99   1HE   LYS  13          1HE       LYS  13  -8.402  -5.226   3.847
  100   2HE   LYS  13          2HE       LYS  13  -8.185  -5.805   5.513
  101   1HZ   LYS  13          1HZ       LYS  13  -8.596  -3.430   6.144
  102   2HZ   LYS  13          2HZ       LYS  13  -9.153  -3.201   4.609
  103   3HZ   LYS  13          3HZ       LYS  13  -9.894  -4.289   5.602
  104    H    LEU  14           H        LEU  14  -5.868  -4.636  -0.912
  105    HA   LEU  14           HA       LEU  14  -4.743  -7.219  -0.111
  106   1HB   LEU  14          1HB       LEU  14  -5.302  -7.711  -2.590
  107   2HB   LEU  14          2HB       LEU  14  -6.658  -7.393  -1.483
  108    HG   LEU  14           HG       LEU  14  -6.574  -6.149  -3.796
  109   1HD1  LEU  14          1HD1      LEU  14  -7.254  -3.955  -2.367
  110   2HD1  LEU  14          2HD1      LEU  14  -8.302  -5.390  -2.480
  111   3HD1  LEU  14          3HD1      LEU  14  -7.257  -5.160  -1.057
  112   1HD2  LEU  14          1HD2      LEU  14  -5.126  -4.359  -4.026
  113   2HD2  LEU  14          2HD2      LEU  14  -5.005  -4.095  -2.270
  114   3HD2  LEU  14          3HD2      LEU  14  -4.104  -5.427  -3.034
  115    H    LEU  15           H        LEU  15  -3.917  -4.416  -2.155
  116    HA   LEU  15           HA       LEU  15  -1.731  -5.495  -3.541
  117   1HB   LEU  15          1HB       LEU  15  -2.680  -2.797  -2.723
  118   2HB   LEU  15          2HB       LEU  15  -0.951  -2.922  -3.127
  119    HG   LEU  15           HG       LEU  15  -2.570  -2.409  -5.072
  120   1HD1  LEU  15          1HD1      LEU  15  -0.832  -3.133  -6.312
  121   2HD1  LEU  15          2HD1      LEU  15  -0.212  -3.984  -4.877
  122   3HD1  LEU  15          3HD1      LEU  15  -1.285  -4.829  -6.018
  123   1HD2  LEU  15          1HD2      LEU  15  -3.365  -5.206  -4.277
  124   2HD2  LEU  15          2HD2      LEU  15  -4.384  -3.852  -4.820
  125   3HD2  LEU  15          3HD2      LEU  15  -3.399  -4.753  -5.998
  126    H    LYS  16           H        LYS  16  -2.079  -4.537  -0.170
  127    HA   LYS  16           HA       LYS  16   0.554  -4.084   0.591
  128   1HB   LYS  16          1HB       LYS  16  -0.833  -3.809   2.381
  129   2HB   LYS  16          2HB       LYS  16  -1.913  -5.133   1.881
  130   1HG   LYS  16          1HG       LYS  16   0.886  -5.774   2.806
  131   2HG   LYS  16          2HG       LYS  16  -0.373  -5.417   4.013
  132   1HD   LYS  16          1HD       LYS  16  -0.298  -7.645   1.956
  133   2HD   LYS  16          2HD       LYS  16  -0.503  -7.767   3.720
  134   1HE   LYS  16          1HE       LYS  16  -2.638  -6.232   3.183
  135   2HE   LYS  16          2HE       LYS  16  -2.495  -7.032   1.603
  136   1HZ   LYS  16          1HZ       LYS  16  -3.880  -8.121   3.390
  137   2HZ   LYS  16          2HZ       LYS  16  -2.825  -9.071   2.550
  138   3HZ   LYS  16          3HZ       LYS  16  -2.451  -8.574   4.078
  139    H    LYS  17           H        LYS  17  -1.151  -7.270   0.564
  140    HA   LYS  17           HA       LYS  17   0.932  -8.911   1.309
  141   1HB   LYS  17          1HB       LYS  17  -1.111  -9.986   0.984
  142   2HB   LYS  17          2HB       LYS  17  -1.375  -9.229  -0.605
  143   1HG   LYS  17          1HG       LYS  17  -0.621 -11.185  -1.474
  144   2HG   LYS  17          2HG       LYS  17   0.995 -10.631  -0.974
  145   1HD   LYS  17          1HD       LYS  17  -0.649 -11.893   1.163
  146   2HD   LYS  17          2HD       LYS  17  -0.123 -12.980  -0.145
  147   1HE   LYS  17          1HE       LYS  17   2.168 -11.531   0.330
  148   2HE   LYS  17          2HE       LYS  17   1.465 -11.627   1.959
  149   1HZ   LYS  17          1HZ       LYS  17   1.361 -13.980   1.732
  150   2HZ   LYS  17          2HZ       LYS  17   1.939 -13.919   0.189
  151   3HZ   LYS  17          3HZ       LYS  17   2.905 -13.475   1.450
  152    H    TRP  18           H        TRP  18   0.661  -6.983  -1.578
  153    HA   TRP  18           HA       TRP  18   3.182  -8.227  -2.562
  154   1HB   TRP  18          1HB       TRP  18   2.209  -7.433  -4.862
  155   2HB   TRP  18          2HB       TRP  18   1.729  -8.989  -4.172
  156    HD1  TRP  18           HD       TRP  18   0.361  -5.779  -5.432
  157    HE1  TRP  18           1HE      TRP  18  -2.168  -5.668  -5.151
  158    HE3  TRP  18           3HE      TRP  18  -0.287  -9.817  -2.354
  159    HZ2  TRP  18           2HZ      TRP  18  -4.231  -7.146  -3.761
  160    HZ3  TRP  18           3HZ      TRP  18  -2.545 -10.433  -1.574
  161    HH2  TRP  18           HH       TRP  18  -4.523  -9.112  -2.265
  162    H    LYS  19           H        LYS  19   1.537  -5.494  -1.417
  163    HA   LYS  19           HA       LYS  19   3.517  -3.687  -2.724
  164   1HB   LYS  19          1HB       LYS  19   0.934  -3.405  -3.069
  165   2HB   LYS  19          2HB       LYS  19   0.965  -2.753  -1.413
  166   1HG   LYS  19          1HG       LYS  19   3.064  -1.398  -2.435
  167   2HG   LYS  19          2HG       LYS  19   2.133  -1.637  -3.933
  168   1HD   LYS  19          1HD       LYS  19   0.152  -0.900  -2.173
  169   2HD   LYS  19          2HD       LYS  19   1.531   0.049  -1.568
  170   1HE   LYS  19          1HE       LYS  19   1.900   1.020  -3.761
  171   2HE   LYS  19          2HE       LYS  19   0.678  -0.046  -4.488
  172   1HZ   LYS  19          1HZ       LYS  19  -0.773   1.093  -2.670
  173   2HZ   LYS  19          2HZ       LYS  19   0.330   2.306  -2.854
  174   3HZ   LYS  19          3HZ       LYS  19  -0.540   1.779  -4.152
  175    H    MET  20           H        MET  20   3.059  -5.422   0.012
  176    HA   MET  20           HA       MET  20   3.137  -3.787   2.213
  177   1HB   MET  20          1HB       MET  20   3.341  -6.332   2.075
  178   2HB   MET  20          2HB       MET  20   5.083  -6.081   1.807
  179   1HG   MET  20          1HG       MET  20   4.442  -4.418   3.972
  180   2HG   MET  20          2HG       MET  20   3.527  -5.905   4.272
  181   1HE   MET  20          1HE       MET  20   7.077  -6.744   2.349
  182   2HE   MET  20          2HE       MET  20   6.645  -5.022   2.482
  183   3HE   MET  20          3HE       MET  20   8.006  -5.673   3.426
  184    H    ARG  21           H        ARG  21   4.516  -2.354   3.159
  185    HA   ARG  21           HA       ARG  21   6.511  -1.226   3.554
  186   1HB   ARG  21          1HB       ARG  21   7.574  -3.410   2.535
  187   2HB   ARG  21          2HB       ARG  21   7.772  -2.401   1.081
  188   1HG   ARG  21          1HG       ARG  21   9.510  -1.303   2.010
  189   2HG   ARG  21          2HG       ARG  21   8.554  -0.924   3.463
  190   1HD   ARG  21          1HD       ARG  21   9.946  -3.579   2.927
  191   2HD   ARG  21          2HD       ARG  21  10.581  -2.291   3.973
  192    HE   ARG  21           HE       ARG  21   8.414  -4.159   4.577
  193   1HH1  ARG  21          2HH2      ARG  21   9.954  -1.063   5.314
  194   2HH1  ARG  21          1HH2      ARG  21   9.317  -0.979   6.942
  195   1HH2  ARG  21          2HH1      ARG  21   7.573  -4.047   6.727
  196   2HH2  ARG  21          1HH1      ARG  21   7.960  -2.680   7.747
  197    H    ARG  22           H        ARG  22   4.196  -0.770   1.535
  198    HA   ARG  22           HA       ARG  22   5.450   1.039  -0.401
  199   1HB   ARG  22          1HB       ARG  22   3.200   1.308  -1.257
  200   2HB   ARG  22          2HB       ARG  22   3.472  -0.422  -0.937
  201   1HG   ARG  22          1HG       ARG  22   2.491   0.841   1.467
  202   2HG   ARG  22          2HG       ARG  22   1.411   1.248   0.112
  203   1HD   ARG  22          1HD       ARG  22   0.486  -0.785   0.573
  204   2HD   ARG  22          2HD       ARG  22   1.853  -1.397  -0.384
  205    HE   ARG  22           HE       ARG  22   2.958  -2.051   1.615
  206   1HH1  ARG  22          2HH2      ARG  22  -0.196  -0.551   2.165
  207   2HH1  ARG  22          1HH2      ARG  22  -0.337  -1.130   3.810
  208   1HH2  ARG  22          2HH1      ARG  22   2.772  -2.815   3.787
  209   2HH2  ARG  22          1HH1      ARG  22   1.355  -2.421   4.735
  210    H    ASN  23           H        ASN  23   6.398   2.184   1.646
  211    HA   ASN  23           HA       ASN  23   4.438   4.049   2.838
  212   1HB   ASN  23          1HB       ASN  23   5.922   3.030   4.415
  213   2HB   ASN  23          2HB       ASN  23   7.342   3.377   3.405
  214   1HD2  ASN  23          1HD2      ASN  23   4.639   5.007   5.143
  215   2HD2  ASN  23          2HD2      ASN  23   5.558   6.425   5.599
  216    H    GLN  24           H        GLN  24   7.759   5.030   2.459
  217    HA   GLN  24           HA       GLN  24   7.354   6.528   0.012
  218   1HB   GLN  24          1HB       GLN  24   6.295   7.698   2.294
  219   2HB   GLN  24          2HB       GLN  24   7.915   8.427   2.185
  220   1HG   GLN  24          1HG       GLN  24   7.032   8.438  -0.454
  221   2HG   GLN  24          2HG       GLN  24   5.558   8.809   0.467
  222   1HE2  GLN  24          1HE2      GLN  24   6.905  10.643  -1.295
  223   2HE2  GLN  24          2HE2      GLN  24   7.495  11.975  -0.325
  224    H    PHE  25           H        PHE  25   9.173   6.433   3.125
  225    HA   PHE  25           HA       PHE  25  11.664   6.953   1.620
  226   1HB   PHE  25          1HB       PHE  25  11.446   8.309   3.547
  227   2HB   PHE  25          2HB       PHE  25  10.885   6.954   4.540
  228    HD1  PHE  25           1HD      PHE  25  12.669   4.898   4.569
  229    HD2  PHE  25           2HD      PHE  25  13.598   9.044   3.938
  230    HE1  PHE  25           1HE      PHE  25  14.994   4.492   5.331
  231    HE2  PHE  25           2HE      PHE  25  15.923   8.638   4.700
  232    HZ   PHE  25           HZ       PHE  25  16.621   6.363   5.397
  233    H    TRP  26           H        TRP  26  10.033   4.494   3.631
  234    HA   TRP  26           HA       TRP  26  12.323   2.663   3.184
  235   1HB   TRP  26          1HB       TRP  26  10.974   1.228   4.810
  236   2HB   TRP  26          2HB       TRP  26  11.719   2.700   5.449
  237    HD1  TRP  26           HD       TRP  26   8.425   0.982   4.999
  238    HE1  TRP  26           1HE      TRP  26   6.534   2.351   6.017
  239    HE3  TRP  26           3HE      TRP  26  10.964   5.339   5.876
  240    HZ2  TRP  26           2HZ      TRP  26   6.157   5.014   7.084
  241    HZ3  TRP  26           3HZ      TRP  26   9.807   7.267   6.892
  242    HH2  TRP  26           HH       TRP  26   7.410   7.122   7.501
  243    H    VAL  27           H        VAL  27  10.812   3.333   0.902
  244    HA   VAL  27           HA       VAL  27   8.991   1.032   0.506
  245    HB   VAL  27           HB       VAL  27   8.538   2.251  -1.684
  246   1HG1  VAL  27          1HG1      VAL  27   7.526   4.307  -0.264
  247   2HG1  VAL  27          2HG1      VAL  27   6.847   2.665  -0.171
  248   3HG1  VAL  27          3HG1      VAL  27   7.969   3.237   1.087
  249   1HG2  VAL  27          1HG2      VAL  27  10.710   3.510  -1.672
  250   2HG2  VAL  27          2HG2      VAL  27   9.291   4.569  -1.852
  251   3HG2  VAL  27          3HG2      VAL  27  10.117   4.448  -0.280
  252    H    LYS  28           H        LYS  28  10.632  -0.611   0.476
  253    HA   LYS  28           HA       LYS  28  11.709  -2.118  -0.961
  254   1HB   LYS  28          1HB       LYS  28  12.013  -1.656  -3.177
  255   2HB   LYS  28          2HB       LYS  28  10.904  -0.312  -2.816
  256   1HG   LYS  28          1HG       LYS  28  13.242   0.840  -2.082
  257   2HG   LYS  28          2HG       LYS  28  13.849  -0.279  -3.326
  258   1HD   LYS  28          1HD       LYS  28  11.391   1.354  -3.923
  259   2HD   LYS  28          2HD       LYS  28  12.982   2.148  -3.989
  260   1HE   LYS  28          1HE       LYS  28  13.580  -0.094  -5.358
  261   2HE   LYS  28          2HE       LYS  28  11.842  -0.014  -5.718
  262   1HZ   LYS  28          1HZ       LYS  28  12.511   1.349  -7.299
  263   2HZ   LYS  28          2HZ       LYS  28  12.617   2.488  -6.111
  264   3HZ   LYS  28          3HZ       LYS  28  13.967   1.676  -6.597
  265    H    VAL  29           H        VAL  29  12.681  -0.571   1.304
  266    HA   VAL  29           HA       VAL  29  15.515  -0.098   0.557
  267    HB   VAL  29           HB       VAL  29  13.969   0.571   3.093
  268   1HG1  VAL  29          1HG1      VAL  29  16.071   0.706   3.945
  269   2HG1  VAL  29          2HG1      VAL  29  16.822   0.610   2.334
  270   3HG1  VAL  29          3HG1      VAL  29  16.226   2.172   2.947
  271   1HG2  VAL  29          1HG2      VAL  29  14.343   2.939   2.184
  272   2HG2  VAL  29          2HG2      VAL  29  14.775   2.172   0.638
  273   3HG2  VAL  29          3HG2      VAL  29  13.145   1.951   1.316
  274    H    GLN  30           H        GLN  30  14.218  -2.785   0.762
  275    HA   GLN  30           HA       GLN  30  16.173  -3.926   2.651
  276   1HB   GLN  30          1HB       GLN  30  13.973  -3.582   3.869
  277   2HB   GLN  30          2HB       GLN  30  13.243  -4.727   2.718
  278   1HG   GLN  30          1HG       GLN  30  15.780  -5.655   3.931
  279   2HG   GLN  30          2HG       GLN  30  14.451  -5.437   5.090
  280   1HE2  GLN  30          1HE2      GLN  30  15.926  -7.731   3.306
  281   2HE2  GLN  30          2HE2      GLN  30  14.575  -8.781   2.934
  282    H    ARG  31           H        ARG  31  13.535  -4.532   0.282
  283    HA   ARG  31           HA       ARG  31  13.318  -6.138  -1.342
  284   1HB   ARG  31          1HB       ARG  31  16.333  -5.724  -1.416
  285   2HB   ARG  31          2HB       ARG  31  15.381  -6.539  -2.681
  286   1HG   ARG  31          1HG       ARG  31  14.392  -4.575  -3.397
  287   2HG   ARG  31          2HG       ARG  31  14.477  -3.820  -1.787
  288   1HD   ARG  31          1HD       ARG  31  17.084  -4.452  -3.091
  289   2HD   ARG  31          2HD       ARG  31  16.129  -3.154  -3.839
  290    HE   ARG  31           HE       ARG  31  16.162  -2.699  -1.050
  291   1HH1  ARG  31          2HH2      ARG  31  18.380  -2.798  -3.802
  292   2HH1  ARG  31          1HH2      ARG  31  19.490  -1.629  -3.123
  293   1HH2  ARG  31          2HH1      ARG  31  17.629  -1.155  -0.154
  294   2HH2  ARG  31          1HH1      ARG  31  19.062  -0.692  -1.044
  295    H    GLY  32           H        GLY  32  12.568  -7.975  -0.347
  296   1HA   GLY  32          1HA       GLY  32  14.654  -9.856   0.668
  297   2HA   GLY  32          2HA       GLY  32  13.001  -9.752   1.314
  Start of MODEL    7
    1    HA   PRO   1           HA       PRO   1 -12.935  12.060   3.977
    2   1HB   PRO   1          1HB       PRO   1 -12.344  10.610   1.747
    3   2HB   PRO   1          2HB       PRO   1 -13.886  11.513   1.907
    4   1HG   PRO   1          1HG       PRO   1 -11.349  12.439   0.530
    5   2HG   PRO   1          2HG       PRO   1 -13.010  12.419  -0.148
    6   1HD   PRO   1          1HD       PRO   1 -11.960  14.669   0.976
    7   2HD   PRO   1          2HD       PRO   1 -13.674  14.232   1.252
    8    HA   PRO   2           HA       PRO   2  -8.716  11.260   4.987
    9   1HB   PRO   2          1HB       PRO   2  -8.886   8.698   5.899
   10   2HB   PRO   2          2HB       PRO   2  -9.684  10.060   6.751
   11   1HG   PRO   2          1HG       PRO   2 -10.932   8.166   4.739
   12   2HG   PRO   2          2HG       PRO   2 -11.543   8.571   6.376
   13   1HD   PRO   2          1HD       PRO   2 -12.471   9.852   4.156
   14   2HD   PRO   2          2HD       PRO   2 -12.177  10.759   5.670
   15    H    LEU   3           H        LEU   3  -7.385   8.801   4.756
   16    HA   LEU   3           HA       LEU   3  -7.579   8.142   1.864
   17   1HB   LEU   3          1HB       LEU   3  -5.017   8.136   1.901
   18   2HB   LEU   3          2HB       LEU   3  -5.805   9.732   1.925
   19    HG   LEU   3           HG       LEU   3  -5.649   9.043   4.625
   20   1HD1  LEU   3          1HD1      LEU   3  -3.321   8.361   4.986
   21   2HD1  LEU   3          2HD1      LEU   3  -4.153   7.146   3.987
   22   3HD1  LEU   3          3HD1      LEU   3  -3.040   8.310   3.229
   23   1HD2  LEU   3          1HD2      LEU   3  -3.441  10.612   4.257
   24   2HD2  LEU   3          2HD2      LEU   3  -4.291  10.878   2.716
   25   3HD2  LEU   3          3HD2      LEU   3  -5.109  11.234   4.256
   26    H    SER   4           H        SER   4  -8.228   6.054   1.967
   27    HA   SER   4           HA       SER   4  -8.056   3.797   2.328
   28   1HB   SER   4          1HB       SER   4  -5.868   3.333   2.021
   29   2HB   SER   4          2HB       SER   4  -5.352   4.808   2.874
   30    HG   SER   4           HG       SER   4  -5.650   3.738   4.821
   31    H    GLN   5           H        GLN   5  -9.699   3.343   3.706
   32    HA   GLN   5           HA       GLN   5  -9.054   2.944   6.505
   33   1HB   GLN   5          1HB       GLN   5 -10.258   5.444   5.653
   34   2HB   GLN   5          2HB       GLN   5 -11.383   4.531   6.688
   35   1HG   GLN   5          1HG       GLN   5  -8.586   4.482   7.631
   36   2HG   GLN   5          2HG       GLN   5  -9.299   6.110   7.594
   37   1HE2  GLN   5          1HE2      GLN   5  -9.519   2.850   8.968
   38   2HE2  GLN   5          2HE2      GLN   5 -10.609   3.259  10.276
   39    H    GLU   6           H        GLU   6 -12.272   3.811   5.286
   40    HA   GLU   6           HA       GLU   6 -12.974   0.913   5.373
   41   1HB   GLU   6          1HB       GLU   6 -15.187   1.605   6.162
   42   2HB   GLU   6          2HB       GLU   6 -13.926   2.240   7.247
   43   1HG   GLU   6          1HG       GLU   6 -14.162   4.431   6.452
   44   2HG   GLU   6          2HG       GLU   6 -14.887   3.903   4.918
   45    H    THR   7           H        THR   7 -11.955   2.031   3.022
   46    HA   THR   7           HA       THR   7 -14.077   1.458   1.198
   47    HB   THR   7           HB       THR   7 -13.608   4.297   1.954
   48    HG1  THR   7           1HG      THR   7 -15.736   4.355   1.520
   49   1HG2  THR   7          1HG2      THR   7 -14.512   4.452  -0.699
   50   2HG2  THR   7          2HG2      THR   7 -12.908   4.938  -0.099
   51   3HG2  THR   7          3HG2      THR   7 -13.152   3.304  -0.763
   52    H    PHE   8           H        PHE   8 -11.777   4.045   0.509
   53    HA   PHE   8           HA       PHE   8 -10.615   2.792  -1.691
   54   1HB   PHE   8          1HB       PHE   8  -8.586   4.368  -0.781
   55   2HB   PHE   8          2HB       PHE   8  -9.984   4.956  -1.698
   56    HD1  PHE   8           1HD      PHE   8 -10.009   3.798   1.843
   57    HD2  PHE   8           2HD      PHE   8 -10.167   7.156  -0.831
   58    HE1  PHE   8           1HE      PHE   8 -10.632   5.275   3.735
   59    HE2  PHE   8           2HE      PHE   8 -10.790   8.633   1.061
   60    HZ   PHE   8           HZ       PHE   8 -11.022   7.693   3.344
   61    H    SER   9           H        SER   9 -10.205   2.104   1.674
   62    HA   SER   9           HA       SER   9  -7.553   0.941   1.424
   63   1HB   SER   9          1HB       SER   9  -9.542   1.467   3.526
   64   2HB   SER   9          2HB       SER   9  -8.710  -0.095   3.721
   65    HG   SER   9           HG       SER   9  -6.732   1.160   3.326
   66    H    ASP  10           H        ASP  10 -10.869  -0.065   0.929
   67    HA   ASP  10           HA       ASP  10 -10.506  -2.874   1.280
   68   1HB   ASP  10          1HB       ASP  10 -12.665  -1.418   1.050
   69   2HB   ASP  10          2HB       ASP  10 -12.431  -1.649  -0.696
   70    H    LEU  11           H        LEU  11  -9.606  -0.619  -1.240
   71    HA   LEU  11           HA       LEU  11  -9.242  -2.747  -3.232
   72   1HB   LEU  11          1HB       LEU  11  -8.045  -0.429  -4.194
   73   2HB   LEU  11          2HB       LEU  11  -9.720  -0.945  -4.504
   74    HG   LEU  11           HG       LEU  11 -10.055   1.196  -3.629
   75   1HD1  LEU  11          1HD1      LEU  11 -10.919  -0.880  -2.138
   76   2HD1  LEU  11          2HD1      LEU  11  -9.887  -0.083  -0.926
   77   3HD1  LEU  11          3HD1      LEU  11 -11.227   0.813  -1.681
   78   1HD2  LEU  11          1HD2      LEU  11  -8.693   2.204  -1.880
   79   2HD2  LEU  11          2HD2      LEU  11  -7.866   0.657  -1.579
   80   3HD2  LEU  11          3HD2      LEU  11  -7.611   1.518  -3.116
   81    H    TRP  12           H        TRP  12  -6.871  -0.208  -3.103
   82    HA   TRP  12           HA       TRP  12  -4.554  -0.880  -3.428
   83   1HB   TRP  12          1HB       TRP  12  -4.773  -0.836  -0.442
   84   2HB   TRP  12          2HB       TRP  12  -3.626  -0.007  -1.504
   85    HD1  TRP  12           HD       TRP  12  -5.912   1.001   0.861
   86    HE1  TRP  12           1HE      TRP  12  -7.149   3.167   0.344
   87    HE3  TRP  12           3HE      TRP  12  -5.051   1.240  -4.179
   88    HZ2  TRP  12           2HZ      TRP  12  -7.704   4.812  -1.971
   89    HZ3  TRP  12           3HZ      TRP  12  -5.948   3.118  -5.504
   90    HH2  TRP  12           HH       TRP  12  -7.274   4.908  -4.419
   91    H    LYS  13           H        LYS  13  -6.440  -2.894  -1.169
   92    HA   LYS  13           HA       LYS  13  -4.518  -4.769  -0.436
   93   1HB   LYS  13          1HB       LYS  13  -6.968  -4.571   0.282
   94   2HB   LYS  13          2HB       LYS  13  -7.369  -5.472  -1.200
   95   1HG   LYS  13          1HG       LYS  13  -5.338  -7.011  -0.197
   96   2HG   LYS  13          2HG       LYS  13  -6.072  -6.406   1.307
   97   1HD   LYS  13          1HD       LYS  13  -8.255  -7.077  -0.339
   98   2HD   LYS  13          2HD       LYS  13  -7.082  -8.394  -0.579
   99   1HE   LYS  13          1HE       LYS  13  -8.025  -9.216   1.332
  100   2HE   LYS  13          2HE       LYS  13  -6.901  -8.084   2.116
  101   1HZ   LYS  13          1HZ       LYS  13  -9.759  -7.896   1.770
  102   2HZ   LYS  13          2HZ       LYS  13  -8.814  -7.446   3.044
  103   3HZ   LYS  13          3HZ       LYS  13  -8.901  -6.490   1.703
  104    H    LEU  14           H        LEU  14  -5.495  -3.952  -3.575
  105    HA   LEU  14           HA       LEU  14  -5.095  -6.625  -4.713
  106   1HB   LEU  14          1HB       LEU  14  -5.328  -5.244  -6.883
  107   2HB   LEU  14          2HB       LEU  14  -6.752  -5.349  -5.820
  108    HG   LEU  14           HG       LEU  14  -6.256  -3.013  -6.642
  109   1HD1  LEU  14          1HD1      LEU  14  -6.951  -3.936  -4.065
  110   2HD1  LEU  14          2HD1      LEU  14  -5.783  -2.620  -3.795
  111   3HD1  LEU  14          3HD1      LEU  14  -7.259  -2.319  -4.743
  112   1HD2  LEU  14          1HD2      LEU  14  -4.182  -2.141  -6.463
  113   2HD2  LEU  14          2HD2      LEU  14  -4.117  -2.525  -4.726
  114   3HD2  LEU  14          3HD2      LEU  14  -3.625  -3.744  -5.926
  115    H    LEU  15           H        LEU  15  -3.414  -3.472  -4.497
  116    HA   LEU  15           HA       LEU  15  -1.282  -3.976  -6.235
  117   1HB   LEU  15          1HB       LEU  15  -1.794  -2.249  -3.867
  118   2HB   LEU  15          2HB       LEU  15  -0.083  -2.530  -4.270
  119    HG   LEU  15           HG       LEU  15  -1.273  -0.528  -5.414
  120   1HD1  LEU  15          1HD1      LEU  15   0.494  -0.685  -6.805
  121   2HD1  LEU  15          2HD1      LEU  15   0.725  -2.364  -6.261
  122   3HD1  LEU  15          3HD1      LEU  15  -0.280  -2.022  -7.690
  123   1HD2  LEU  15          1HD2      LEU  15  -3.320  -1.335  -6.183
  124   2HD2  LEU  15          2HD2      LEU  15  -2.326  -1.496  -7.651
  125   3HD2  LEU  15          3HD2      LEU  15  -2.644  -2.920  -6.632
  126    H    LYS  16           H        LYS  16  -1.930  -5.202  -2.980
  127    HA   LYS  16           HA       LYS  16   0.564  -6.038  -2.138
  128   1HB   LYS  16          1HB       LYS  16  -1.024  -6.579  -0.587
  129   2HB   LYS  16          2HB       LYS  16  -2.235  -7.006  -1.820
  130   1HG   LYS  16          1HG       LYS  16   0.219  -8.731  -1.485
  131   2HG   LYS  16          2HG       LYS  16  -1.136  -8.903  -0.344
  132   1HD   LYS  16          1HD       LYS  16  -1.136  -9.311  -3.351
  133   2HD   LYS  16          2HD       LYS  16  -1.614 -10.458  -2.077
  134   1HE   LYS  16          1HE       LYS  16  -3.336  -8.460  -1.514
  135   2HE   LYS  16          2HE       LYS  16  -3.124  -8.159  -3.253
  136   1HZ   LYS  16          1HZ       LYS  16  -4.261 -10.463  -1.911
  137   2HZ   LYS  16          2HZ       LYS  16  -4.794  -9.649  -3.243
  138   3HZ   LYS  16          3HZ       LYS  16  -3.517 -10.686  -3.366
  139    H    LYS  17           H        LYS  17  -1.709  -7.959  -4.188
  140    HA   LYS  17           HA       LYS  17  -0.156 -10.172  -4.675
  141   1HB   LYS  17          1HB       LYS  17  -2.281 -10.214  -5.635
  142   2HB   LYS  17          2HB       LYS  17  -2.095  -8.602  -6.368
  143   1HG   LYS  17          1HG       LYS  17  -1.602  -9.718  -8.282
  144   2HG   LYS  17          2HG       LYS  17  -0.025 -10.047  -7.526
  145   1HD   LYS  17          1HD       LYS  17  -0.527 -12.246  -7.653
  146   2HD   LYS  17          2HD       LYS  17  -1.777 -11.957  -6.420
  147   1HE   LYS  17          1HE       LYS  17  -3.467 -11.613  -8.069
  148   2HE   LYS  17          2HE       LYS  17  -2.270 -11.466  -9.374
  149   1HZ   LYS  17          1HZ       LYS  17  -3.274 -13.589  -9.438
  150   2HZ   LYS  17          2HZ       LYS  17  -1.705 -13.780  -8.966
  151   3HZ   LYS  17          3HZ       LYS  17  -2.920 -13.891  -7.856
  152    H    TRP  18           H        TRP  18   0.461  -6.883  -5.662
  153    HA   TRP  18           HA       TRP  18   2.824  -7.862  -7.191
  154   1HB   TRP  18          1HB       TRP  18   2.452  -5.568  -8.417
  155   2HB   TRP  18          2HB       TRP  18   1.572  -7.018  -8.919
  156    HD1  TRP  18           HD       TRP  18   1.078  -3.518  -7.815
  157    HE1  TRP  18           1HE      TRP  18  -1.393  -2.961  -7.541
  158    HE3  TRP  18           3HE      TRP  18  -0.848  -8.254  -8.059
  159    HZ2  TRP  18           2HZ      TRP  18  -3.907  -4.390  -7.438
  160    HZ3  TRP  18           3HZ      TRP  18  -3.281  -8.616  -7.870
  161    HH2  TRP  18           HH       TRP  18  -4.821  -6.700  -7.559
  162    H    LYS  19           H        LYS  19   1.564  -6.081  -4.578
  163    HA   LYS  19           HA       LYS  19   4.125  -4.571  -4.340
  164   1HB   LYS  19          1HB       LYS  19   1.276  -3.873  -3.616
  165   2HB   LYS  19          2HB       LYS  19   2.641  -3.114  -2.762
  166   1HG   LYS  19          1HG       LYS  19   2.425  -3.190  -5.795
  167   2HG   LYS  19          2HG       LYS  19   1.779  -1.853  -4.814
  168   1HD   LYS  19          1HD       LYS  19   4.566  -2.660  -4.169
  169   2HD   LYS  19          2HD       LYS  19   4.340  -1.946  -5.784
  170   1HE   LYS  19          1HE       LYS  19   3.872   0.113  -4.943
  171   2HE   LYS  19          2HE       LYS  19   2.884  -0.548  -3.622
  172   1HZ   LYS  19          1HZ       LYS  19   5.786  -0.223  -3.728
  173   2HZ   LYS  19          2HZ       LYS  19   4.720   0.380  -2.623
  174   3HZ   LYS  19          3HZ       LYS  19   5.066  -1.232  -2.639
  175    H    MET  20           H        MET  20   3.012  -7.378  -3.456
  176    HA   MET  20           HA       MET  20   2.852  -7.312  -0.608
  177   1HB   MET  20          1HB       MET  20   3.310  -9.766  -0.821
  178   2HB   MET  20          2HB       MET  20   2.006  -9.196  -1.891
  179   1HG   MET  20          1HG       MET  20   3.131  -9.890  -3.695
  180   2HG   MET  20          2HG       MET  20   4.515  -8.879  -3.248
  181   1HE   MET  20          1HE       MET  20   6.322 -11.371  -0.706
  182   2HE   MET  20          2HE       MET  20   6.609  -9.863  -1.608
  183   3HE   MET  20          3HE       MET  20   5.216  -9.990  -0.506
  184    H    ARG  21           H        ARG  21   4.390  -7.096   0.908
  185    HA   ARG  21           HA       ARG  21   6.455  -6.890   1.872
  186   1HB   ARG  21          1HB       ARG  21   6.487  -9.324   0.852
  187   2HB   ARG  21          2HB       ARG  21   7.666  -8.617  -0.278
  188   1HG   ARG  21          1HG       ARG  21   9.191  -8.099   1.438
  189   2HG   ARG  21          2HG       ARG  21   7.940  -8.170   2.702
  190   1HD   ARG  21          1HD       ARG  21   8.622 -10.283   3.100
  191   2HD   ARG  21          2HD       ARG  21   7.884 -10.717   1.543
  192    HE   ARG  21           HE       ARG  21  10.533  -9.668   1.159
  193   1HH1  ARG  21          2HH2      ARG  21   8.740 -12.512   2.253
  194   2HH1  ARG  21          1HH2      ARG  21  10.008 -13.642   1.835
  195   1HH2  ARG  21          2HH1      ARG  21  12.208 -11.161   0.607
  196   2HH2  ARG  21          1HH1      ARG  21  11.986 -12.872   0.896
  197    H    ARG  22           H        ARG  22   5.589  -5.531  -0.920
  198    HA   ARG  22           HA       ARG  22   8.231  -4.583  -1.790
  199   1HB   ARG  22          1HB       ARG  22   5.412  -4.462  -2.778
  200   2HB   ARG  22          2HB       ARG  22   6.492  -3.122  -3.234
  201   1HG   ARG  22          1HG       ARG  22   6.972  -4.603  -4.949
  202   2HG   ARG  22          2HG       ARG  22   8.172  -5.142  -3.750
  203   1HD   ARG  22          1HD       ARG  22   5.605  -6.414  -3.265
  204   2HD   ARG  22          2HD       ARG  22   6.121  -6.686  -4.944
  205    HE   ARG  22           HE       ARG  22   8.196  -7.141  -2.926
  206   1HH1  ARG  22          2HH2      ARG  22   5.561  -8.501  -4.852
  207   2HH1  ARG  22          1HH2      ARG  22   6.141 -10.148  -4.733
  208   1HH2  ARG  22          2HH1      ARG  22   8.962  -9.316  -2.769
  209   2HH2  ARG  22          1HH1      ARG  22   8.080 -10.612  -3.545
  210    H    ASN  23           H        ASN  23   8.394  -3.789   0.622
  211    HA   ASN  23           HA       ASN  23   7.764  -0.908   0.531
  212   1HB   ASN  23          1HB       ASN  23   6.113  -2.608   1.930
  213   2HB   ASN  23          2HB       ASN  23   7.294  -2.140   3.173
  214   1HD2  ASN  23          1HD2      ASN  23   4.457  -1.418   3.052
  215   2HD2  ASN  23          2HD2      ASN  23   4.388   0.328   2.954
  216    H    GLN  24           H        GLN  24   9.803  -3.543   1.186
  217    HA   GLN  24           HA       GLN  24  11.386  -3.021   3.301
  218   1HB   GLN  24          1HB       GLN  24  11.851  -3.988   0.552
  219   2HB   GLN  24          2HB       GLN  24  13.306  -3.335   1.343
  220   1HG   GLN  24          1HG       GLN  24  13.443  -5.415   2.263
  221   2HG   GLN  24          2HG       GLN  24  12.221  -4.787   3.389
  222   1HE2  GLN  24          1HE2      GLN  24  12.842  -6.878   0.619
  223   2HE2  GLN  24          2HE2      GLN  24  11.280  -7.668   0.602
  224    H    PHE  25           H        PHE  25  12.629  -1.673   0.233
  225    HA   PHE  25           HA       PHE  25  13.483   0.722   1.754
  226   1HB   PHE  25          1HB       PHE  25  15.246  -0.433   0.592
  227   2HB   PHE  25          2HB       PHE  25  14.305  -0.474  -0.908
  228    HD1  PHE  25           1HD      PHE  25  13.541   1.938  -1.778
  229    HD2  PHE  25           2HD      PHE  25  16.892   1.180   0.801
  230    HE1  PHE  25           1HE      PHE  25  14.568   4.084  -2.481
  231    HE2  PHE  25           2HE      PHE  25  17.918   3.325   0.098
  232    HZ   PHE  25           HZ       PHE  25  16.756   4.777  -1.542
  233    H    TRP  26           H        TRP  26  11.098  -0.374  -0.467
  234    HA   TRP  26           HA       TRP  26  10.720   1.967  -2.029
  235   1HB   TRP  26          1HB       TRP  26   8.448   0.218  -1.134
  236   2HB   TRP  26          2HB       TRP  26   8.728   0.976  -2.707
  237    HD1  TRP  26           HD       TRP  26   8.014  -2.078  -2.444
  238    HE1  TRP  26           1HE      TRP  26   9.598  -3.871  -3.317
  239    HE3  TRP  26           3HE      TRP  26  12.365   0.618  -2.444
  240    HZ2  TRP  26           2HZ      TRP  26  12.413  -4.117  -3.943
  241    HZ3  TRP  26           3HZ      TRP  26  14.474  -0.428  -3.183
  242    HH2  TRP  26           HH       TRP  26  14.516  -2.789  -3.934
  243    H    VAL  27           H        VAL  27  10.313   1.405   1.320
  244    HA   VAL  27           HA       VAL  27   8.049   2.983   1.918
  245    HB   VAL  27           HB       VAL  27   9.556   1.444   3.408
  246   1HG1  VAL  27          1HG1      VAL  27  11.527   2.273   4.148
  247   2HG1  VAL  27          2HG1      VAL  27  11.366   3.518   2.887
  248   3HG1  VAL  27          3HG1      VAL  27  10.795   3.847   4.540
  249   1HG2  VAL  27          1HG2      VAL  27   8.088   2.160   4.961
  250   2HG2  VAL  27          2HG2      VAL  27   8.978   3.692   5.133
  251   3HG2  VAL  27          3HG2      VAL  27   7.694   3.541   3.910
  252    H    LYS  28           H        LYS  28   9.330   4.880   3.781
  253    HA   LYS  28           HA       LYS  28   9.536   7.196   3.609
  254   1HB   LYS  28          1HB       LYS  28  12.038   6.347   2.111
  255   2HB   LYS  28          2HB       LYS  28  11.823   7.763   3.168
  256   1HG   LYS  28          1HG       LYS  28  11.070   5.682   4.825
  257   2HG   LYS  28          2HG       LYS  28  12.377   4.944   3.869
  258   1HD   LYS  28          1HD       LYS  28  13.974   6.476   4.620
  259   2HD   LYS  28          2HD       LYS  28  12.754   7.714   5.003
  260   1HE   LYS  28          1HE       LYS  28  11.921   5.859   6.726
  261   2HE   LYS  28          2HE       LYS  28  13.603   5.303   6.585
  262   1HZ   LYS  28          1HZ       LYS  28  14.188   7.678   7.037
  263   2HZ   LYS  28          2HZ       LYS  28  12.623   7.896   7.510
  264   3HZ   LYS  28          3HZ       LYS  28  13.582   6.814   8.305
  265    H    VAL  29           H        VAL  29   7.853   6.216   1.516
  266    HA   VAL  29           HA       VAL  29   8.528   8.207  -0.587
  267    HB   VAL  29           HB       VAL  29   7.643   5.324  -0.927
  268   1HG1  VAL  29          1HG1      VAL  29   6.230   6.242  -2.497
  269   2HG1  VAL  29          2HG1      VAL  29   7.179   7.743  -2.627
  270   3HG1  VAL  29          3HG1      VAL  29   7.728   6.268  -3.458
  271   1HG2  VAL  29          1HG2      VAL  29   9.701   6.578  -2.654
  272   2HG2  VAL  29          2HG2      VAL  29  10.138   6.484  -0.931
  273   3HG2  VAL  29          3HG2      VAL  29   9.714   5.004  -1.824
  274    H    GLN  30           H        GLN  30   6.778   8.197   1.859
  275    HA   GLN  30           HA       GLN  30   4.477   9.403   0.641
  276   1HB   GLN  30          1HB       GLN  30   3.973   6.943   0.343
  277   2HB   GLN  30          2HB       GLN  30   3.970   6.794   2.117
  278   1HG   GLN  30          1HG       GLN  30   2.327   8.918   1.872
  279   2HG   GLN  30          2HG       GLN  30   2.013   8.148   0.302
  280   1HE2  GLN  30          1HE2      GLN  30   0.122   7.067   0.457
  281   2HE2  GLN  30          2HE2      GLN  30  -0.315   5.978   1.756
  282    H    ARG  31           H        ARG  31   5.029   7.475   3.642
  283    HA   ARG  31           HA       ARG  31   3.851   9.361   5.373
  284   1HB   ARG  31          1HB       ARG  31   4.657   6.855   5.690
  285   2HB   ARG  31          2HB       ARG  31   6.142   7.639   6.281
  286   1HG   ARG  31          1HG       ARG  31   4.382   9.125   7.640
  287   2HG   ARG  31          2HG       ARG  31   3.366   7.678   7.431
  288   1HD   ARG  31          1HD       ARG  31   4.670   6.401   8.804
  289   2HD   ARG  31          2HD       ARG  31   6.177   7.162   8.250
  290    HE   ARG  31           HE       ARG  31   4.781   7.788  10.630
  291   1HH1  ARG  31          2HH2      ARG  31   6.259   9.394   7.848
  292   2HH1  ARG  31          1HH2      ARG  31   6.660  10.851   8.730
  293   1HH2  ARG  31          2HH1      ARG  31   5.311   9.713  11.794
  294   2HH2  ARG  31          1HH1      ARG  31   6.120  11.033  10.979
  295    H    GLY  32           H        GLY  32   4.454  11.412   5.734
  296   1HA   GLY  32          1HA       GLY  32   7.161  12.032   6.533
  297   2HA   GLY  32          2HA       GLY  32   6.779  12.655   4.912
  Start of MODEL    8
    1    HA   PRO   1           HA       PRO   1  -2.886   6.342  -7.761
    2   1HB   PRO   1          1HB       PRO   1  -5.310   6.698  -6.567
    3   2HB   PRO   1          2HB       PRO   1  -5.127   5.727  -8.065
    4   1HG   PRO   1          1HG       PRO   1  -5.203   4.707  -5.211
    5   2HG   PRO   1          2HG       PRO   1  -6.197   4.145  -6.594
    6   1HD   PRO   1          1HD       PRO   1  -3.908   2.854  -5.873
    7   2HD   PRO   1          2HD       PRO   1  -4.315   3.082  -7.601
    8    HA   PRO   2           HA       PRO   2  -1.297   8.097  -4.029
    9   1HB   PRO   2          1HB       PRO   2  -1.536  10.745  -4.626
   10   2HB   PRO   2          2HB       PRO   2  -0.410   9.671  -5.520
   11   1HG   PRO   2          1HG       PRO   2  -3.227  10.456  -6.321
   12   2HG   PRO   2          2HG       PRO   2  -1.740  10.577  -7.316
   13   1HD   PRO   2          1HD       PRO   2  -3.415   8.436  -7.517
   14   2HD   PRO   2          2HD       PRO   2  -1.640   8.208  -7.573
   15    H    LEU   3           H        LEU   3  -3.192   7.145  -2.855
   16    HA   LEU   3           HA       LEU   3  -4.540   9.081  -1.320
   17   1HB   LEU   3          1HB       LEU   3  -6.901   8.575  -2.184
   18   2HB   LEU   3          2HB       LEU   3  -5.903   9.659  -3.183
   19    HG   LEU   3           HG       LEU   3  -7.210   7.559  -4.236
   20   1HD1  LEU   3          1HD1      LEU   3  -5.380   9.337  -5.127
   21   2HD1  LEU   3          2HD1      LEU   3  -4.401   7.854  -5.226
   22   3HD1  LEU   3          3HD1      LEU   3  -5.940   7.966  -6.114
   23   1HD2  LEU   3          1HD2      LEU   3  -4.482   6.431  -3.478
   24   2HD2  LEU   3          2HD2      LEU   3  -6.015   5.968  -2.700
   25   3HD2  LEU   3          3HD2      LEU   3  -5.749   5.615  -4.424
   26    H    SER   4           H        SER   4  -5.607   8.126   0.430
   27    HA   SER   4           HA       SER   4  -6.605   5.514   0.554
   28   1HB   SER   4          1HB       SER   4  -3.825   5.448   0.258
   29   2HB   SER   4          2HB       SER   4  -4.082   5.235   2.007
   30    HG   SER   4           HG       SER   4  -5.900   3.812   0.664
   31    H    GLN   5           H        GLN   5  -7.958   5.711   2.229
   32    HA   GLN   5           HA       GLN   5  -6.964   6.675   4.801
   33   1HB   GLN   5          1HB       GLN   5  -9.096   8.182   3.237
   34   2HB   GLN   5          2HB       GLN   5  -8.751   8.424   4.967
   35   1HG   GLN   5          1HG       GLN   5  -6.358   8.916   4.346
   36   2HG   GLN   5          2HG       GLN   5  -6.838   8.846   2.636
   37   1HE2  GLN   5          1HE2      GLN   5  -6.147  10.963   5.038
   38   2HE2  GLN   5          2HE2      GLN   5  -7.185  12.302   4.596
   39    H    GLU   6           H        GLU   6 -10.338   7.087   4.080
   40    HA   GLU   6           HA       GLU   6 -10.886   4.474   5.409
   41   1HB   GLU   6          1HB       GLU   6 -12.206   7.190   5.585
   42   2HB   GLU   6          2HB       GLU   6 -13.086   5.706   6.022
   43   1HG   GLU   6          1HG       GLU   6 -10.326   6.093   7.136
   44   2HG   GLU   6          2HG       GLU   6 -11.645   7.068   7.821
   45    H    THR   7           H        THR   7 -10.445   4.591   2.621
   46    HA   THR   7           HA       THR   7 -13.003   3.560   1.704
   47    HB   THR   7           HB       THR   7 -12.027   6.268   0.927
   48    HG1  THR   7           1HG      THR   7 -13.967   6.195   1.885
   49   1HG2  THR   7          1HG2      THR   7 -11.841   5.784  -1.272
   50   2HG2  THR   7          2HG2      THR   7 -12.382   4.109  -1.005
   51   3HG2  THR   7          3HG2      THR   7 -13.579   5.401  -1.260
   52    H    PHE   8           H        PHE   8 -10.697   5.027  -0.512
   53    HA   PHE   8           HA       PHE   8 -10.215   2.715  -1.980
   54   1HB   PHE   8          1HB       PHE   8  -7.868   4.114  -2.244
   55   2HB   PHE   8          2HB       PHE   8  -9.357   4.429  -3.152
   56    HD1  PHE   8           1HD      PHE   8  -8.723   5.135   0.459
   57    HD2  PHE   8           2HD      PHE   8  -9.240   6.762  -3.483
   58    HE1  PHE   8           1HE      PHE   8  -8.826   7.421   1.416
   59    HE2  PHE   8           2HE      PHE   8  -9.343   9.048  -2.526
   60    HZ   PHE   8           HZ       PHE   8  -9.136   9.377  -0.077
   61    H    SER   9           H        SER   9  -9.054   3.577   1.171
   62    HA   SER   9           HA       SER   9  -6.680   1.907   1.088
   63   1HB   SER   9          1HB       SER   9  -7.735   3.913   2.758
   64   2HB   SER   9          2HB       SER   9  -7.738   2.433   3.747
   65    HG   SER   9           HG       SER   9  -5.727   3.757   3.629
   66    H    ASP  10           H        ASP  10 -10.102   1.497   1.756
   67    HA   ASP  10           HA       ASP  10  -9.951  -0.858   3.343
   68   1HB   ASP  10          1HB       ASP  10 -11.946   0.727   2.781
   69   2HB   ASP  10          2HB       ASP  10 -12.150  -0.305   1.349
   70    H    LEU  11           H        LEU  11  -9.466  -0.242  -0.071
   71    HA   LEU  11           HA       LEU  11  -9.786  -3.071  -0.788
   72   1HB   LEU  11          1HB       LEU  11  -8.619  -1.731  -2.935
   73   2HB   LEU  11          2HB       LEU  11 -10.361  -2.011  -2.694
   74    HG   LEU  11           HG       LEU  11 -10.321   0.307  -2.920
   75   1HD1  LEU  11          1HD1      LEU  11 -10.993   1.106  -0.859
   76   2HD1  LEU  11          2HD1      LEU  11 -10.967  -0.634  -0.486
   77   3HD1  LEU  11          3HD1      LEU  11  -9.598   0.398  -0.011
   78   1HD2  LEU  11          1HD2      LEU  11  -7.748   0.392  -1.291
   79   2HD2  LEU  11          2HD2      LEU  11  -7.807   0.374  -3.070
   80   3HD2  LEU  11          3HD2      LEU  11  -8.504   1.743  -2.170
   81    H    TRP  12           H        TRP  12  -7.223  -1.342  -2.347
   82    HA   TRP  12           HA       TRP  12  -5.125  -2.518  -2.647
   83   1HB   TRP  12          1HB       TRP  12  -4.611  -1.074  -0.077
   84   2HB   TRP  12          2HB       TRP  12  -3.686  -1.064  -1.585
   85    HD1  TRP  12           HD       TRP  12  -5.190   1.351   0.330
   86    HE1  TRP  12           1HE      TRP  12  -6.319   3.239  -0.953
   87    HE3  TRP  12           3HE      TRP  12  -5.643  -0.930  -4.230
   88    HZ2  TRP  12           2HZ      TRP  12  -7.305   3.712  -3.633
   89    HZ3  TRP  12           3HZ      TRP  12  -6.681   0.269  -6.120
   90    HH2  TRP  12           HH       TRP  12  -7.516   2.584  -5.839
   91    H    LYS  13           H        LYS  13  -6.621  -2.856   0.569
   92    HA   LYS  13           HA       LYS  13  -4.748  -4.565   1.767
   93   1HB   LYS  13          1HB       LYS  13  -6.799  -3.492   2.807
   94   2HB   LYS  13          2HB       LYS  13  -7.767  -4.770   2.034
   95   1HG   LYS  13          1HG       LYS  13  -5.688  -6.187   3.223
   96   2HG   LYS  13          2HG       LYS  13  -6.029  -4.903   4.407
   97   1HD   LYS  13          1HD       LYS  13  -7.826  -6.080   5.088
   98   2HD   LYS  13          2HD       LYS  13  -8.553  -5.819   3.485
   99   1HE   LYS  13          1HE       LYS  13  -6.971  -7.817   2.779
  100   2HE   LYS  13          2HE       LYS  13  -6.990  -8.182   4.518
  101   1HZ   LYS  13          1HZ       LYS  13  -8.993  -8.594   2.587
  102   2HZ   LYS  13          2HZ       LYS  13  -8.880  -9.180   4.124
  103   3HZ   LYS  13          3HZ       LYS  13  -9.572  -7.708   3.852
  104    H    LEU  14           H        LEU  14  -6.031  -5.039  -1.192
  105    HA   LEU  14           HA       LEU  14  -6.373  -7.971  -0.853
  106   1HB   LEU  14          1HB       LEU  14  -7.200  -7.723  -3.291
  107   2HB   LEU  14          2HB       LEU  14  -8.236  -7.072  -1.998
  108    HG   LEU  14           HG       LEU  14  -7.709  -5.586  -4.108
  109   1HD1  LEU  14          1HD1      LEU  14  -7.442  -3.570  -2.411
  110   2HD1  LEU  14          2HD1      LEU  14  -8.937  -4.537  -2.422
  111   3HD1  LEU  14          3HD1      LEU  14  -7.691  -4.838  -1.187
  112   1HD2  LEU  14          1HD2      LEU  14  -5.639  -4.587  -4.248
  113   2HD2  LEU  14          2HD2      LEU  14  -5.381  -4.633  -2.487
  114   3HD2  LEU  14          3HD2      LEU  14  -5.137  -6.103  -3.461
  115    H    LEU  15           H        LEU  15  -4.384  -5.439  -2.297
  116    HA   LEU  15           HA       LEU  15  -2.757  -7.503  -3.679
  117   1HB   LEU  15          1HB       LEU  15  -2.864  -4.470  -3.903
  118   2HB   LEU  15          2HB       LEU  15  -1.709  -5.504  -4.779
  119    HG   LEU  15           HG       LEU  15  -4.598  -5.056  -5.258
  120   1HD1  LEU  15          1HD1      LEU  15  -3.332  -4.493  -7.100
  121   2HD1  LEU  15          2HD1      LEU  15  -2.077  -5.702  -6.739
  122   3HD1  LEU  15          3HD1      LEU  15  -3.609  -6.207  -7.489
  123   1HD2  LEU  15          1HD2      LEU  15  -4.257  -7.466  -4.221
  124   2HD2  LEU  15          2HD2      LEU  15  -5.246  -7.260  -5.687
  125   3HD2  LEU  15          3HD2      LEU  15  -3.567  -7.835  -5.820
  126    H    LYS  16           H        LYS  16  -2.961  -5.857  -0.752
  127    HA   LYS  16           HA       LYS  16  -0.632  -4.814   0.024
  128   1HB   LYS  16          1HB       LYS  16  -1.133  -6.977   1.868
  129   2HB   LYS  16          2HB       LYS  16  -1.497  -5.244   2.049
  130   1HG   LYS  16          1HG       LYS  16  -3.591  -6.444   2.210
  131   2HG   LYS  16          2HG       LYS  16  -3.565  -5.626   0.629
  132   1HD   LYS  16          1HD       LYS  16  -4.034  -7.664  -0.251
  133   2HD   LYS  16          2HD       LYS  16  -2.334  -8.062   0.093
  134   1HE   LYS  16          1HE       LYS  16  -4.201  -8.301   2.396
  135   2HE   LYS  16          2HE       LYS  16  -4.459  -9.467   1.079
  136   1HZ   LYS  16          1HZ       LYS  16  -2.270 -10.205   1.289
  137   2HZ   LYS  16          2HZ       LYS  16  -1.844  -8.979   2.306
  138   3HZ   LYS  16          3HZ       LYS  16  -2.880 -10.155   2.820
  139    H    LYS  17           H        LYS  17  -0.881  -8.362   0.517
  140    HA   LYS  17           HA       LYS  17   1.772  -8.957   0.734
  141   1HB   LYS  17          1HB       LYS  17   0.282 -10.743   1.025
  142   2HB   LYS  17          2HB       LYS  17  -0.531 -10.447  -0.531
  143   1HG   LYS  17          1HG       LYS  17   0.785 -12.148  -1.285
  144   2HG   LYS  17          2HG       LYS  17   2.057 -10.904  -1.346
  145   1HD   LYS  17          1HD       LYS  17   2.958 -11.563   0.750
  146   2HD   LYS  17          2HD       LYS  17   1.498 -12.484   1.183
  147   1HE   LYS  17          1HE       LYS  17   2.195 -14.326   0.066
  148   2HE   LYS  17          2HE       LYS  17   2.724 -13.376  -1.340
  149   1HZ   LYS  17          1HZ       LYS  17   4.767 -13.604  -0.654
  150   2HZ   LYS  17          2HZ       LYS  17   4.429 -12.874   0.786
  151   3HZ   LYS  17          3HZ       LYS  17   4.277 -14.510   0.635
  152    H    TRP  18           H        TRP  18   0.042  -8.019  -2.195
  153    HA   TRP  18           HA       TRP  18   2.549  -8.446  -3.748
  154   1HB   TRP  18          1HB       TRP  18   0.627  -7.925  -5.601
  155   2HB   TRP  18          2HB       TRP  18   1.106  -9.545  -5.076
  156    HD1  TRP  18           HD       TRP  18  -1.831  -7.383  -5.432
  157    HE1  TRP  18           1HE      TRP  18  -3.887  -8.361  -4.290
  158    HE3  TRP  18           3HE      TRP  18   0.447 -11.023  -2.646
  159    HZ2  TRP  18           2HZ      TRP  18  -4.482 -10.466  -2.396
  160    HZ3  TRP  18           3HZ      TRP  18  -0.895 -12.492  -1.187
  161    HH2  TRP  18           HH       TRP  18  -3.354 -12.228  -1.050
  162    H    LYS  19           H        LYS  19   0.572  -6.123  -2.228
  163    HA   LYS  19           HA       LYS  19   1.498  -3.981  -4.070
  164   1HB   LYS  19          1HB       LYS  19  -0.994  -4.365  -3.302
  165   2HB   LYS  19          2HB       LYS  19  -0.448  -3.568  -1.807
  166   1HG   LYS  19          1HG       LYS  19  -0.392  -1.541  -2.809
  167   2HG   LYS  19          2HG       LYS  19   0.519  -2.180  -4.199
  168   1HD   LYS  19          1HD       LYS  19  -1.696  -3.192  -5.003
  169   2HD   LYS  19          2HD       LYS  19  -2.490  -2.189  -3.766
  170   1HE   LYS  19          1HE       LYS  19  -1.174  -0.214  -4.799
  171   2HE   LYS  19          2HE       LYS  19  -0.881  -1.299  -6.176
  172   1HZ   LYS  19          1HZ       LYS  19  -2.957   0.243  -6.039
  173   2HZ   LYS  19          2HZ       LYS  19  -3.022  -1.238  -6.762
  174   3HZ   LYS  19          3HZ       LYS  19  -3.595  -1.043  -5.228
  175    H    MET  20           H        MET  20   2.596  -5.600  -1.441
  176    HA   MET  20           HA       MET  20   3.164  -4.067   0.668
  177   1HB   MET  20          1HB       MET  20   5.165  -5.246   0.925
  178   2HB   MET  20          2HB       MET  20   4.255  -6.293  -0.190
  179   1HG   MET  20          1HG       MET  20   5.638  -4.283  -1.710
  180   2HG   MET  20          2HG       MET  20   6.790  -5.040  -0.597
  181   1HE   MET  20          1HE       MET  20   3.654  -7.148  -2.124
  182   2HE   MET  20          2HE       MET  20   3.928  -5.634  -3.019
  183   3HE   MET  20          3HE       MET  20   4.266  -7.199  -3.795
  184    H    ARG  21           H        ARG  21   4.670  -2.428   1.292
  185    HA   ARG  21           HA       ARG  21   5.949  -0.536   1.007
  186   1HB   ARG  21          1HB       ARG  21   7.035  -1.994  -0.848
  187   2HB   ARG  21          2HB       ARG  21   6.039  -1.042  -1.975
  188   1HG   ARG  21          1HG       ARG  21   6.992   1.050  -0.888
  189   2HG   ARG  21          2HG       ARG  21   8.130  -0.008  -0.020
  190   1HD   ARG  21          1HD       ARG  21   8.036  -0.659  -2.862
  191   2HD   ARG  21          2HD       ARG  21   8.444   1.052  -2.610
  192    HE   ARG  21           HE       ARG  21  10.023  -0.370  -0.802
  193   1HH1  ARG  21          2HH2      ARG  21   9.522  -0.257  -4.300
  194   2HH1  ARG  21          1HH2      ARG  21  11.164  -0.721  -4.688
  195   1HH2  ARG  21          2HH1      ARG  21  12.191  -0.983  -1.314
  196   2HH2  ARG  21          1HH1      ARG  21  12.685  -1.135  -2.985
  197    H    ARG  22           H        ARG  22   2.942  -1.206  -0.246
  198    HA   ARG  22           HA       ARG  22   2.525   1.502  -1.365
  199   1HB   ARG  22          1HB       ARG  22   0.991  -1.100  -1.384
  200   2HB   ARG  22          2HB       ARG  22   0.170   0.437  -1.748
  201   1HG   ARG  22          1HG       ARG  22   2.529  -0.815  -3.202
  202   2HG   ARG  22          2HG       ARG  22   0.918  -0.432  -3.855
  203   1HD   ARG  22          1HD       ARG  22   1.967   1.455  -4.601
  204   2HD   ARG  22          2HD       ARG  22   1.657   2.022  -2.946
  205    HE   ARG  22           HE       ARG  22   4.081   0.704  -2.769
  206   1HH1  ARG  22          2HH2      ARG  22   2.754   3.327  -4.735
  207   2HH1  ARG  22          1HH2      ARG  22   4.290   4.142  -4.929
  208   1HH2  ARG  22          2HH1      ARG  22   6.109   1.781  -3.026
  209   2HH2  ARG  22          1HH1      ARG  22   6.203   3.260  -3.955
  210    H    ASN  23           H        ASN  23   3.064   2.135   1.036
  211    HA   ASN  23           HA       ASN  23   0.591   1.963   2.676
  212   1HB   ASN  23          1HB       ASN  23   2.565   1.198   3.830
  213   2HB   ASN  23          2HB       ASN  23   3.476   2.643   3.343
  214   1HD2  ASN  23          1HD2      ASN  23   0.395   1.761   5.014
  215   2HD2  ASN  23          2HD2      ASN  23   0.520   2.989   6.255
  216    H    GLN  24           H        GLN  24   2.873   4.465   3.368
  217    HA   GLN  24           HA       GLN  24   1.703   6.507   1.696
  218   1HB   GLN  24          1HB       GLN  24   0.186   5.812   3.934
  219   2HB   GLN  24          2HB       GLN  24   1.110   7.235   4.470
  220   1HG   GLN  24          1HG       GLN  24   0.417   8.218   2.128
  221   2HG   GLN  24          2HG       GLN  24  -0.855   6.978   2.192
  222   1HE2  GLN  24          1HE2      GLN  24  -2.740   7.664   3.018
  223   2HE2  GLN  24          2HE2      GLN  24  -2.931   8.910   4.233
  224    H    PHE  25           H        PHE  25   3.314   5.810   4.840
  225    HA   PHE  25           HA       PHE  25   5.153   8.080   4.291
  226   1HB   PHE  25          1HB       PHE  25   4.120   8.293   6.417
  227   2HB   PHE  25          2HB       PHE  25   4.351   6.577   6.790
  228    HD1  PHE  25           1HD      PHE  25   6.946   5.821   6.685
  229    HD2  PHE  25           2HD      PHE  25   5.518   9.794   7.479
  230    HE1  PHE  25           1HE      PHE  25   9.076   6.356   7.837
  231    HE2  PHE  25           2HE      PHE  25   7.648  10.329   8.631
  232    HZ   PHE  25           HZ       PHE  25   9.427   8.610   8.810
  233    H    TRP  26           H        TRP  26   5.018   4.602   5.162
  234    HA   TRP  26           HA       TRP  26   7.935   4.402   4.739
  235   1HB   TRP  26          1HB       TRP  26   7.441   1.987   5.436
  236   2HB   TRP  26          2HB       TRP  26   7.262   3.251   6.660
  237    HD1  TRP  26           HD       TRP  26   5.385   0.553   4.864
  238    HE1  TRP  26           1HE      TRP  26   2.998   0.371   5.731
  239    HE3  TRP  26           3HE      TRP  26   5.220   4.826   7.678
  240    HZ2  TRP  26           2HZ      TRP  26   1.221   1.889   7.438
  241    HZ3  TRP  26           3HZ      TRP  26   3.166   5.423   8.908
  242    HH2  TRP  26           HH       TRP  26   1.163   3.970   8.799
  243    H    VAL  27           H        VAL  27   6.005   4.996   2.533
  244    HA   VAL  27           HA       VAL  27   5.687   2.589   0.982
  245    HB   VAL  27           HB       VAL  27   5.277   4.312  -0.873
  246   1HG1  VAL  27          1HG1      VAL  27   3.228   3.752  -0.064
  247   2HG1  VAL  27          2HG1      VAL  27   3.785   3.803   1.626
  248   3HG1  VAL  27          3HG1      VAL  27   3.307   5.306   0.801
  249   1HG2  VAL  27          1HG2      VAL  27   4.857   6.497   0.979
  250   2HG2  VAL  27          2HG2      VAL  27   6.558   5.976   1.048
  251   3HG2  VAL  27          3HG2      VAL  27   5.839   6.463  -0.506
  252    H    LYS  28           H        LYS  28   8.145   2.140   1.658
  253    HA   LYS  28           HA       LYS  28   9.659   1.777  -0.560
  254   1HB   LYS  28          1HB       LYS  28   9.677   4.633   0.221
  255   2HB   LYS  28          2HB       LYS  28  11.289   3.919  -0.025
  256   1HG   LYS  28          1HG       LYS  28   9.291   3.141  -2.066
  257   2HG   LYS  28          2HG       LYS  28   9.671   4.879  -2.042
  258   1HD   LYS  28          1HD       LYS  28  12.153   3.568  -1.732
  259   2HD   LYS  28          2HD       LYS  28  11.291   2.652  -2.991
  260   1HE   LYS  28          1HE       LYS  28  10.939   4.637  -4.307
  261   2HE   LYS  28          2HE       LYS  28  11.506   5.684  -2.987
  262   1HZ   LYS  28          1HZ       LYS  28  13.278   5.502  -4.409
  263   2HZ   LYS  28          2HZ       LYS  28  13.643   4.410  -3.229
  264   3HZ   LYS  28          3HZ       LYS  28  13.063   3.889  -4.682
  265    H    VAL  29           H        VAL  29   9.242   0.587   1.929
  266    HA   VAL  29           HA       VAL  29  11.933   0.830   3.193
  267    HB   VAL  29           HB       VAL  29   9.278  -0.054   4.393
  268   1HG1  VAL  29          1HG1      VAL  29  10.694  -1.224   5.751
  269   2HG1  VAL  29          2HG1      VAL  29  12.118  -0.290   5.235
  270   3HG1  VAL  29          3HG1      VAL  29  11.019   0.373   6.467
  271   1HG2  VAL  29          1HG2      VAL  29   9.672   2.009   5.811
  272   2HG2  VAL  29          2HG2      VAL  29  11.002   2.437   4.708
  273   3HG2  VAL  29          3HG2      VAL  29   9.332   2.350   4.097
  274    H    GLN  30           H        GLN  30  11.142  -0.742   0.791
  275    HA   GLN  30           HA       GLN  30  11.122  -3.512   1.785
  276   1HB   GLN  30          1HB       GLN  30  10.050  -2.247  -0.439
  277   2HB   GLN  30          2HB       GLN  30  11.483  -3.069  -1.100
  278   1HG   GLN  30          1HG       GLN  30   9.437  -4.508  -1.127
  279   2HG   GLN  30          2HG       GLN  30  10.756  -5.195  -0.155
  280   1HE2  GLN  30          1HE2      GLN  30   9.448  -6.440   1.207
  281   2HE2  GLN  30          2HE2      GLN  30   8.360  -5.730   2.381
  282    H    ARG  31           H        ARG  31  12.824  -4.946   1.604
  283    HA   ARG  31           HA       ARG  31  15.404  -4.177   1.964
  284   1HB   ARG  31          1HB       ARG  31  14.043  -6.586   0.974
  285   2HB   ARG  31          2HB       ARG  31  15.711  -6.433   0.371
  286   1HG   ARG  31          1HG       ARG  31  15.456  -5.726   3.216
  287   2HG   ARG  31          2HG       ARG  31  14.972  -7.404   2.875
  288   1HD   ARG  31          1HD       ARG  31  17.130  -7.623   1.532
  289   2HD   ARG  31          2HD       ARG  31  17.614  -6.054   2.212
  290    HE   ARG  31           HE       ARG  31  17.544  -8.629   3.582
  291   1HH1  ARG  31          2HH2      ARG  31  17.451  -5.110   3.916
  292   2HH1  ARG  31          1HH2      ARG  31  18.041  -5.114   5.563
  293   1HH2  ARG  31          2HH1      ARG  31  18.323  -8.634   5.757
  294   2HH2  ARG  31          1HH1      ARG  31  18.538  -7.123   6.612
  295    H    GLY  32           H        GLY  32  13.924  -4.861  -1.258
  296   1HA   GLY  32          1HA       GLY  32  14.592  -2.963  -2.880
  297   2HA   GLY  32          2HA       GLY  32  16.249  -3.488  -2.506
  Start of MODEL    9
    1    HA   PRO   1           HA       PRO   1 -18.899  -4.686  -1.782
    2   1HB   PRO   1          1HB       PRO   1 -19.601  -2.566  -0.221
    3   2HB   PRO   1          2HB       PRO   1 -19.913  -4.258   0.286
    4   1HG   PRO   1          1HG       PRO   1 -17.552  -2.516   1.049
    5   2HG   PRO   1          2HG       PRO   1 -18.636  -3.423   2.153
    6   1HD   PRO   1          1HD       PRO   1 -16.252  -4.459   1.334
    7   2HD   PRO   1          2HD       PRO   1 -17.697  -5.506   1.470
    8    HA   PRO   2           HA       PRO   2 -16.696  -1.649  -4.116
    9   1HB   PRO   2          1HB       PRO   2 -18.712  -0.720  -5.696
   10   2HB   PRO   2          2HB       PRO   2 -18.104  -2.402  -5.830
   11   1HG   PRO   2          1HG       PRO   2 -20.501  -1.435  -4.246
   12   2HG   PRO   2          2HG       PRO   2 -20.455  -2.769  -5.444
   13   1HD   PRO   2          1HD       PRO   2 -20.217  -3.250  -2.771
   14   2HD   PRO   2          2HD       PRO   2 -19.221  -4.158  -3.948
   15    H    LEU   3           H        LEU   3 -16.000   0.080  -2.942
   16    HA   LEU   3           HA       LEU   3 -17.424   2.500  -2.894
   17   1HB   LEU   3          1HB       LEU   3 -18.489   0.741  -1.013
   18   2HB   LEU   3          2HB       LEU   3 -17.371   1.748  -0.061
   19    HG   LEU   3           HG       LEU   3 -19.576   2.815  -0.132
   20   1HD1  LEU   3          1HD1      LEU   3 -18.784   4.938  -0.578
   21   2HD1  LEU   3          2HD1      LEU   3 -17.236   4.059  -0.582
   22   3HD1  LEU   3          3HD1      LEU   3 -18.040   4.452  -2.121
   23   1HD2  LEU   3          1HD2      LEU   3 -20.457   3.591  -2.367
   24   2HD2  LEU   3          2HD2      LEU   3 -19.202   2.599  -3.148
   25   3HD2  LEU   3          3HD2      LEU   3 -20.466   1.822  -2.164
   26    H    SER   4           H        SER   4 -16.037   4.148  -2.370
   27    HA   SER   4           HA       SER   4 -13.749   3.674  -0.631
   28   1HB   SER   4          1HB       SER   4 -12.392   2.959  -2.291
   29   2HB   SER   4          2HB       SER   4 -13.542   3.447  -3.559
   30    HG   SER   4           HG       SER   4 -11.707   4.722  -3.697
   31    H    GLN   5           H        GLN   5 -13.714   5.481   0.557
   32    HA   GLN   5           HA       GLN   5 -13.782   8.081  -0.812
   33   1HB   GLN   5          1HB       GLN   5 -16.074   6.959   0.545
   34   2HB   GLN   5          2HB       GLN   5 -15.486   8.382   1.439
   35   1HG   GLN   5          1HG       GLN   5 -16.748   9.512  -0.100
   36   2HG   GLN   5          2HG       GLN   5 -15.290   9.321  -1.099
   37   1HE2  GLN   5          1HE2      GLN   5 -17.203   9.654  -2.731
   38   2HE2  GLN   5          2HE2      GLN   5 -17.915   8.181  -3.352
   39    H    GLU   6           H        GLU   6 -14.482   7.446   2.615
   40    HA   GLU   6           HA       GLU   6 -11.709   8.340   3.252
   41   1HB   GLU   6          1HB       GLU   6 -12.617   9.604   5.120
   42   2HB   GLU   6          2HB       GLU   6 -13.442  10.110   3.626
   43   1HG   GLU   6          1HG       GLU   6 -14.986   7.973   4.497
   44   2HG   GLU   6          2HG       GLU   6 -14.521   8.768   6.017
   45    H    THR   7           H        THR   7 -12.327   5.635   2.944
   46    HA   THR   7           HA       THR   7 -11.566   4.622   5.509
   47    HB   THR   7           HB       THR   7 -14.454   4.657   4.808
   48    HG1  THR   7           1HG      THR   7 -12.954   4.244   7.186
   49   1HG2  THR   7          1HG2      THR   7 -14.659   2.407   4.675
   50   2HG2  THR   7          2HG2      THR   7 -12.959   2.157   5.140
   51   3HG2  THR   7          3HG2      THR   7 -14.204   2.362   6.395
   52    H    PHE   8           H        PHE   8 -13.812   2.857   3.424
   53    HA   PHE   8           HA       PHE   8 -12.138   0.685   2.976
   54   1HB   PHE   8          1HB       PHE   8 -13.642   0.782   0.683
   55   2HB   PHE   8          2HB       PHE   8 -14.178   0.109   2.231
   56    HD1  PHE   8           1HD      PHE   8 -13.672   3.712   1.403
   57    HD2  PHE   8           2HD      PHE   8 -16.494   0.567   2.173
   58    HE1  PHE   8           1HE      PHE   8 -15.505   5.380   1.496
   59    HE2  PHE   8           2HE      PHE   8 -18.327   2.234   2.266
   60    HZ   PHE   8           HZ       PHE   8 -17.833   4.641   1.927
   61    H    SER   9           H        SER   9 -11.949   3.881   1.652
   62    HA   SER   9           HA       SER   9 -10.498   3.123  -0.750
   63   1HB   SER   9          1HB       SER   9 -11.922   5.222  -0.395
   64   2HB   SER   9          2HB       SER   9 -10.578   5.844   0.592
   65    HG   SER   9           HG       SER   9 -10.417   6.458  -1.613
   66    H    ASP  10           H        ASP  10  -9.765   3.731   2.616
   67    HA   ASP  10           HA       ASP  10  -7.021   4.465   2.310
   68   1HB   ASP  10          1HB       ASP  10  -8.808   4.320   4.381
   69   2HB   ASP  10          2HB       ASP  10  -7.790   2.899   4.704
   70    H    LEU  11           H        LEU  11  -8.760   1.435   2.082
   71    HA   LEU  11           HA       LEU  11  -6.334  -0.177   2.426
   72   1HB   LEU  11          1HB       LEU  11  -8.347  -1.806   1.401
   73   2HB   LEU  11          2HB       LEU  11  -7.963  -1.572   3.124
   74    HG   LEU  11           HG       LEU  11 -10.225  -1.006   3.094
   75   1HD1  LEU  11          1HD1      LEU  11  -9.347   1.721   2.213
   76   2HD1  LEU  11          2HD1      LEU  11 -10.259   1.231   3.661
   77   3HD1  LEU  11          3HD1      LEU  11  -8.496   0.996   3.598
   78   1HD2  LEU  11          1HD2      LEU  11  -9.803   0.426   0.438
   79   2HD2  LEU  11          2HD2      LEU  11 -10.380  -1.251   0.589
   80   3HD2  LEU  11          3HD2      LEU  11 -11.356   0.087   1.240
   81    H    TRP  12           H        TRP  12  -8.608  -1.096  -0.051
   82    HA   TRP  12           HA       TRP  12  -7.620  -1.937  -2.124
   83   1HB   TRP  12          1HB       TRP  12  -8.162   0.929  -2.786
   84   2HB   TRP  12          2HB       TRP  12  -8.690  -0.543  -3.614
   85    HD1  TRP  12           HD       TRP  12 -10.292   2.145  -2.189
   86    HE1  TRP  12           1HE      TRP  12 -12.467   1.615  -0.973
   87    HE3  TRP  12           3HE      TRP  12  -9.641  -2.888  -1.527
   88    HZ2  TRP  12           2HZ      TRP  12 -13.774  -0.707   0.154
   89    HZ3  TRP  12           3HZ      TRP  12 -11.369  -4.224  -0.380
   90    HH2  TRP  12           HH       TRP  12 -13.437  -3.152   0.465
   91    H    LYS  13           H        LYS  13  -6.211   1.067  -0.828
   92    HA   LYS  13           HA       LYS  13  -4.277   1.594  -2.763
   93   1HB   LYS  13          1HB       LYS  13  -4.432   3.180  -1.062
   94   2HB   LYS  13          2HB       LYS  13  -4.427   1.952   0.226
   95   1HG   LYS  13          1HG       LYS  13  -2.097   1.580   0.024
   96   2HG   LYS  13          2HG       LYS  13  -2.025   2.343  -1.582
   97   1HD   LYS  13          1HD       LYS  13  -3.068   4.347   0.072
   98   2HD   LYS  13          2HD       LYS  13  -1.822   3.565   1.075
   99   1HE   LYS  13          1HE       LYS  13  -0.507   3.697  -1.303
  100   2HE   LYS  13          2HE       LYS  13  -1.546   5.132  -1.446
  101   1HZ   LYS  13          1HZ       LYS  13  -0.644   6.008   0.487
  102   2HZ   LYS  13          2HZ       LYS  13   0.094   4.598   0.918
  103   3HZ   LYS  13          3HZ       LYS  13   0.650   5.458  -0.374
  104    H    LEU  14           H        LEU  14  -4.675  -1.247  -0.938
  105    HA   LEU  14           HA       LEU  14  -1.841  -1.944  -0.807
  106   1HB   LEU  14          1HB       LEU  14  -2.897  -4.210  -0.141
  107   2HB   LEU  14          2HB       LEU  14  -3.145  -2.829   0.954
  108    HG   LEU  14           HG       LEU  14  -5.196  -4.345   0.197
  109   1HD1  LEU  14          1HD1      LEU  14  -6.519  -2.013   0.079
  110   2HD1  LEU  14          2HD1      LEU  14  -5.789  -2.599   1.592
  111   3HD1  LEU  14          3HD1      LEU  14  -4.941  -1.383   0.607
  112   1HD2  LEU  14          1HD2      LEU  14  -6.101  -3.927  -1.877
  113   2HD2  LEU  14          2HD2      LEU  14  -5.497  -2.253  -1.920
  114   3HD2  LEU  14          3HD2      LEU  14  -4.397  -3.605  -2.278
  115    H    LEU  15           H        LEU  15  -4.628  -2.461  -2.927
  116    HA   LEU  15           HA       LEU  15  -3.193  -4.479  -4.506
  117   1HB   LEU  15          1HB       LEU  15  -5.943  -3.224  -4.559
  118   2HB   LEU  15          2HB       LEU  15  -5.342  -4.160  -5.949
  119    HG   LEU  15           HG       LEU  15  -6.507  -5.173  -3.574
  120   1HD1  LEU  15          1HD1      LEU  15  -6.421  -7.196  -4.739
  121   2HD1  LEU  15          2HD1      LEU  15  -6.237  -6.023  -6.065
  122   3HD1  LEU  15          3HD1      LEU  15  -4.808  -6.858  -5.411
  123   1HD2  LEU  15          1HD2      LEU  15  -4.783  -5.548  -2.165
  124   2HD2  LEU  15          2HD2      LEU  15  -4.147  -6.699  -3.366
  125   3HD2  LEU  15          3HD2      LEU  15  -3.600  -5.005  -3.380
  126    H    LYS  16           H        LYS  16  -3.024  -1.176  -4.193
  127    HA   LYS  16           HA       LYS  16  -2.556  -0.753  -7.100
  128   1HB   LYS  16          1HB       LYS  16  -2.602   1.480  -5.093
  129   2HB   LYS  16          2HB       LYS  16  -3.132   1.466  -6.792
  130   1HG   LYS  16          1HG       LYS  16  -4.569   0.461  -4.333
  131   2HG   LYS  16          2HG       LYS  16  -5.180   1.482  -5.656
  132   1HD   LYS  16          1HD       LYS  16  -4.397  -0.889  -6.929
  133   2HD   LYS  16          2HD       LYS  16  -5.152  -1.438  -5.414
  134   1HE   LYS  16          1HE       LYS  16  -6.965  -1.261  -6.920
  135   2HE   LYS  16          2HE       LYS  16  -7.042   0.242  -5.974
  136   1HZ   LYS  16          1HZ       LYS  16  -5.925   1.358  -7.741
  137   2HZ   LYS  16          2HZ       LYS  16  -5.786  -0.035  -8.612
  138   3HZ   LYS  16          3HZ       LYS  16  -7.275   0.615  -8.328
  139    H    LYS  17           H        LYS  17  -1.214   0.312  -3.917
  140    HA   LYS  17           HA       LYS  17   1.382   0.819  -5.119
  141   1HB   LYS  17          1HB       LYS  17   1.930   1.760  -3.071
  142   2HB   LYS  17          2HB       LYS  17   0.159   1.939  -3.052
  143   1HG   LYS  17          1HG       LYS  17   0.049  -0.304  -1.860
  144   2HG   LYS  17          2HG       LYS  17   1.820  -0.227  -1.704
  145   1HD   LYS  17          1HD       LYS  17  -0.173   1.820  -0.639
  146   2HD   LYS  17          2HD       LYS  17   0.753   0.650   0.331
  147   1HE   LYS  17          1HE       LYS  17   2.639   1.997  -1.306
  148   2HE   LYS  17          2HE       LYS  17   1.561   3.252  -0.660
  149   1HZ   LYS  17          1HZ       LYS  17   1.973   2.399   1.524
  150   2HZ   LYS  17          2HZ       LYS  17   2.963   1.222   0.930
  151   3HZ   LYS  17          3HZ       LYS  17   3.394   2.809   0.796
  152    H    TRP  18           H        TRP  18  -0.254  -1.971  -4.169
  153    HA   TRP  18           HA       TRP  18   0.660  -3.896  -3.005
  154   1HB   TRP  18          1HB       TRP  18   1.400  -3.601  -5.910
  155   2HB   TRP  18          2HB       TRP  18   1.839  -5.064  -5.017
  156    HD1  TRP  18           HD       TRP  18  -0.606  -5.860  -3.478
  157    HE1  TRP  18           1HE      TRP  18  -2.829  -6.479  -4.555
  158    HE3  TRP  18           3HE      TRP  18  -0.026  -3.464  -7.964
  159    HZ2  TRP  18           2HZ      TRP  18  -4.200  -5.999  -7.058
  160    HZ3  TRP  18           3HZ      TRP  18  -1.809  -3.568  -9.667
  161    HH2  TRP  18           HH       TRP  18  -3.896  -4.829  -9.231
  162    H    LYS  19           H        LYS  19   3.147  -2.041  -4.829
  163    HA   LYS  19           HA       LYS  19   5.351  -3.385  -3.553
  164   1HB   LYS  19          1HB       LYS  19   4.962  -0.990  -5.327
  165   2HB   LYS  19          2HB       LYS  19   6.508  -1.175  -4.464
  166   1HG   LYS  19          1HG       LYS  19   7.113  -3.033  -5.670
  167   2HG   LYS  19          2HG       LYS  19   5.438  -3.619  -5.807
  168   1HD   LYS  19          1HD       LYS  19   5.313  -1.295  -7.267
  169   2HD   LYS  19          2HD       LYS  19   6.979  -1.824  -7.600
  170   1HE   LYS  19          1HE       LYS  19   6.289  -3.836  -8.570
  171   2HE   LYS  19          2HE       LYS  19   4.724  -3.822  -7.729
  172   1HZ   LYS  19          1HZ       LYS  19   3.838  -2.733  -9.388
  173   2HZ   LYS  19          2HZ       LYS  19   5.026  -1.590  -9.413
  174   3HZ   LYS  19          3HZ       LYS  19   5.214  -2.993 -10.259
  175    H    MET  20           H        MET  20   3.032  -1.586  -2.155
  176    HA   MET  20           HA       MET  20   3.773   0.524  -0.774
  177   1HB   MET  20          1HB       MET  20   2.406  -0.170   0.939
  178   2HB   MET  20          2HB       MET  20   1.980  -1.407  -0.268
  179   1HG   MET  20          1HG       MET  20   3.707  -2.906   0.686
  180   2HG   MET  20          2HG       MET  20   4.087  -1.681   1.907
  181   1HE   MET  20          1HE       MET  20  -0.131  -1.785   2.760
  182   2HE   MET  20          2HE       MET  20   1.128  -0.557   2.484
  183   3HE   MET  20          3HE       MET  20   0.458  -1.469   1.110
  184    H    ARG  21           H        ARG  21   5.287   1.281   0.656
  185    HA   ARG  21           HA       ARG  21   7.121   1.257   2.059
  186   1HB   ARG  21          1HB       ARG  21   6.130  -1.157   2.606
  187   2HB   ARG  21          2HB       ARG  21   7.568  -1.689   1.703
  188   1HG   ARG  21          1HG       ARG  21   9.024  -0.922   3.303
  189   2HG   ARG  21          2HG       ARG  21   7.997   0.472   3.718
  190   1HD   ARG  21          1HD       ARG  21   7.743  -0.843   5.620
  191   2HD   ARG  21          2HD       ARG  21   6.365  -1.391   4.642
  192    HE   ARG  21           HE       ARG  21   8.324  -3.120   3.881
  193   1HH1  ARG  21          2HH2      ARG  21   7.159  -2.016   7.032
  194   2HH1  ARG  21          1HH2      ARG  21   7.545  -3.512   7.852
  195   1HH2  ARG  21          2HH1      ARG  21   8.834  -5.096   4.965
  196   2HH2  ARG  21          1HH1      ARG  21   8.500  -5.268   6.673
  197    H    ARG  22           H        ARG  22   6.884   0.610  -1.132
  198    HA   ARG  22           HA       ARG  22   9.741   0.044  -1.596
  199   1HB   ARG  22          1HB       ARG  22   7.210  -0.066  -3.150
  200   2HB   ARG  22          2HB       ARG  22   8.650   0.445  -4.062
  201   1HG   ARG  22          1HG       ARG  22   8.151  -2.100  -3.920
  202   2HG   ARG  22          2HG       ARG  22   9.813  -1.563  -3.578
  203   1HD   ARG  22          1HD       ARG  22   9.648  -2.615  -1.593
  204   2HD   ARG  22          2HD       ARG  22   8.476  -1.369  -1.114
  205    HE   ARG  22           HE       ARG  22   6.841  -3.054  -2.388
  206   1HH1  ARG  22          2HH2      ARG  22   9.499  -3.710  -0.152
  207   2HH1  ARG  22          1HH2      ARG  22   8.791  -5.183   0.473
  208   1HH2  ARG  22          2HH1      ARG  22   5.906  -4.999  -1.563
  209   2HH2  ARG  22          1HH1      ARG  22   6.743  -5.918  -0.332
  210    H    ASN  23           H        ASN  23  10.014   2.241  -0.345
  211    HA   ASN  23           HA       ASN  23   9.840   4.469  -2.315
  212   1HB   ASN  23          1HB       ASN  23   8.612   4.881  -0.247
  213   2HB   ASN  23          2HB       ASN  23  10.047   4.476   0.719
  214   1HD2  ASN  23          1HD2      ASN  23   8.708   6.787  -1.659
  215   2HD2  ASN  23          2HD2      ASN  23   9.762   8.119  -1.235
  216    H    GLN  24           H        GLN  24  11.831   4.905   0.459
  217    HA   GLN  24           HA       GLN  24  14.267   4.186  -1.084
  218   1HB   GLN  24          1HB       GLN  24  13.530   6.848   0.155
  219   2HB   GLN  24          2HB       GLN  24  15.228   6.375  -0.087
  220   1HG   GLN  24          1HG       GLN  24  13.452   5.920  -2.421
  221   2HG   GLN  24          2HG       GLN  24  13.683   7.625  -1.978
  222   1HE2  GLN  24          1HE2      GLN  24  16.094   8.171  -1.413
  223   2HE2  GLN  24          2HE2      GLN  24  17.281   7.554  -2.542
  224    H    PHE  25           H        PHE  25  14.772   6.090   1.706
  225    HA   PHE  25           HA       PHE  25  16.303   4.352   3.126
  226   1HB   PHE  25          1HB       PHE  25  14.558   5.725   4.977
  227   2HB   PHE  25          2HB       PHE  25  16.266   6.020   4.611
  228    HD1  PHE  25           1HD      PHE  25  13.067   6.434   2.671
  229    HD2  PHE  25           2HD      PHE  25  16.660   8.252   4.167
  230    HE1  PHE  25           1HE      PHE  25  12.460   8.559   1.546
  231    HE2  PHE  25           2HE      PHE  25  16.053  10.377   3.041
  232    HZ   PHE  25           HZ       PHE  25  13.953  10.531   1.731
  233    H    TRP  26           H        TRP  26  12.778   4.291   2.833
  234    HA   TRP  26           HA       TRP  26  12.725   1.954   4.680
  235   1HB   TRP  26          1HB       TRP  26  10.332   2.425   4.900
  236   2HB   TRP  26          2HB       TRP  26  11.317   3.815   5.378
  237    HD1  TRP  26           HD       TRP  26   8.792   2.667   2.793
  238    HE1  TRP  26           1HE      TRP  26   7.930   4.655   1.454
  239    HE3  TRP  26           3HE      TRP  26  12.017   6.254   4.506
  240    HZ2  TRP  26           2HZ      TRP  26   8.556   7.465   1.155
  241    HZ3  TRP  26           3HZ      TRP  26  11.853   8.570   3.672
  242    HH2  TRP  26           HH       TRP  26  10.133   9.191   2.001
  243    H    VAL  27           H        VAL  27  13.778   1.180   2.404
  244    HA   VAL  27           HA       VAL  27  11.600   0.365   0.572
  245    HB   VAL  27           HB       VAL  27  13.602  -0.471  -0.789
  246   1HG1  VAL  27          1HG1      VAL  27  12.928   1.490  -1.733
  247   2HG1  VAL  27          2HG1      VAL  27  12.767   2.301  -0.157
  248   3HG1  VAL  27          3HG1      VAL  27  14.364   2.173  -0.934
  249   1HG2  VAL  27          1HG2      VAL  27  14.928   0.066   1.643
  250   2HG2  VAL  27          2HG2      VAL  27  15.680  -0.346   0.084
  251   3HG2  VAL  27          3HG2      VAL  27  15.445   1.359   0.535
  252    H    LYS  28           H        LYS  28  14.099  -1.782   0.230
  253    HA   LYS  28           HA       LYS  28  12.557  -3.901   1.531
  254   1HB   LYS  28          1HB       LYS  28  15.092  -3.881  -0.149
  255   2HB   LYS  28          2HB       LYS  28  14.322  -5.356   0.482
  256   1HG   LYS  28          1HG       LYS  28  12.157  -4.461  -0.644
  257   2HG   LYS  28          2HG       LYS  28  13.242  -3.371  -1.539
  258   1HD   LYS  28          1HD       LYS  28  13.666  -5.056  -2.976
  259   2HD   LYS  28          2HD       LYS  28  14.441  -5.944  -1.642
  260   1HE   LYS  28          1HE       LYS  28  12.618  -7.283  -1.295
  261   2HE   LYS  28          2HE       LYS  28  11.463  -5.988  -1.680
  262   1HZ   LYS  28          1HZ       LYS  28  12.805  -7.844  -3.451
  263   2HZ   LYS  28          2HZ       LYS  28  11.241  -7.319  -3.458
  264   3HZ   LYS  28          3HZ       LYS  28  12.441  -6.342  -4.029
  265    H    VAL  29           H        VAL  29  13.549  -2.023   3.393
  266    HA   VAL  29           HA       VAL  29  16.044  -2.927   4.524
  267    HB   VAL  29           HB       VAL  29  15.135  -1.558   6.521
  268   1HG1  VAL  29          1HG1      VAL  29  15.255  -0.144   3.828
  269   2HG1  VAL  29          2HG1      VAL  29  15.709   0.510   5.420
  270   3HG1  VAL  29          3HG1      VAL  29  16.694  -0.769   4.669
  271   1HG2  VAL  29          1HG2      VAL  29  13.212  -0.306   4.629
  272   2HG2  VAL  29          2HG2      VAL  29  12.731  -1.899   5.259
  273   3HG2  VAL  29          3HG2      VAL  29  13.081  -0.565   6.385
  274    H    GLN  30           H        GLN  30  15.284  -5.293   4.326
  275    HA   GLN  30           HA       GLN  30  14.784  -7.228   5.442
  276   1HB   GLN  30          1HB       GLN  30  15.626  -5.420   7.428
  277   2HB   GLN  30          2HB       GLN  30  14.129  -6.144   8.063
  278   1HG   GLN  30          1HG       GLN  30  16.369  -7.793   6.840
  279   2HG   GLN  30          2HG       GLN  30  16.292  -7.411   8.574
  280   1HE2  GLN  30          1HE2      GLN  30  14.699  -9.102   5.881
  281   2HE2  GLN  30          2HE2      GLN  30  13.712 -10.156   6.871
  282    H    ARG  31           H        ARG  31  12.872  -7.670   4.343
  283    HA   ARG  31           HA       ARG  31  10.387  -6.392   4.870
  284   1HB   ARG  31          1HB       ARG  31   9.462  -8.480   3.742
  285   2HB   ARG  31          2HB       ARG  31  10.687  -7.582   2.813
  286   1HG   ARG  31          1HG       ARG  31  12.064  -9.439   4.507
  287   2HG   ARG  31          2HG       ARG  31  10.758 -10.323   3.682
  288   1HD   ARG  31          1HD       ARG  31  11.633  -9.933   1.578
  289   2HD   ARG  31          2HD       ARG  31  12.392  -8.401   2.060
  290    HE   ARG  31           HE       ARG  31  13.742 -10.385   3.482
  291   1HH1  ARG  31          2HH2      ARG  31  13.091  -9.588   0.099
  292   2HH1  ARG  31          1HH2      ARG  31  14.580 -10.287  -0.495
  293   1HH2  ARG  31          2HH1      ARG  31  15.710 -11.308   2.697
  294   2HH2  ARG  31          1HH1      ARG  31  16.074 -11.267   0.986
  295    H    GLY  32           H        GLY  32  12.144  -8.999   6.461
  296   1HA   GLY  32          1HA       GLY  32   9.992 -10.236   7.825
  297   2HA   GLY  32          2HA       GLY  32  11.686 -10.198   8.364
  Start of MODEL   10
    1    HA   PRO   1           HA       PRO   1 -10.877   6.868  -9.076
    2   1HB   PRO   1          1HB       PRO   1 -11.133   5.745  -6.607
    3   2HB   PRO   1          2HB       PRO   1 -10.307   4.893  -7.952
    4   1HG   PRO   1          1HG       PRO   1  -9.023   6.547  -5.759
    5   2HG   PRO   1          2HG       PRO   1  -8.600   4.874  -6.249
    6   1HD   PRO   1          1HD       PRO   1  -7.233   7.026  -7.214
    7   2HD   PRO   1          2HD       PRO   1  -7.625   5.646  -8.284
    8    HA   PRO   2           HA       PRO   2 -12.272  10.538  -7.048
    9   1HB   PRO   2          1HB       PRO   2 -14.965  10.136  -7.159
   10   2HB   PRO   2          2HB       PRO   2 -13.985  10.388  -8.640
   11   1HG   PRO   2          1HG       PRO   2 -14.838   7.743  -7.428
   12   2HG   PRO   2          2HG       PRO   2 -15.057   8.284  -9.125
   13   1HD   PRO   2          1HD       PRO   2 -12.942   6.728  -8.391
   14   2HD   PRO   2          2HD       PRO   2 -12.724   8.059  -9.567
   15    H    LEU   3           H        LEU   3 -11.336  10.069  -4.967
   16    HA   LEU   3           HA       LEU   3 -11.525   9.841  -2.693
   17   1HB   LEU   3          1HB       LEU   3 -13.536  10.805  -2.266
   18   2HB   LEU   3          2HB       LEU   3 -14.343   9.943  -3.597
   19    HG   LEU   3           HG       LEU   3 -14.233   7.843  -2.176
   20   1HD1  LEU   3          1HD1      LEU   3 -12.375   8.859  -0.709
   21   2HD1  LEU   3          2HD1      LEU   3 -13.669   9.776   0.099
   22   3HD1  LEU   3          3HD1      LEU   3 -13.680   7.997   0.140
   23   1HD2  LEU   3          1HD2      LEU   3 -15.849   9.249  -0.361
   24   2HD2  LEU   3          2HD2      LEU   3 -15.908  10.221  -1.851
   25   3HD2  LEU   3          3HD2      LEU   3 -16.376   8.504  -1.889
   26    H    SER   4           H        SER   4 -10.925   8.153  -1.426
   27    HA   SER   4           HA       SER   4 -12.162   5.552  -1.638
   28   1HB   SER   4          1HB       SER   4 -10.920   4.828  -3.388
   29   2HB   SER   4          2HB       SER   4  -9.771   6.181  -3.252
   30    HG   SER   4           HG       SER   4  -9.102   3.883  -2.697
   31    H    GLN   5           H        GLN   5 -12.396   5.658   0.586
   32    HA   GLN   5           HA       GLN   5 -10.565   4.589   2.274
   33   1HB   GLN   5          1HB       GLN   5  -8.850   6.143   1.981
   34   2HB   GLN   5          2HB       GLN   5  -9.977   7.510   1.812
   35   1HG   GLN   5          1HG       GLN   5 -10.378   7.630   4.123
   36   2HG   GLN   5          2HG       GLN   5  -9.837   5.960   4.402
   37   1HE2  GLN   5          1HE2      GLN   5  -9.022   9.039   5.072
   38   2HE2  GLN   5          2HE2      GLN   5  -7.275   8.928   5.071
   39    H    GLU   6           H        GLU   6 -13.038   7.006   1.705
   40    HA   GLU   6           HA       GLU   6 -14.135   6.406   4.411
   41   1HB   GLU   6          1HB       GLU   6 -15.153   8.752   4.218
   42   2HB   GLU   6          2HB       GLU   6 -13.401   8.668   4.522
   43   1HG   GLU   6          1HG       GLU   6 -13.029   8.870   2.040
   44   2HG   GLU   6          2HG       GLU   6 -14.777   9.128   1.845
   45    H    THR   7           H        THR   7 -14.860   4.659   2.569
   46    HA   THR   7           HA       THR   7 -17.639   4.867   2.385
   47    HB   THR   7           HB       THR   7 -16.288   6.451   0.388
   48    HG1  THR   7           1HG      THR   7 -18.982   5.719   0.903
   49   1HG2  THR   7          1HG2      THR   7 -17.267   3.809  -0.486
   50   2HG2  THR   7          2HG2      THR   7 -18.013   5.165  -1.364
   51   3HG2  THR   7          3HG2      THR   7 -16.242   4.984  -1.344
   52    H    PHE   8           H        PHE   8 -15.506   3.981  -0.353
   53    HA   PHE   8           HA       PHE   8 -16.403   1.189  -0.042
   54   1HB   PHE   8          1HB       PHE   8 -14.715   1.335  -2.236
   55   2HB   PHE   8          2HB       PHE   8 -16.484   1.429  -2.266
   56    HD1  PHE   8           1HD      PHE   8 -13.943   3.925  -1.092
   57    HD2  PHE   8           2HD      PHE   8 -17.029   2.974  -3.925
   58    HE1  PHE   8           1HE      PHE   8 -13.806   6.224  -2.013
   59    HE2  PHE   8           2HE      PHE   8 -16.892   5.273  -4.845
   60    HZ   PHE   8           HZ       PHE   8 -15.281   6.898  -3.889
   61    H    SER   9           H        SER   9 -13.812   3.201   0.888
   62    HA   SER   9           HA       SER   9 -11.434   2.177   0.683
   63   1HB   SER   9          1HB       SER   9 -12.372   3.636   2.600
   64   2HB   SER   9          2HB       SER   9 -12.598   2.104   3.478
   65    HG   SER   9           HG       SER   9 -10.146   2.449   2.241
   66    H    ASP  10           H        ASP  10 -14.107   0.320   2.151
   67    HA   ASP  10           HA       ASP  10 -12.883  -1.886   3.176
   68   1HB   ASP  10          1HB       ASP  10 -14.893  -3.050   1.703
   69   2HB   ASP  10          2HB       ASP  10 -15.112  -2.246   3.272
   70    H    LEU  11           H        LEU  11 -13.408  -1.208  -0.312
   71    HA   LEU  11           HA       LEU  11 -12.253  -3.664  -1.221
   72   1HB   LEU  11          1HB       LEU  11 -11.912  -2.002  -3.322
   73   2HB   LEU  11          2HB       LEU  11 -13.490  -2.707  -2.896
   74    HG   LEU  11           HG       LEU  11 -13.400  -0.149  -3.280
   75   1HD1  LEU  11          1HD1      LEU  11 -14.551  -0.147  -0.684
   76   2HD1  LEU  11          2HD1      LEU  11 -15.384  -0.392  -2.238
   77   3HD1  LEU  11          3HD1      LEU  11 -14.774  -1.793  -1.325
   78   1HD2  LEU  11          1HD2      LEU  11 -12.752   1.067  -1.124
   79   2HD2  LEU  11          2HD2      LEU  11 -11.949  -0.440  -0.623
   80   3HD2  LEU  11          3HD2      LEU  11 -11.399   0.419  -2.081
   81    H    TRP  12           H        TRP  12 -10.735  -1.002  -2.753
   82    HA   TRP  12           HA       TRP  12  -8.353  -1.142  -3.133
   83   1HB   TRP  12          1HB       TRP  12  -8.474   0.335  -0.522
   84   2HB   TRP  12          2HB       TRP  12  -7.601   0.744  -2.005
   85    HD1  TRP  12           HD       TRP  12 -10.128   2.177  -0.087
   86    HE1  TRP  12           1HE      TRP  12 -11.860   3.497  -1.406
   87    HE3  TRP  12           3HE      TRP  12  -9.209   0.279  -4.750
   88    HZ2  TRP  12           2HZ      TRP  12 -12.749   3.711  -4.152
   89    HZ3  TRP  12           3HZ      TRP  12 -10.517   1.064  -6.690
   90    HH2  TRP  12           HH       TRP  12 -12.286   2.775  -6.409
   91    H    LYS  13           H        LYS  13  -9.411  -2.108   0.136
   92    HA   LYS  13           HA       LYS  13  -6.997  -2.863   1.271
   93   1HB   LYS  13          1HB       LYS  13  -9.417  -2.961   2.194
   94   2HB   LYS  13          2HB       LYS  13  -9.478  -4.586   1.470
   95   1HG   LYS  13          1HG       LYS  13  -7.131  -4.843   2.717
   96   2HG   LYS  13          2HG       LYS  13  -7.809  -3.566   3.754
   97   1HD   LYS  13          1HD       LYS  13  -9.807  -5.611   3.197
   98   2HD   LYS  13          2HD       LYS  13  -8.341  -6.336   3.901
   99   1HE   LYS  13          1HE       LYS  13  -9.493  -5.724   5.826
  100   2HE   LYS  13          2HE       LYS  13  -8.490  -4.281   5.559
  101   1HZ   LYS  13          1HZ       LYS  13 -11.268  -4.595   4.665
  102   2HZ   LYS  13          2HZ       LYS  13 -10.787  -3.755   6.000
  103   3HZ   LYS  13          3HZ       LYS  13 -10.335  -3.245   4.499
  104    H    LEU  14           H        LEU  14  -8.238  -3.933  -1.675
  105    HA   LEU  14           HA       LEU  14  -7.137  -6.647  -1.507
  106   1HB   LEU  14          1HB       LEU  14  -7.821  -6.632  -3.975
  107   2HB   LEU  14          2HB       LEU  14  -9.135  -6.443  -2.790
  108    HG   LEU  14           HG       LEU  14  -9.211  -4.819  -4.749
  109   1HD1  LEU  14          1HD1      LEU  14 -10.396  -3.541  -3.319
  110   2HD1  LEU  14          2HD1      LEU  14  -9.646  -4.423  -1.967
  111   3HD1  LEU  14          3HD1      LEU  14  -8.899  -2.927  -2.577
  112   1HD2  LEU  14          1HD2      LEU  14  -6.508  -4.554  -4.215
  113   2HD2  LEU  14          2HD2      LEU  14  -7.473  -3.426  -5.198
  114   3HD2  LEU  14          3HD2      LEU  14  -7.187  -3.086  -3.474
  115    H    LEU  15           H        LEU  15  -6.377  -3.473  -2.958
  116    HA   LEU  15           HA       LEU  15  -4.153  -4.366  -4.509
  117   1HB   LEU  15          1HB       LEU  15  -3.964  -2.164  -5.070
  118   2HB   LEU  15          2HB       LEU  15  -5.567  -2.052  -4.305
  119    HG   LEU  15           HG       LEU  15  -4.499  -0.405  -3.096
  120   1HD1  LEU  15          1HD1      LEU  15  -4.366  -1.232  -0.975
  121   2HD1  LEU  15          2HD1      LEU  15  -4.830  -2.772  -1.737
  122   3HD1  LEU  15          3HD1      LEU  15  -3.115  -2.421  -1.415
  123   1HD2  LEU  15          1HD2      LEU  15  -1.989  -2.000  -3.686
  124   2HD2  LEU  15          2HD2      LEU  15  -2.398  -0.342  -4.188
  125   3HD2  LEU  15          3HD2      LEU  15  -1.987  -0.682  -2.489
  126    H    LYS  16           H        LYS  16  -4.631  -4.159  -1.139
  127    HA   LYS  16           HA       LYS  16  -2.170  -3.269  -0.155
  128   1HB   LYS  16          1HB       LYS  16  -3.478  -3.705   1.637
  129   2HB   LYS  16          2HB       LYS  16  -4.408  -4.947   0.766
  130   1HG   LYS  16          1HG       LYS  16  -1.558  -5.487   1.630
  131   2HG   LYS  16          2HG       LYS  16  -2.902  -5.681   2.780
  132   1HD   LYS  16          1HD       LYS  16  -2.521  -7.099   0.114
  133   2HD   LYS  16          2HD       LYS  16  -2.550  -7.827   1.738
  134   1HE   LYS  16          1HE       LYS  16  -4.948  -6.556   1.758
  135   2HE   LYS  16          2HE       LYS  16  -4.800  -6.888   0.019
  136   1HZ   LYS  16          1HZ       LYS  16  -4.756  -9.119   0.392
  137   2HZ   LYS  16          2HZ       LYS  16  -4.296  -8.989   1.971
  138   3HZ   LYS  16          3HZ       LYS  16  -5.842  -8.619   1.529
  139    H    LYS  17           H        LYS  17  -3.128  -6.543  -1.288
  140    HA   LYS  17           HA       LYS  17  -0.755  -7.894  -0.659
  141   1HB   LYS  17          1HB       LYS  17  -2.454  -9.291  -1.384
  142   2HB   LYS  17          2HB       LYS  17  -2.924  -8.208  -2.715
  143   1HG   LYS  17          1HG       LYS  17  -1.748  -9.598  -4.065
  144   2HG   LYS  17          2HG       LYS  17  -0.290  -8.885  -3.334
  145   1HD   LYS  17          1HD       LYS  17  -0.238 -11.355  -3.189
  146   2HD   LYS  17          2HD       LYS  17  -0.328 -10.623  -1.569
  147   1HE   LYS  17          1HE       LYS  17  -3.005 -10.901  -2.383
  148   2HE   LYS  17          2HE       LYS  17  -2.215 -12.402  -2.913
  149   1HZ   LYS  17          1HZ       LYS  17  -1.561 -11.500  -0.270
  150   2HZ   LYS  17          2HZ       LYS  17  -3.116 -12.005  -0.482
  151   3HZ   LYS  17          3HZ       LYS  17  -1.864 -13.022  -0.828
  152    H    TRP  18           H        TRP  18  -1.491  -5.607  -3.252
  153    HA   TRP  18           HA       TRP  18   1.172  -6.134  -4.456
  154   1HB   TRP  18          1HB       TRP  18  -0.037  -4.276  -6.047
  155   2HB   TRP  18          2HB       TRP  18  -0.112  -6.026  -6.294
  156    HD1  TRP  18           HD       TRP  18  -2.271  -3.138  -6.137
  157    HE1  TRP  18           1HE      TRP  18  -4.712  -3.743  -5.736
  158    HE3  TRP  18           3HE      TRP  18  -1.661  -7.984  -4.605
  159    HZ2  TRP  18           2HZ      TRP  18  -6.227  -6.046  -4.856
  160    HZ3  TRP  18           3HZ      TRP  18  -3.623  -9.349  -3.994
  161    HH2  TRP  18           HH       TRP  18  -5.908  -8.398  -4.114
  162    H    LYS  19           H        LYS  19  -0.507  -4.036  -2.322
  163    HA   LYS  19           HA       LYS  19   1.227  -1.728  -2.906
  164   1HB   LYS  19          1HB       LYS  19  -1.341  -1.805  -2.186
  165   2HB   LYS  19          2HB       LYS  19  -0.632  -1.849  -0.554
  166   1HG   LYS  19          1HG       LYS  19   0.773   0.154  -1.200
  167   2HG   LYS  19          2HG       LYS  19  -0.159   0.245  -2.714
  168   1HD   LYS  19          1HD       LYS  19  -2.230   0.143  -1.034
  169   2HD   LYS  19          2HD       LYS  19  -1.033   0.794   0.110
  170   1HE   LYS  19          1HE       LYS  19  -0.744   2.762  -1.100
  171   2HE   LYS  19          2HE       LYS  19  -1.248   2.017  -2.632
  172   1HZ   LYS  19          1HZ       LYS  19  -3.033   3.264  -2.085
  173   2HZ   LYS  19          2HZ       LYS  19  -3.476   1.825  -1.413
  174   3HZ   LYS  19          3HZ       LYS  19  -2.883   3.033  -0.459
  175    H    MET  20           H        MET  20   1.502  -4.618  -1.255
  176    HA   MET  20           HA       MET  20   2.558  -3.917   1.254
  177   1HB   MET  20          1HB       MET  20   2.175  -6.240  -0.212
  178   2HB   MET  20          2HB       MET  20   3.948  -6.135  -0.090
  179   1HG   MET  20          1HG       MET  20   3.087  -7.349   1.829
  180   2HG   MET  20          2HG       MET  20   3.735  -5.787   2.358
  181   1HE   MET  20          1HE       MET  20   0.121  -7.954   2.608
  182   2HE   MET  20          2HE       MET  20  -0.605  -6.744   1.523
  183   3HE   MET  20          3HE       MET  20   0.859  -7.623   1.023
  184    H    ARG  21           H        ARG  21   4.811  -3.869   1.971
  185    HA   ARG  21           HA       ARG  21   6.989  -3.160   1.849
  186   1HB   ARG  21          1HB       ARG  21   6.848  -4.739  -0.275
  187   2HB   ARG  21          2HB       ARG  21   6.950  -3.197  -1.158
  188   1HG   ARG  21          1HG       ARG  21   9.082  -2.717  -0.349
  189   2HG   ARG  21          2HG       ARG  21   8.864  -3.710   1.112
  190   1HD   ARG  21          1HD       ARG  21   9.415  -5.667   0.034
  191   2HD   ARG  21          2HD       ARG  21   8.755  -5.121  -1.523
  192    HE   ARG  21           HE       ARG  21  11.149  -3.685  -0.661
  193   1HH1  ARG  21          2HH2      ARG  21   9.830  -6.473  -2.390
  194   2HH1  ARG  21          1HH2      ARG  21  11.248  -6.697  -3.389
  195   1HH2  ARG  21          2HH1      ARG  21  13.023  -3.982  -1.981
  196   2HH2  ARG  21          1HH1      ARG  21  13.069  -5.277  -3.156
  197    H    ARG  22           H        ARG  22   4.316  -1.563   0.840
  198    HA   ARG  22           HA       ARG  22   5.675   0.816  -0.230
  199   1HB   ARG  22          1HB       ARG  22   2.768   0.118   0.324
  200   2HB   ARG  22          2HB       ARG  22   3.307   1.695  -0.303
  201   1HG   ARG  22          1HG       ARG  22   4.058  -0.932  -1.634
  202   2HG   ARG  22          2HG       ARG  22   2.580  -0.036  -2.057
  203   1HD   ARG  22          1HD       ARG  22   3.858   1.158  -3.483
  204   2HD   ARG  22          2HD       ARG  22   4.571   1.924  -2.047
  205    HE   ARG  22           HE       ARG  22   5.900  -0.546  -2.533
  206   1HH1  ARG  22          2HH2      ARG  22   5.501   2.689  -3.902
  207   2HH1  ARG  22          1HH2      ARG  22   7.077   2.711  -4.662
  208   1HH2  ARG  22          2HH1      ARG  22   7.982  -0.517  -3.536
  209   2HH2  ARG  22          1HH1      ARG  22   8.491   0.883  -4.452
  210    H    ASN  23           H        ASN  23   6.920   0.753   1.970
  211    HA   ASN  23           HA       ASN  23   5.391   2.473   3.865
  212   1HB   ASN  23          1HB       ASN  23   5.853   0.063   4.624
  213   2HB   ASN  23          2HB       ASN  23   7.568   0.524   4.668
  214   1HD2  ASN  23          1HD2      ASN  23   5.883  -0.290   6.924
  215   2HD2  ASN  23          2HD2      ASN  23   5.849   1.061   8.037
  216    H    GLN  24           H        GLN  24   8.296   2.137   5.232
  217    HA   GLN  24           HA       GLN  24   9.365   4.528   3.828
  218   1HB   GLN  24          1HB       GLN  24   9.602   3.435   6.640
  219   2HB   GLN  24          2HB       GLN  24  10.768   4.624   6.011
  220   1HG   GLN  24          1HG       GLN  24   8.110   5.479   5.311
  221   2HG   GLN  24          2HG       GLN  24   8.141   5.094   7.045
  222   1HE2  GLN  24          1HE2      GLN  24   8.384   7.619   5.024
  223   2HE2  GLN  24          2HE2      GLN  24   9.548   8.617   5.868
  224    H    PHE  25           H        PHE  25  11.509   2.859   5.932
  225    HA   PHE  25           HA       PHE  25  13.543   2.529   4.072
  226   1HB   PHE  25          1HB       PHE  25  13.366   0.413   6.127
  227   2HB   PHE  25          2HB       PHE  25  14.663   1.572   5.791
  228    HD1  PHE  25           1HD      PHE  25  11.175   1.470   7.188
  229    HD2  PHE  25           2HD      PHE  25  15.080   3.254   7.333
  230    HE1  PHE  25           1HE      PHE  25  10.491   2.807   9.162
  231    HE2  PHE  25           2HE      PHE  25  14.396   4.591   9.306
  232    HZ   PHE  25           HZ       PHE  25  12.102   4.368  10.220
  233    H    TRP  26           H        TRP  26  10.907   0.264   4.944
  234    HA   TRP  26           HA       TRP  26  11.728  -2.024   3.624
  235   1HB   TRP  26          1HB       TRP  26   8.956  -0.795   3.705
  236   2HB   TRP  26          2HB       TRP  26   9.315  -2.477   3.290
  237    HD1  TRP  26           HD       TRP  26   9.758  -4.149   5.221
  238    HE1  TRP  26           1HE      TRP  26   9.524  -4.068   7.756
  239    HE3  TRP  26           3HE      TRP  26   9.228   0.906   5.823
  240    HZ2  TRP  26           2HZ      TRP  26   9.150  -2.060   9.806
  241    HZ3  TRP  26           3HZ      TRP  26   8.936   1.864   8.078
  242    HH2  TRP  26           HH       TRP  26   8.894   0.399  10.075
  243    H    VAL  27           H        VAL  27  10.661   1.048   2.266
  244    HA   VAL  27           HA       VAL  27  10.378  -0.067  -0.428
  245    HB   VAL  27           HB       VAL  27   9.649   2.366   0.993
  246   1HG1  VAL  27          1HG1      VAL  27  10.113   3.985  -0.741
  247   2HG1  VAL  27          2HG1      VAL  27  11.654   3.198  -0.322
  248   3HG1  VAL  27          3HG1      VAL  27  10.790   2.729  -1.806
  249   1HG2  VAL  27          1HG2      VAL  27   7.772   1.948  -0.190
  250   2HG2  VAL  27          2HG2      VAL  27   8.653   2.072  -1.732
  251   3HG2  VAL  27          3HG2      VAL  27   8.595   0.520  -0.862
  252    H    LYS  28           H        LYS  28  12.991   0.134   1.347
  253    HA   LYS  28           HA       LYS  28  14.751   0.530  -0.901
  254   1HB   LYS  28          1HB       LYS  28  14.067   2.905   0.031
  255   2HB   LYS  28          2HB       LYS  28  15.225   2.504   1.322
  256   1HG   LYS  28          1HG       LYS  28  16.116   1.956  -1.475
  257   2HG   LYS  28          2HG       LYS  28  15.963   3.669  -1.016
  258   1HD   LYS  28          1HD       LYS  28  17.203   2.482   1.197
  259   2HD   LYS  28          2HD       LYS  28  17.968   1.692  -0.203
  260   1HE   LYS  28          1HE       LYS  28  17.585   4.606  -0.518
  261   2HE   LYS  28          2HE       LYS  28  18.678   4.160   0.810
  262   1HZ   LYS  28          1HZ       LYS  28  20.196   3.517  -0.618
  263   2HZ   LYS  28          2HZ       LYS  28  19.134   2.681  -1.564
  264   3HZ   LYS  28          3HZ       LYS  28  19.333   4.304  -1.783
  265    H    VAL  29           H        VAL  29  14.325  -1.667   0.689
  266    HA   VAL  29           HA       VAL  29  16.391  -1.666   2.787
  267    HB   VAL  29           HB       VAL  29  15.554  -4.118   2.950
  268   1HG1  VAL  29          1HG1      VAL  29  14.916  -2.533   4.627
  269   2HG1  VAL  29          2HG1      VAL  29  13.851  -1.661   3.498
  270   3HG1  VAL  29          3HG1      VAL  29  13.401  -3.285   4.072
  271   1HG2  VAL  29          1HG2      VAL  29  13.559  -4.695   1.844
  272   2HG2  VAL  29          2HG2      VAL  29  13.153  -2.999   1.489
  273   3HG2  VAL  29          3HG2      VAL  29  14.458  -3.809   0.589
  274    H    GLN  30           H        GLN  30  18.028  -1.164   1.009
  275    HA   GLN  30           HA       GLN  30  19.159  -3.740   0.109
  276   1HB   GLN  30          1HB       GLN  30  17.699  -2.480  -1.701
  277   2HB   GLN  30          2HB       GLN  30  19.133  -1.433  -1.824
  278   1HG   GLN  30          1HG       GLN  30  20.293  -3.916  -1.811
  279   2HG   GLN  30          2HG       GLN  30  18.761  -4.263  -2.642
  280   1HE2  GLN  30          1HE2      GLN  30  20.242  -4.717  -4.501
  281   2HE2  GLN  30          2HE2      GLN  30  20.738  -3.374  -5.508
  282    H    ARG  31           H        ARG  31  20.137  -2.571   2.272
  283    HA   ARG  31           HA       ARG  31  21.810  -0.429   2.267
  284   1HB   ARG  31          1HB       ARG  31  21.496  -2.760   3.799
  285   2HB   ARG  31          2HB       ARG  31  23.217  -2.745   3.347
  286   1HG   ARG  31          1HG       ARG  31  22.326  -0.069   4.062
  287   2HG   ARG  31          2HG       ARG  31  21.973  -1.217   5.376
  288   1HD   ARG  31          1HD       ARG  31  24.240  -1.862   5.579
  289   2HD   ARG  31          2HD       ARG  31  24.664  -1.200   3.986
  290    HE   ARG  31           HE       ARG  31  23.857   1.023   5.344
  291   1HH1  ARG  31          2HH2      ARG  31  26.093  -1.611   6.092
  292   2HH1  ARG  31          1HH2      ARG  31  27.138  -0.624   7.088
  293   1HH2  ARG  31          2HH1      ARG  31  25.237   2.327   6.661
  294   2HH2  ARG  31          1HH1      ARG  31  26.650   1.622   7.413
  295    H    GLY  32           H        GLY  32  22.877  -3.725   1.224
  296   1HA   GLY  32          1HA       GLY  32  25.399  -3.252   0.353
  297   2HA   GLY  32          2HA       GLY  32  24.267  -4.283  -0.552
  Start of MODEL   11
    1    HA   PRO   1           HA       PRO   1 -16.466  11.679  -7.865
    2   1HB   PRO   1          1HB       PRO   1 -13.948  11.564  -8.898
    3   2HB   PRO   1          2HB       PRO   1 -15.332  12.199  -9.848
    4   1HG   PRO   1          1HG       PRO   1 -13.318  13.797  -8.241
    5   2HG   PRO   1          2HG       PRO   1 -13.787  14.047  -9.954
    6   1HD   PRO   1          1HD       PRO   1 -14.940  15.478  -7.941
    7   2HD   PRO   1          2HD       PRO   1 -15.925  14.888  -9.314
    8    HA   PRO   2           HA       PRO   2 -14.497  11.272  -3.846
    9   1HB   PRO   2          1HB       PRO   2 -15.450   8.781  -3.287
   10   2HB   PRO   2          2HB       PRO   2 -16.514  10.225  -3.277
   11   1HG   PRO   2          1HG       PRO   2 -16.103   8.262  -5.550
   12   2HG   PRO   2          2HG       PRO   2 -17.662   8.794  -4.840
   13   1HD   PRO   2          1HD       PRO   2 -16.646   9.969  -7.079
   14   2HD   PRO   2          2HD       PRO   2 -17.446  10.957  -5.819
   15    H    LEU   3           H        LEU   3 -13.577   8.754  -3.023
   16    HA   LEU   3           HA       LEU   3 -12.196   7.171  -4.827
   17   1HB   LEU   3          1HB       LEU   3  -9.851   8.297  -4.502
   18   2HB   LEU   3          2HB       LEU   3 -10.941   8.904  -5.771
   19    HG   LEU   3           HG       LEU   3 -11.770  10.359  -3.582
   20   1HD1  LEU   3          1HD1      LEU   3  -9.079  11.095  -3.136
   21   2HD1  LEU   3          2HD1      LEU   3 -10.176  10.295  -1.985
   22   3HD1  LEU   3          3HD1      LEU   3  -9.107   9.319  -3.021
   23   1HD2  LEU   3          1HD2      LEU   3 -10.939  12.191  -4.770
   24   2HD2  LEU   3          2HD2      LEU   3  -9.446  11.341  -5.237
   25   3HD2  LEU   3          3HD2      LEU   3 -10.985  10.943  -6.039
   26    H    SER   4           H        SER   4 -12.194   5.502  -3.424
   27    HA   SER   4           HA       SER   4 -11.757   4.263  -1.550
   28   1HB   SER   4          1HB       SER   4  -9.422   5.554  -2.241
   29   2HB   SER   4          2HB       SER   4  -9.609   6.017  -0.533
   30    HG   SER   4           HG       SER   4  -9.215   4.039   0.027
   31    H    GLN   5           H        GLN   5 -13.370   4.371  -0.087
   32    HA   GLN   5           HA       GLN   5 -13.096   6.173   2.164
   33   1HB   GLN   5          1HB       GLN   5 -14.161   7.792   0.788
   34   2HB   GLN   5          2HB       GLN   5 -15.280   6.589   0.102
   35   1HG   GLN   5          1HG       GLN   5 -16.735   6.849   1.807
   36   2HG   GLN   5          2HG       GLN   5 -15.446   6.670   3.017
   37   1HE2  GLN   5          1HE2      GLN   5 -15.847   8.345   4.405
   38   2HE2  GLN   5          2HE2      GLN   5 -15.897  10.029   3.930
   39    H    GLU   6           H        GLU   6 -16.260   5.123   1.029
   40    HA   GLU   6           HA       GLU   6 -16.171   2.948   3.067
   41   1HB   GLU   6          1HB       GLU   6 -18.342   4.872   2.204
   42   2HB   GLU   6          2HB       GLU   6 -18.732   3.337   3.017
   43   1HG   GLU   6          1HG       GLU   6 -16.711   4.272   4.610
   44   2HG   GLU   6          2HG       GLU   6 -17.462   5.798   4.093
   45    H    THR   7           H        THR   7 -15.179   2.461   0.485
   46    HA   THR   7           HA       THR   7 -16.871   0.269  -0.295
   47    HB   THR   7           HB       THR   7 -17.020   2.856  -1.789
   48    HG1  THR   7           1HG      THR   7 -18.978   2.366  -1.264
   49   1HG2  THR   7          1HG2      THR   7 -16.376   1.960  -3.757
   50   2HG2  THR   7          2HG2      THR   7 -16.142   0.364  -3.003
   51   3HG2  THR   7          3HG2      THR   7 -17.744   0.827  -3.628
   52    H    PHE   8           H        PHE   8 -15.144   2.026  -2.783
   53    HA   PHE   8           HA       PHE   8 -13.455  -0.027  -3.520
   54   1HB   PHE   8          1HB       PHE   8 -11.910   2.176  -4.021
   55   2HB   PHE   8          2HB       PHE   8 -13.238   1.609  -5.049
   56    HD1  PHE   8           1HD      PHE   8 -13.533   3.244  -1.708
   57    HD2  PHE   8           2HD      PHE   8 -14.028   3.643  -5.956
   58    HE1  PHE   8           1HE      PHE   8 -14.718   5.396  -1.367
   59    HE2  PHE   8           2HE      PHE   8 -15.213   5.795  -5.616
   60    HZ   PHE   8           HZ       PHE   8 -15.557   6.672  -3.321
   61    H    SER   9           H        SER   9 -13.356   1.838  -0.618
   62    HA   SER   9           HA       SER   9 -10.515   1.518  -0.119
   63   1HB   SER   9          1HB       SER   9 -10.962   2.585   1.942
   64   2HB   SER   9          2HB       SER   9 -12.125   3.314   0.810
   65    HG   SER   9           HG       SER   9 -12.781   2.312   3.015
   66    H    ASP  10           H        ASP  10 -13.520  -0.227   0.646
   67    HA   ASP  10           HA       ASP  10 -12.565  -1.944   2.647
   68   1HB   ASP  10          1HB       ASP  10 -14.317  -3.307   0.770
   69   2HB   ASP  10          2HB       ASP  10 -14.634  -2.785   2.438
   70    H    LEU  11           H        LEU  11 -12.048  -1.946  -0.854
   71    HA   LEU  11           HA       LEU  11 -10.916  -4.627  -0.881
   72   1HB   LEU  11          1HB       LEU  11 -10.099  -3.357  -3.201
   73   2HB   LEU  11          2HB       LEU  11 -11.611  -4.276  -3.003
   74    HG   LEU  11           HG       LEU  11 -12.437  -2.237  -3.771
   75   1HD1  LEU  11          1HD1      LEU  11 -13.649  -1.367  -1.994
   76   2HD1  LEU  11          2HD1      LEU  11 -13.064  -2.876  -1.254
   77   3HD1  LEU  11          3HD1      LEU  11 -12.238  -1.337  -0.908
   78   1HD2  LEU  11          1HD2      LEU  11 -11.446  -0.078  -3.322
   79   2HD2  LEU  11          2HD2      LEU  11 -10.413  -0.759  -2.042
   80   3HD2  LEU  11          3HD2      LEU  11 -10.124  -1.192  -3.745
   81    H    TRP  12           H        TRP  12  -9.119  -2.234  -2.621
   82    HA   TRP  12           HA       TRP  12  -6.699  -2.381  -2.497
   83   1HB   TRP  12          1HB       TRP  12  -7.314  -0.403  -0.330
   84   2HB   TRP  12          2HB       TRP  12  -6.197  -0.269  -1.696
   85    HD1  TRP  12           HD       TRP  12  -8.914   1.531  -0.617
   86    HE1  TRP  12           1HE      TRP  12 -10.440   2.434  -2.445
   87    HE3  TRP  12           3HE      TRP  12  -7.463  -1.523  -4.460
   88    HZ2  TRP  12           2HZ      TRP  12 -10.976   1.902  -5.239
   89    HZ3  TRP  12           3HZ      TRP  12  -8.503  -1.295  -6.687
   90    HH2  TRP  12           HH       TRP  12 -10.256   0.407  -7.092
   91    H    LYS  13           H        LYS  13  -8.405  -2.698   0.622
   92    HA   LYS  13           HA       LYS  13  -6.255  -3.108   2.338
   93   1HB   LYS  13          1HB       LYS  13  -8.582  -2.988   3.086
   94   2HB   LYS  13          2HB       LYS  13  -8.950  -4.523   2.264
   95   1HG   LYS  13          1HG       LYS  13  -7.420  -5.733   3.714
   96   2HG   LYS  13          2HG       LYS  13  -6.847  -4.216   4.447
   97   1HD   LYS  13          1HD       LYS  13  -8.547  -4.246   5.928
   98   2HD   LYS  13          2HD       LYS  13  -9.736  -4.343   4.607
   99   1HE   LYS  13          1HE       LYS  13  -9.963  -6.604   4.802
  100   2HE   LYS  13          2HE       LYS  13  -8.237  -6.849   5.145
  101   1HZ   LYS  13          1HZ       LYS  13 -10.419  -6.390   6.952
  102   2HZ   LYS  13          2HZ       LYS  13  -9.035  -7.263   7.157
  103   3HZ   LYS  13          3HZ       LYS  13  -9.009  -5.623   7.328
  104    H    LEU  14           H        LEU  14  -6.963  -4.839  -0.477
  105    HA   LEU  14           HA       LEU  14  -5.894  -7.399   0.501
  106   1HB   LEU  14          1HB       LEU  14  -6.222  -8.010  -1.961
  107   2HB   LEU  14          2HB       LEU  14  -7.695  -7.593  -1.053
  108    HG   LEU  14           HG       LEU  14  -7.520  -6.497  -3.333
  109   1HD1  LEU  14          1HD1      LEU  14  -8.336  -5.453  -0.839
  110   2HD1  LEU  14          2HD1      LEU  14  -7.450  -4.131  -1.636
  111   3HD1  LEU  14          3HD1      LEU  14  -8.838  -4.890  -2.452
  112   1HD2  LEU  14          1HD2      LEU  14  -5.741  -5.198  -3.903
  113   2HD2  LEU  14          2HD2      LEU  14  -5.649  -4.457  -2.287
  114   3HD2  LEU  14          3HD2      LEU  14  -4.902  -6.046  -2.582
  115    H    LEU  15           H        LEU  15  -4.979  -4.633  -1.568
  116    HA   LEU  15           HA       LEU  15  -2.456  -5.838  -2.351
  117   1HB   LEU  15          1HB       LEU  15  -2.561  -4.211  -3.894
  118   2HB   LEU  15          2HB       LEU  15  -4.074  -3.643  -3.149
  119    HG   LEU  15           HG       LEU  15  -2.475  -2.480  -1.417
  120   1HD1  LEU  15          1HD1      LEU  15  -0.346  -3.307  -1.971
  121   2HD1  LEU  15          2HD1      LEU  15  -0.662  -3.223  -3.721
  122   3HD1  LEU  15          3HD1      LEU  15  -0.370  -1.730  -2.797
  123   1HD2  LEU  15          1HD2      LEU  15  -3.863  -1.157  -2.847
  124   2HD2  LEU  15          2HD2      LEU  15  -2.211  -0.536  -3.075
  125   3HD2  LEU  15          3HD2      LEU  15  -2.933  -1.614  -4.294
  126    H    LYS  16           H        LYS  16  -3.653  -4.341   0.474
  127    HA   LYS  16           HA       LYS  16  -1.675  -2.718   1.450
  128   1HB   LYS  16          1HB       LYS  16  -3.241  -2.957   3.071
  129   2HB   LYS  16          2HB       LYS  16  -3.612  -4.633   2.597
  130   1HG   LYS  16          1HG       LYS  16  -0.979  -3.991   3.934
  131   2HG   LYS  16          2HG       LYS  16  -2.453  -4.172   4.916
  132   1HD   LYS  16          1HD       LYS  16  -1.108  -6.216   3.123
  133   2HD   LYS  16          2HD       LYS  16  -1.534  -6.357   4.846
  134   1HE   LYS  16          1HE       LYS  16  -3.994  -5.951   3.934
  135   2HE   LYS  16          2HE       LYS  16  -3.297  -6.551   2.413
  136   1HZ   LYS  16          1HZ       LYS  16  -3.211  -7.951   4.992
  137   2HZ   LYS  16          2HZ       LYS  16  -4.231  -8.302   3.744
  138   3HZ   LYS  16          3HZ       LYS  16  -2.605  -8.510   3.563
  139    H    LYS  17           H        LYS  17  -1.664  -6.323   1.556
  140    HA   LYS  17           HA       LYS  17   0.791  -6.678   2.833
  141   1HB   LYS  17          1HB       LYS  17  -0.416  -8.637   2.518
  142   2HB   LYS  17          2HB       LYS  17  -0.809  -8.249   0.826
  143   1HG   LYS  17          1HG       LYS  17   0.882  -9.656   0.277
  144   2HG   LYS  17          2HG       LYS  17   1.972  -8.358   0.818
  145   1HD   LYS  17          1HD       LYS  17   1.807  -9.312   3.158
  146   2HD   LYS  17          2HD       LYS  17   0.919 -10.691   2.467
  147   1HE   LYS  17          1HE       LYS  17   3.159 -10.411   0.808
  148   2HE   LYS  17          2HE       LYS  17   3.790 -10.116   2.443
  149   1HZ   LYS  17          1HZ       LYS  17   2.583 -12.504   1.340
  150   2HZ   LYS  17          2HZ       LYS  17   3.895 -12.343   2.326
  151   3HZ   LYS  17          3HZ       LYS  17   2.373 -12.200   2.947
  152    H    TRP  18           H        TRP  18   0.075  -5.615  -0.448
  153    HA   TRP  18           HA       TRP  18   2.989  -5.703  -1.062
  154   1HB   TRP  18          1HB       TRP  18   1.826  -5.178  -3.436
  155   2HB   TRP  18          2HB       TRP  18   2.156  -6.812  -2.844
  156    HD1  TRP  18           HD       TRP  18  -0.528  -4.768  -4.223
  157    HE1  TRP  18           1HE      TRP  18  -2.816  -5.849  -3.941
  158    HE3  TRP  18           3HE      TRP  18   0.700  -8.374  -0.805
  159    HZ2  TRP  18           2HZ      TRP  18  -3.984  -8.016  -2.418
  160    HZ3  TRP  18           3HZ      TRP  18  -1.025  -9.925   0.037
  161    HH2  TRP  18           HH       TRP  18  -3.366  -9.760  -0.757
  162    H    LYS  19           H        LYS  19   0.395  -3.690  -0.161
  163    HA   LYS  19           HA       LYS  19   1.524  -1.322  -1.528
  164   1HB   LYS  19          1HB       LYS  19  -0.748  -1.095  -1.697
  165   2HB   LYS  19          2HB       LYS  19  -1.062  -2.060  -0.235
  166   1HG   LYS  19          1HG       LYS  19  -1.655   0.236   0.259
  167   2HG   LYS  19          2HG       LYS  19  -0.145  -0.131   1.128
  168   1HD   LYS  19          1HD       LYS  19   0.968   0.773  -1.116
  169   2HD   LYS  19          2HD       LYS  19  -0.593   1.611  -1.285
  170   1HE   LYS  19          1HE       LYS  19   0.821   1.698   1.369
  171   2HE   LYS  19          2HE       LYS  19   1.420   2.726   0.049
  172   1HZ   LYS  19          1HZ       LYS  19  -1.381   2.849   0.284
  173   2HZ   LYS  19          2HZ       LYS  19  -0.653   3.258   1.706
  174   3HZ   LYS  19          3HZ       LYS  19  -0.269   4.067   0.321
  175    H    MET  20           H        MET  20   2.060  -3.090   1.259
  176    HA   MET  20           HA       MET  20   2.374  -0.860   3.106
  177   1HB   MET  20          1HB       MET  20   1.788  -3.282   3.698
  178   2HB   MET  20          2HB       MET  20   3.494  -3.668   3.370
  179   1HG   MET  20          1HG       MET  20   4.270  -2.404   5.152
  180   2HG   MET  20          2HG       MET  20   2.850  -1.345   5.160
  181   1HE   MET  20          1HE       MET  20   0.581  -2.450   5.233
  182   2HE   MET  20          2HE       MET  20   0.429  -4.205   5.487
  183   3HE   MET  20          3HE       MET  20   0.118  -3.081   6.831
  184    H    ARG  21           H        ARG  21   4.522  -0.480   4.188
  185    HA   ARG  21           HA       ARG  21   6.726   0.128   4.078
  186   1HB   ARG  21          1HB       ARG  21   6.752  -2.425   3.258
  187   2HB   ARG  21          2HB       ARG  21   7.275  -1.659   1.739
  188   1HG   ARG  21          1HG       ARG  21   9.065  -0.459   2.974
  189   2HG   ARG  21          2HG       ARG  21   8.554  -1.262   4.478
  190   1HD   ARG  21          1HD       ARG  21   8.897  -3.236   2.394
  191   2HD   ARG  21          2HD       ARG  21  10.361  -2.235   2.505
  192    HE   ARG  21           HE       ARG  21  10.773  -3.070   4.649
  193   1HH1  ARG  21          2HH2      ARG  21   7.604  -4.078   3.447
  194   2HH1  ARG  21          1HH2      ARG  21   7.351  -5.265   4.707
  195   1HH2  ARG  21          2HH1      ARG  21  10.438  -4.637   6.314
  196   2HH2  ARG  21          1HH1      ARG  21   8.968  -5.583   6.342
  197    H    ARG  22           H        ARG  22   4.442   0.867   1.930
  198    HA   ARG  22           HA       ARG  22   6.163   2.063  -0.135
  199   1HB   ARG  22          1HB       ARG  22   3.249   1.536   0.265
  200   2HB   ARG  22          2HB       ARG  22   3.687   2.950  -0.724
  201   1HG   ARG  22          1HG       ARG  22   3.546   1.116  -2.253
  202   2HG   ARG  22          2HG       ARG  22   5.286   1.383  -1.986
  203   1HD   ARG  22          1HD       ARG  22   3.864  -0.504  -0.140
  204   2HD   ARG  22          2HD       ARG  22   4.173  -1.055  -1.801
  205    HE   ARG  22           HE       ARG  22   6.164  -0.520   0.298
  206   1HH1  ARG  22          2HH2      ARG  22   5.474  -1.115  -3.119
  207   2HH1  ARG  22          1HH2      ARG  22   7.098  -1.645  -3.495
  208   1HH2  ARG  22          2HH1      ARG  22   8.309  -1.220  -0.200
  209   2HH2  ARG  22          1HH1      ARG  22   8.714  -1.705  -1.831
  210    H    ASN  23           H        ASN  23   7.168   3.273   1.865
  211    HA   ASN  23           HA       ASN  23   5.580   5.738   2.381
  212   1HB   ASN  23          1HB       ASN  23   6.203   4.585   4.409
  213   2HB   ASN  23          2HB       ASN  23   7.888   4.434   3.866
  214   1HD2  ASN  23          1HD2      ASN  23   9.093   5.699   5.185
  215   2HD2  ASN  23          2HD2      ASN  23   8.747   7.373   5.564
  216    H    GLN  24           H        GLN  24   8.992   5.717   3.001
  217    HA   GLN  24           HA       GLN  24   9.378   7.501   0.645
  218   1HB   GLN  24          1HB       GLN  24  10.219   7.601   3.492
  219   2HB   GLN  24          2HB       GLN  24  11.473   8.043   2.308
  220   1HG   GLN  24          1HG       GLN  24   9.486   9.442   1.230
  221   2HG   GLN  24          2HG       GLN  24   8.825   9.354   2.877
  222   1HE2  GLN  24          1HE2      GLN  24   9.251  11.833   2.285
  223   2HE2  GLN  24          2HE2      GLN  24  10.764  12.462   2.903
  224    H    PHE  25           H        PHE  25  11.978   6.239   2.661
  225    HA   PHE  25           HA       PHE  25  13.197   5.034   0.290
  226   1HB   PHE  25          1HB       PHE  25  14.626   6.304   1.725
  227   2HB   PHE  25          2HB       PHE  25  14.061   5.440   3.165
  228    HD1  PHE  25           1HD      PHE  25  14.432   2.796   3.068
  229    HD2  PHE  25           2HD      PHE  25  16.665   5.693   0.816
  230    HE1  PHE  25           1HE      PHE  25  16.293   1.174   2.827
  231    HE2  PHE  25           2HE      PHE  25  18.526   4.071   0.575
  232    HZ   PHE  25           HZ       PHE  25  18.339   1.812   1.580
  233    H    TRP  26           H        TRP  26  11.090   4.064   2.808
  234    HA   TRP  26           HA       TRP  26  11.973   1.435   3.337
  235   1HB   TRP  26          1HB       TRP  26   9.071   2.214   3.098
  236   2HB   TRP  26          2HB       TRP  26   9.827   1.076   4.222
  237    HD1  TRP  26           HD       TRP  26   7.951   3.246   5.359
  238    HE1  TRP  26           1HE      TRP  26   8.779   5.056   6.947
  239    HE3  TRP  26           3HE      TRP  26  12.925   3.164   4.154
  240    HZ2  TRP  26           2HZ      TRP  26  11.292   6.324   7.622
  241    HZ3  TRP  26           3HZ      TRP  26  14.502   4.685   5.289
  242    HH2  TRP  26           HH       TRP  26  13.704   6.267   7.020
  243    H    VAL  27           H        VAL  27  10.847   2.853   0.428
  244    HA   VAL  27           HA       VAL  27   9.604   0.497  -0.698
  245    HB   VAL  27           HB       VAL  27  10.013   3.259  -1.393
  246   1HG1  VAL  27          1HG1      VAL  27  10.654   3.106  -3.703
  247   2HG1  VAL  27          2HG1      VAL  27  11.885   2.210  -2.783
  248   3HG1  VAL  27          3HG1      VAL  27  10.616   1.327  -3.664
  249   1HG2  VAL  27          1HG2      VAL  27   7.832   2.596  -1.643
  250   2HG2  VAL  27          2HG2      VAL  27   8.364   2.246  -3.305
  251   3HG2  VAL  27          3HG2      VAL  27   8.281   0.936  -2.102
  252    H    LYS  28           H        LYS  28  12.649   0.863   0.352
  253    HA   LYS  28           HA       LYS  28  13.682  -1.020  -1.672
  254   1HB   LYS  28          1HB       LYS  28  14.361   1.712  -1.708
  255   2HB   LYS  28          2HB       LYS  28  15.738   0.898  -0.926
  256   1HG   LYS  28          1HG       LYS  28  14.601  -0.473  -3.317
  257   2HG   LYS  28          2HG       LYS  28  15.433   1.069  -3.629
  258   1HD   LYS  28          1HD       LYS  28  16.864  -0.674  -1.725
  259   2HD   LYS  28          2HD       LYS  28  16.678  -1.393  -3.343
  260   1HE   LYS  28          1HE       LYS  28  17.340   1.342  -3.743
  261   2HE   LYS  28          2HE       LYS  28  18.440   0.738  -2.485
  262   1HZ   LYS  28          1HZ       LYS  28  18.750   0.390  -5.111
  263   2HZ   LYS  28          2HZ       LYS  28  19.472  -0.521  -3.942
  264   3HZ   LYS  28          3HZ       LYS  28  18.088  -1.052  -4.663
  265    H    VAL  29           H        VAL  29  12.892  -2.033   0.587
  266    HA   VAL  29           HA       VAL  29  15.202  -1.989   2.460
  267    HB   VAL  29           HB       VAL  29  12.359  -3.011   2.837
  268   1HG1  VAL  29          1HG1      VAL  29  13.333  -2.697   5.322
  269   2HG1  VAL  29          2HG1      VAL  29  13.539  -4.216   4.417
  270   3HG1  VAL  29          3HG1      VAL  29  14.866  -3.032   4.483
  271   1HG2  VAL  29          1HG2      VAL  29  13.623  -0.604   4.170
  272   2HG2  VAL  29          2HG2      VAL  29  12.839  -0.454   2.579
  273   3HG2  VAL  29          3HG2      VAL  29  11.898  -1.005   3.986
  274    H    GLN  30           H        GLN  30  15.096  -3.384  -0.183
  275    HA   GLN  30           HA       GLN  30  14.677  -6.186   0.313
  276   1HB   GLN  30          1HB       GLN  30  15.964  -4.523  -1.852
  277   2HB   GLN  30          2HB       GLN  30  16.156  -6.293  -1.848
  278   1HG   GLN  30          1HG       GLN  30  13.411  -5.744  -1.301
  279   2HG   GLN  30          2HG       GLN  30  13.882  -4.719  -2.674
  280   1HE2  GLN  30          1HE2      GLN  30  15.384  -5.964  -4.323
  281   2HE2  GLN  30          2HE2      GLN  30  14.803  -7.549  -4.787
  282    H    ARG  31           H        ARG  31  17.730  -4.375  -0.362
  283    HA   ARG  31           HA       ARG  31  19.163  -6.438   1.224
  284   1HB   ARG  31          1HB       ARG  31  20.030  -4.460  -0.911
  285   2HB   ARG  31          2HB       ARG  31  21.183  -5.396   0.070
  286   1HG   ARG  31          1HG       ARG  31  18.928  -6.658  -1.539
  287   2HG   ARG  31          2HG       ARG  31  20.586  -6.458  -2.156
  288   1HD   ARG  31          1HD       ARG  31  20.687  -7.600   0.493
  289   2HD   ARG  31          2HD       ARG  31  19.564  -8.549  -0.504
  290    HE   ARG  31           HE       ARG  31  22.428  -8.485  -0.724
  291   1HH1  ARG  31          2HH2      ARG  31  19.447  -8.657  -2.618
  292   2HH1  ARG  31          1HH2      ARG  31  20.181  -9.525  -3.948
  293   1HH2  ARG  31          2HH1      ARG  31  23.397  -9.632  -2.480
  294   2HH2  ARG  31          1HH1      ARG  31  22.433 -10.080  -3.869
  295    H    GLY  32           H        GLY  32  18.416  -5.466   3.254
  296   1HA   GLY  32          1HA       GLY  32  19.786  -4.331   5.000
  297   2HA   GLY  32          2HA       GLY  32  19.909  -2.956   3.880
  Start of MODEL   12
    1    HA   PRO   1           HA       PRO   1 -11.402  12.912  -6.013
    2   1HB   PRO   1          1HB       PRO   1 -10.466  10.552  -7.001
    3   2HB   PRO   1          2HB       PRO   1 -11.503  11.641  -7.978
    4   1HG   PRO   1          1HG       PRO   1  -8.476  11.482  -7.996
    5   2HG   PRO   1          2HG       PRO   1  -9.578  11.399  -9.409
    6   1HD   PRO   1          1HD       PRO   1  -8.393  13.738  -8.666
    7   2HD   PRO   1          2HD       PRO   1 -10.093  13.720  -9.227
    8    HA   PRO   2           HA       PRO   2  -8.562  12.115  -2.727
    9   1HB   PRO   2          1HB       PRO   2 -10.050  10.412  -1.207
   10   2HB   PRO   2          2HB       PRO   2 -10.524  12.125  -1.447
   11   1HG   PRO   2          1HG       PRO   2 -11.510   9.712  -2.994
   12   2HG   PRO   2          2HG       PRO   2 -12.505  10.970  -2.190
   13   1HD   PRO   2          1HD       PRO   2 -11.916  11.107  -4.848
   14   2HD   PRO   2          2HD       PRO   2 -11.913  12.586  -3.840
   15    H    LEU   3           H        LEU   3  -8.275   9.709  -1.341
   16    HA   LEU   3           HA       LEU   3  -7.817   7.580  -3.310
   17   1HB   LEU   3          1HB       LEU   3  -5.534   8.843  -1.741
   18   2HB   LEU   3          2HB       LEU   3  -5.421   7.414  -2.797
   19    HG   LEU   3           HG       LEU   3  -6.414  10.123  -3.764
   20   1HD1  LEU   3          1HD1      LEU   3  -3.865   9.693  -2.878
   21   2HD1  LEU   3          2HD1      LEU   3  -3.721   9.140  -4.564
   22   3HD1  LEU   3          3HD1      LEU   3  -4.275  10.796  -4.215
   23   1HD2  LEU   3          1HD2      LEU   3  -6.802   9.026  -5.695
   24   2HD2  LEU   3          2HD2      LEU   3  -5.139   8.391  -5.708
   25   3HD2  LEU   3          3HD2      LEU   3  -6.425   7.501  -4.857
   26    H    SER   4           H        SER   4  -8.670   5.851  -2.325
   27    HA   SER   4           HA       SER   4  -9.165   4.311  -0.707
   28   1HB   SER   4          1HB       SER   4  -6.494   4.891  -0.387
   29   2HB   SER   4          2HB       SER   4  -7.137   5.224   1.239
   30    HG   SER   4           HG       SER   4  -6.998   3.132   1.414
   31    H    GLN   5           H        GLN   5 -11.081   4.688   0.247
   32    HA   GLN   5           HA       GLN   5 -11.170   6.108   2.761
   33   1HB   GLN   5          1HB       GLN   5 -11.254   7.887   0.833
   34   2HB   GLN   5          2HB       GLN   5 -12.921   7.302   0.614
   35   1HG   GLN   5          1HG       GLN   5 -13.441   7.786   2.949
   36   2HG   GLN   5          2HG       GLN   5 -11.753   8.245   3.263
   37   1HE2  GLN   5          1HE2      GLN   5 -11.065  10.309   2.812
   38   2HE2  GLN   5          2HE2      GLN   5 -12.078  11.544   2.096
   39    H    GLU   6           H        GLU   6 -13.783   5.941   0.339
   40    HA   GLU   6           HA       GLU   6 -14.945   3.673   1.883
   41   1HB   GLU   6          1HB       GLU   6 -17.146   4.705   1.623
   42   2HB   GLU   6          2HB       GLU   6 -16.043   5.835   2.445
   43   1HG   GLU   6          1HG       GLU   6 -15.539   6.743   0.063
   44   2HG   GLU   6          2HG       GLU   6 -17.014   5.881  -0.425
   45    H    THR   7           H        THR   7 -13.326   3.331  -0.395
   46    HA   THR   7           HA       THR   7 -15.108   1.836  -2.062
   47    HB   THR   7           HB       THR   7 -14.462   4.622  -2.841
   48    HG1  THR   7           1HG      THR   7 -16.384   4.355  -3.863
   49   1HG2  THR   7          1HG2      THR   7 -13.524   2.322  -4.413
   50   2HG2  THR   7          2HG2      THR   7 -14.659   3.352  -5.318
   51   3HG2  THR   7          3HG2      THR   7 -13.180   4.056  -4.622
   52    H    PHE   8           H        PHE   8 -12.338   3.640  -3.350
   53    HA   PHE   8           HA       PHE   8 -10.953   1.414  -4.275
   54   1HB   PHE   8          1HB       PHE   8  -8.937   3.166  -3.688
   55   2HB   PHE   8          2HB       PHE   8  -9.958   3.241  -5.133
   56    HD1  PHE   8           1HD      PHE   8 -10.974   4.063  -1.640
   57    HD2  PHE   8           2HD      PHE   8 -10.003   5.569  -5.543
   58    HE1  PHE   8           1HE      PHE   8 -11.764   6.315  -0.967
   59    HE2  PHE   8           2HE      PHE   8 -10.793   7.822  -4.871
   60    HZ   PHE   8           HZ       PHE   8 -11.674   8.195  -2.582
   61    H    SER   9           H        SER   9 -11.375   2.514  -1.015
   62    HA   SER   9           HA       SER   9  -8.974   1.259   0.037
   63   1HB   SER   9          1HB       SER   9 -10.218   3.237   1.048
   64   2HB   SER   9          2HB       SER   9 -11.483   2.084   1.537
   65    HG   SER   9           HG       SER   9  -8.765   2.172   2.314
   66    H    ASP  10           H        ASP  10 -12.270   0.315  -0.723
   67    HA   ASP  10           HA       ASP  10 -12.486  -1.940   0.991
   68   1HB   ASP  10          1HB       ASP  10 -14.149  -0.660  -0.713
   69   2HB   ASP  10          2HB       ASP  10 -13.700  -2.046  -1.730
   70    H    LEU  11           H        LEU  11 -10.691  -1.353  -1.963
   71    HA   LEU  11           HA       LEU  11 -10.277  -4.213  -2.470
   72   1HB   LEU  11          1HB       LEU  11  -8.498  -2.759  -4.046
   73   2HB   LEU  11          2HB       LEU  11 -10.117  -3.315  -4.532
   74    HG   LEU  11           HG       LEU  11 -10.306  -1.030  -4.940
   75   1HD1  LEU  11          1HD1      LEU  11 -11.799  -1.994  -2.927
   76   2HD1  LEU  11          2HD1      LEU  11 -10.912  -0.749  -2.015
   77   3HD1  LEU  11          3HD1      LEU  11 -11.891  -0.288  -3.428
   78   1HD2  LEU  11          1HD2      LEU  11  -9.201   0.706  -3.637
   79   2HD2  LEU  11          2HD2      LEU  11  -8.709  -0.480  -2.404
   80   3HD2  LEU  11          3HD2      LEU  11  -8.006  -0.550  -4.037
   81    H    TRP  12           H        TRP  12  -7.554  -2.136  -2.972
   82    HA   TRP  12           HA       TRP  12  -5.392  -2.963  -2.252
   83   1HB   TRP  12          1HB       TRP  12  -6.227  -1.376   0.144
   84   2HB   TRP  12          2HB       TRP  12  -4.756  -1.262  -0.833
   85    HD1  TRP  12           HD       TRP  12  -7.236   0.939   0.034
   86    HE1  TRP  12           1HE      TRP  12  -7.954   2.575  -1.781
   87    HE3  TRP  12           3HE      TRP  12  -5.405  -1.538  -4.054
   88    HZ2  TRP  12           2HZ      TRP  12  -7.763   2.792  -4.660
   89    HZ3  TRP  12           3HZ      TRP  12  -5.692  -0.587  -6.312
   90    HH2  TRP  12           HH       TRP  12  -6.866   1.571  -6.633
   91    H    LYS  13           H        LYS  13  -8.062  -3.446   0.056
   92    HA   LYS  13           HA       LYS  13  -6.673  -4.786   2.090
   93   1HB   LYS  13          1HB       LYS  13  -8.937  -4.185   2.473
   94   2HB   LYS  13          2HB       LYS  13  -9.493  -5.021   1.003
   95   1HG   LYS  13          1HG       LYS  13  -9.066  -7.180   1.961
   96   2HG   LYS  13          2HG       LYS  13  -8.162  -6.473   3.321
   97   1HD   LYS  13          1HD       LYS  13 -10.394  -5.198   3.823
   98   2HD   LYS  13          2HD       LYS  13 -11.141  -6.442   2.792
   99   1HE   LYS  13          1HE       LYS  13 -11.182  -7.784   4.601
  100   2HE   LYS  13          2HE       LYS  13  -9.411  -7.868   4.482
  101   1HZ   LYS  13          1HZ       LYS  13 -10.692  -5.646   5.860
  102   2HZ   LYS  13          2HZ       LYS  13 -10.477  -7.087   6.631
  103   3HZ   LYS  13          3HZ       LYS  13  -9.174  -6.258   6.054
  104    H    LEU  14           H        LEU  14  -6.492  -5.554  -1.075
  105    HA   LEU  14           HA       LEU  14  -6.541  -8.491  -0.626
  106   1HB   LEU  14          1HB       LEU  14  -6.249  -8.439  -3.204
  107   2HB   LEU  14          2HB       LEU  14  -7.827  -7.966  -2.531
  108    HG   LEU  14           HG       LEU  14  -6.669  -6.439  -4.345
  109   1HD1  LEU  14          1HD1      LEU  14  -8.036  -5.640  -1.772
  110   2HD1  LEU  14          2HD1      LEU  14  -7.518  -4.389  -2.928
  111   3HD1  LEU  14          3HD1      LEU  14  -8.676  -5.642  -3.433
  112   1HD2  LEU  14          1HD2      LEU  14  -5.481  -5.055  -1.973
  113   2HD2  LEU  14          2HD2      LEU  14  -4.600  -6.467  -2.607
  114   3HD2  LEU  14          3HD2      LEU  14  -4.940  -5.079  -3.669
  115    H    LEU  15           H        LEU  15  -4.488  -5.712  -1.351
  116    HA   LEU  15           HA       LEU  15  -2.163  -7.519  -1.720
  117   1HB   LEU  15          1HB       LEU  15  -2.590  -4.554  -2.245
  118   2HB   LEU  15          2HB       LEU  15  -1.026  -5.383  -2.428
  119    HG   LEU  15           HG       LEU  15  -3.376  -5.400  -4.194
  120   1HD1  LEU  15          1HD1      LEU  15  -0.674  -5.055  -4.430
  121   2HD1  LEU  15          2HD1      LEU  15  -0.832  -6.757  -4.927
  122   3HD1  LEU  15          3HD1      LEU  15  -1.739  -5.491  -5.789
  123   1HD2  LEU  15          1HD2      LEU  15  -2.037  -8.076  -3.975
  124   2HD2  LEU  15          2HD2      LEU  15  -3.309  -7.687  -2.793
  125   3HD2  LEU  15          3HD2      LEU  15  -3.676  -7.667  -4.535
  126    H    LYS  16           H        LYS  16  -3.816  -5.774   0.667
  127    HA   LYS  16           HA       LYS  16  -2.223  -4.389   2.266
  128   1HB   LYS  16          1HB       LYS  16  -3.138  -6.555   3.927
  129   2HB   LYS  16          2HB       LYS  16  -3.815  -4.917   3.756
  130   1HG   LYS  16          1HG       LYS  16  -5.533  -6.542   3.159
  131   2HG   LYS  16          2HG       LYS  16  -5.013  -5.691   1.685
  132   1HD   LYS  16          1HD       LYS  16  -4.834  -7.833   0.877
  133   2HD   LYS  16          2HD       LYS  16  -3.242  -7.746   1.668
  134   1HE   LYS  16          1HE       LYS  16  -4.824  -9.778   2.180
  135   2HE   LYS  16          2HE       LYS  16  -3.942  -9.001   3.513
  136   1HZ   LYS  16          1HZ       LYS  16  -6.602  -8.069   2.805
  137   2HZ   LYS  16          2HZ       LYS  16  -6.435  -9.437   3.712
  138   3HZ   LYS  16          3HZ       LYS  16  -5.820  -8.006   4.256
  139    H    LYS  17           H        LYS  17  -2.142  -7.921   2.912
  140    HA   LYS  17           HA       LYS  17   0.231  -8.042   4.266
  141   1HB   LYS  17          1HB       LYS  17  -0.967 -10.048   4.107
  142   2HB   LYS  17          2HB       LYS  17  -1.106  -9.941   2.335
  143   1HG   LYS  17          1HG       LYS  17   0.635 -11.410   2.327
  144   2HG   LYS  17          2HG       LYS  17   1.628  -9.974   2.677
  145   1HD   LYS  17          1HD       LYS  17   0.375 -11.057   5.095
  146   2HD   LYS  17          2HD       LYS  17   1.398 -12.263   4.279
  147   1HE   LYS  17          1HE       LYS  17   3.074 -10.204   4.081
  148   2HE   LYS  17          2HE       LYS  17   2.147  -9.607   5.475
  149   1HZ   LYS  17          1HZ       LYS  17   4.198 -11.256   5.645
  150   2HZ   LYS  17          2HZ       LYS  17   2.999 -11.161   6.773
  151   3HZ   LYS  17          3HZ       LYS  17   2.960 -12.345   5.625
  152    H    TRP  18           H        TRP  18  -0.229  -7.616   0.776
  153    HA   TRP  18           HA       TRP  18   2.727  -7.635   0.435
  154   1HB   TRP  18          1HB       TRP  18   1.694  -7.486  -2.077
  155   2HB   TRP  18          2HB       TRP  18   2.122  -8.991  -1.251
  156    HD1  TRP  18           HD       TRP  18  -0.653  -7.356  -2.985
  157    HE1  TRP  18           1HE      TRP  18  -2.851  -8.605  -2.678
  158    HE3  TRP  18           3HE      TRP  18   0.707 -10.450   0.858
  159    HZ2  TRP  18           2HZ      TRP  18  -3.903 -10.695  -0.974
  160    HZ3  TRP  18           3HZ      TRP  18  -0.917 -12.053   1.796
  161    HH2  TRP  18           HH       TRP  18  -3.221 -12.188   0.894
  162    H    LYS  19           H        LYS  19   0.001  -5.609   0.777
  163    HA   LYS  19           HA       LYS  19   1.285  -3.415  -0.755
  164   1HB   LYS  19          1HB       LYS  19  -1.047  -3.764  -1.286
  165   2HB   LYS  19          2HB       LYS  19  -1.490  -3.764   0.438
  166   1HG   LYS  19          1HG       LYS  19   0.015  -1.374  -0.509
  167   2HG   LYS  19          2HG       LYS  19  -1.633  -1.554  -1.157
  168   1HD   LYS  19          1HD       LYS  19  -2.597  -1.585   1.029
  169   2HD   LYS  19          2HD       LYS  19  -1.014  -1.831   1.805
  170   1HE   LYS  19          1HE       LYS  19  -1.091   0.425   2.116
  171   2HE   LYS  19          2HE       LYS  19  -0.545   0.479   0.426
  172   1HZ   LYS  19          1HZ       LYS  19  -3.238   0.848   1.482
  173   2HZ   LYS  19          2HZ       LYS  19  -2.367   1.838   0.492
  174   3HZ   LYS  19          3HZ       LYS  19  -2.997   0.431  -0.095
  175    H    MET  20           H        MET  20   1.433  -4.745   2.267
  176    HA   MET  20           HA       MET  20   1.206  -2.333   3.866
  177   1HB   MET  20          1HB       MET  20   1.665  -5.201   4.262
  178   2HB   MET  20          2HB       MET  20   2.698  -4.196   5.306
  179   1HG   MET  20          1HG       MET  20   0.519  -4.703   6.366
  180   2HG   MET  20          2HG       MET  20   0.758  -2.966   6.113
  181   1HE   MET  20          1HE       MET  20  -2.209  -1.761   4.841
  182   2HE   MET  20          2HE       MET  20  -0.525  -1.564   5.383
  183   3HE   MET  20          3HE       MET  20  -0.892  -1.687   3.646
  184    H    ARG  21           H        ARG  21   3.056  -1.483   5.146
  185    HA   ARG  21           HA       ARG  21   5.122  -0.505   5.242
  186   1HB   ARG  21          1HB       ARG  21   5.616  -3.144   5.045
  187   2HB   ARG  21          2HB       ARG  21   6.375  -2.608   3.526
  188   1HG   ARG  21          1HG       ARG  21   7.673  -0.906   4.802
  189   2HG   ARG  21          2HG       ARG  21   6.950  -1.510   6.312
  190   1HD   ARG  21          1HD       ARG  21   8.322  -3.437   4.442
  191   2HD   ARG  21          2HD       ARG  21   9.302  -2.412   5.512
  192    HE   ARG  21           HE       ARG  21   8.514  -3.593   7.371
  193   1HH1  ARG  21          2HH2      ARG  21   6.812  -4.522   4.414
  194   2HH1  ARG  21          1HH2      ARG  21   6.058  -5.930   5.128
  195   1HH2  ARG  21          2HH1      ARG  21   7.516  -5.453   8.314
  196   2HH2  ARG  21          1HH1      ARG  21   6.459  -6.460   7.351
  197    H    ARG  22           H        ARG  22   3.246  -0.534   2.659
  198    HA   ARG  22           HA       ARG  22   5.206   0.436   0.683
  199   1HB   ARG  22          1HB       ARG  22   2.182   0.104   0.553
  200   2HB   ARG  22          2HB       ARG  22   3.244   0.532  -0.811
  201   1HG   ARG  22          1HG       ARG  22   4.057  -1.885   0.719
  202   2HG   ARG  22          2HG       ARG  22   2.527  -2.034  -0.178
  203   1HD   ARG  22          1HD       ARG  22   4.272  -2.705  -1.685
  204   2HD   ARG  22          2HD       ARG  22   3.748  -1.087  -2.199
  205    HE   ARG  22           HE       ARG  22   6.013  -1.130  -0.337
  206   1HH1  ARG  22          2HH2      ARG  22   4.904  -1.120  -3.694
  207   2HH1  ARG  22          1HH2      ARG  22   6.405  -0.487  -4.332
  208   1HH2  ARG  22          2HH1      ARG  22   7.995  -0.293  -1.179
  209   2HH2  ARG  22          1HH1      ARG  22   8.168  -0.015  -2.897
  210    H    ASN  23           H        ASN  23   5.670   2.182   2.453
  211    HA   ASN  23           HA       ASN  23   3.762   4.438   2.062
  212   1HB   ASN  23          1HB       ASN  23   3.995   3.738   4.398
  213   2HB   ASN  23          2HB       ASN  23   5.761   3.890   4.287
  214   1HD2  ASN  23          1HD2      ASN  23   2.805   5.501   4.965
  215   2HD2  ASN  23          2HD2      ASN  23   3.433   7.131   5.081
  216    H    GLN  24           H        GLN  24   6.957   4.895   3.401
  217    HA   GLN  24           HA       GLN  24   8.030   5.792   0.800
  218   1HB   GLN  24          1HB       GLN  24   7.440   7.544   3.191
  219   2HB   GLN  24          2HB       GLN  24   8.769   7.941   2.076
  220   1HG   GLN  24          1HG       GLN  24   7.069   7.689   0.180
  221   2HG   GLN  24          2HG       GLN  24   5.813   7.651   1.436
  222   1HE2  GLN  24          1HE2      GLN  24   7.530   9.640  -0.661
  223   2HE2  GLN  24          2HE2      GLN  24   7.268  11.178   0.132
  224    H    PHE  25           H        PHE  25   9.544   7.157   3.537
  225    HA   PHE  25           HA       PHE  25  12.020   6.139   3.269
  226   1HB   PHE  25          1HB       PHE  25  11.368   5.988   6.077
  227   2HB   PHE  25          2HB       PHE  25  12.335   7.194   5.211
  228    HD1  PHE  25           1HD      PHE  25   8.679   6.301   5.234
  229    HD2  PHE  25           2HD      PHE  25  11.669   9.343   5.736
  230    HE1  PHE  25           1HE      PHE  25   6.899   7.989   5.598
  231    HE2  PHE  25           2HE      PHE  25   9.890  11.032   6.101
  232    HZ   PHE  25           HZ       PHE  25   7.505  10.355   6.032
  233    H    TRP  26           H        TRP  26   9.215   4.380   4.543
  234    HA   TRP  26           HA       TRP  26  10.956   1.990   4.896
  235   1HB   TRP  26          1HB       TRP  26   9.123   1.127   6.294
  236   2HB   TRP  26          2HB       TRP  26   9.781   2.649   6.910
  237    HD1  TRP  26           HD       TRP  26   6.643   1.104   5.451
  238    HE1  TRP  26           1HE      TRP  26   4.662   2.679   5.739
  239    HE3  TRP  26           3HE      TRP  26   9.146   5.251   7.103
  240    HZ2  TRP  26           2HZ      TRP  26   4.208   5.410   6.583
  241    HZ3  TRP  26           3HZ      TRP  26   7.907   7.318   7.638
  242    HH2  TRP  26           HH       TRP  26   5.445   7.414   7.383
  243    H    VAL  27           H        VAL  27  10.751   2.176   2.369
  244    HA   VAL  27           HA       VAL  27   8.418   0.491   1.601
  245    HB   VAL  27           HB       VAL  27   8.505   1.671  -0.619
  246   1HG1  VAL  27          1HG1      VAL  27   6.767   2.358   0.854
  247   2HG1  VAL  27          2HG1      VAL  27   7.907   3.180   1.947
  248   3HG1  VAL  27          3HG1      VAL  27   7.552   3.872   0.346
  249   1HG2  VAL  27          1HG2      VAL  27  10.412   2.851  -0.978
  250   2HG2  VAL  27          2HG2      VAL  27   9.652   4.116   0.018
  251   3HG2  VAL  27          3HG2      VAL  27  10.777   2.953   0.761
  252    H    LYS  28           H        LYS  28  10.001   0.991  -1.167
  253    HA   LYS  28           HA       LYS  28  11.449  -1.540  -0.949
  254   1HB   LYS  28          1HB       LYS  28  11.527  -1.480  -3.300
  255   2HB   LYS  28          2HB       LYS  28   9.982  -0.683  -2.920
  256   1HG   LYS  28          1HG       LYS  28  11.798   1.417  -2.822
  257   2HG   LYS  28          2HG       LYS  28  12.419   0.422  -4.161
  258   1HD   LYS  28          1HD       LYS  28   9.481   1.155  -3.921
  259   2HD   LYS  28          2HD       LYS  28  10.652   2.200  -4.761
  260   1HE   LYS  28          1HE       LYS  28  11.117  -0.453  -5.677
  261   2HE   LYS  28          2HE       LYS  28   9.357  -0.208  -5.704
  262   1HZ   LYS  28          1HZ       LYS  28   9.877   0.693  -7.656
  263   2HZ   LYS  28          2HZ       LYS  28  10.156   2.041  -6.748
  264   3HZ   LYS  28          3HZ       LYS  28  11.419   1.096  -7.230
  265    H    VAL  29           H        VAL  29  12.517   0.486   0.736
  266    HA   VAL  29           HA       VAL  29  14.795   1.706  -0.593
  267    HB   VAL  29           HB       VAL  29  15.424   2.233   1.822
  268   1HG1  VAL  29          1HG1      VAL  29  14.317   4.084   1.133
  269   2HG1  VAL  29          2HG1      VAL  29  13.129   3.121   0.221
  270   3HG1  VAL  29          3HG1      VAL  29  12.891   3.412   1.961
  271   1HG2  VAL  29          1HG2      VAL  29  14.159   1.466   3.577
  272   2HG2  VAL  29          2HG2      VAL  29  12.654   1.463   2.626
  273   3HG2  VAL  29          3HG2      VAL  29  13.821   0.131   2.449
  274    H    GLN  30           H        GLN  30  15.424  -0.496  -1.535
  275    HA   GLN  30           HA       GLN  30  17.741  -1.432  -0.173
  276   1HB   GLN  30          1HB       GLN  30  15.945  -2.496   1.248
  277   2HB   GLN  30          2HB       GLN  30  15.424  -3.401  -0.194
  278   1HG   GLN  30          1HG       GLN  30  17.716  -4.339  -0.409
  279   2HG   GLN  30          2HG       GLN  30  18.199  -3.467   1.063
  280   1HE2  GLN  30          1HE2      GLN  30  18.533  -6.184   1.030
  281   2HE2  GLN  30          2HE2      GLN  30  17.346  -6.960   2.057
  282    H    ARG  31           H        ARG  31  18.912  -3.003  -1.443
  283    HA   ARG  31           HA       ARG  31  18.701  -2.632  -4.214
  284   1HB   ARG  31          1HB       ARG  31  20.297  -4.169  -2.348
  285   2HB   ARG  31          2HB       ARG  31  19.913  -5.154  -3.780
  286   1HG   ARG  31          1HG       ARG  31  20.662  -2.338  -4.357
  287   2HG   ARG  31          2HG       ARG  31  21.964  -3.337  -3.669
  288   1HD   ARG  31          1HD       ARG  31  20.239  -4.296  -5.974
  289   2HD   ARG  31          2HD       ARG  31  21.715  -3.341  -6.236
  290    HE   ARG  31           HE       ARG  31  22.155  -5.625  -4.502
  291   1HH1  ARG  31          2HH2      ARG  31  21.861  -4.535  -7.853
  292   2HH1  ARG  31          1HH2      ARG  31  22.831  -5.836  -8.505
  293   1HH2  ARG  31          2HH1      ARG  31  23.436  -7.344  -5.364
  294   2HH2  ARG  31          1HH1      ARG  31  23.729  -7.438  -7.086
  295    H    GLY  32           H        GLY  32  16.773  -3.031  -5.224
  296   1HA   GLY  32          1HA       GLY  32  15.327  -5.526  -4.652
  297   2HA   GLY  32          2HA       GLY  32  14.802  -4.199  -5.713
  Start of MODEL   13
    1    HA   PRO   1           HA       PRO   1 -10.600   3.761 -10.189
    2   1HB   PRO   1          1HB       PRO   1 -13.093   4.653  -9.547
    3   2HB   PRO   1          2HB       PRO   1 -12.790   3.666 -11.014
    4   1HG   PRO   1          1HG       PRO   1 -13.737   2.689  -8.305
    5   2HG   PRO   1          2HG       PRO   1 -14.489   2.366  -9.902
    6   1HD   PRO   1          1HD       PRO   1 -12.764   0.592  -8.758
    7   2HD   PRO   1          2HD       PRO   1 -12.706   0.906 -10.519
    8    HA   PRO   2           HA       PRO   2  -9.805   5.529  -6.236
    9   1HB   PRO   2          1HB       PRO   2 -10.497   8.152  -6.493
   10   2HB   PRO   2          2HB       PRO   2  -9.175   7.423  -7.463
   11   1HG   PRO   2          1HG       PRO   2 -12.066   7.809  -8.292
   12   2HG   PRO   2          2HG       PRO   2 -10.599   8.322  -9.188
   13   1HD   PRO   2          1HD       PRO   2 -11.859   5.972  -9.750
   14   2HD   PRO   2          2HD       PRO   2 -10.072   6.065  -9.748
   15    H    LEU   3           H        LEU   3 -11.010   4.781  -4.557
   16    HA   LEU   3           HA       LEU   3 -13.177   6.242  -3.515
   17   1HB   LEU   3          1HB       LEU   3 -14.023   4.808  -5.721
   18   2HB   LEU   3          2HB       LEU   3 -14.396   3.701  -4.378
   19    HG   LEU   3           HG       LEU   3 -16.324   5.020  -4.433
   20   1HD1  LEU   3          1HD1      LEU   3 -16.313   6.187  -2.418
   21   2HD1  LEU   3          2HD1      LEU   3 -14.834   5.212  -2.242
   22   3HD1  LEU   3          3HD1      LEU   3 -14.721   6.920  -2.731
   23   1HD2  LEU   3          1HD2      LEU   3 -15.642   6.554  -6.190
   24   2HD2  LEU   3          2HD2      LEU   3 -16.221   7.515  -4.808
   25   3HD2  LEU   3          3HD2      LEU   3 -14.474   7.346  -5.104
   26    H    SER   4           H        SER   4 -13.362   5.701  -1.400
   27    HA   SER   4           HA       SER   4 -12.934   2.965  -0.506
   28   1HB   SER   4          1HB       SER   4 -10.704   3.183  -0.224
   29   2HB   SER   4          2HB       SER   4 -10.760   4.943  -0.485
   30    HG   SER   4           HG       SER   4 -10.261   3.910   1.735
   31    H    GLN   5           H        GLN   5 -14.586   2.755   0.879
   32    HA   GLN   5           HA       GLN   5 -14.868   4.741   3.032
   33   1HB   GLN   5          1HB       GLN   5 -17.100   4.033   1.089
   34   2HB   GLN   5          2HB       GLN   5 -17.325   4.918   2.617
   35   1HG   GLN   5          1HG       GLN   5 -15.439   6.485   1.674
   36   2HG   GLN   5          2HG       GLN   5 -15.882   5.777   0.105
   37   1HE2  GLN   5          1HE2      GLN   5 -17.670   6.520  -0.956
   38   2HE2  GLN   5          2HE2      GLN   5 -18.812   7.666  -0.288
   39    H    GLU   6           H        GLU   6 -17.530   2.646   2.209
   40    HA   GLU   6           HA       GLU   6 -16.676   0.806   4.394
   41   1HB   GLU   6          1HB       GLU   6 -19.162   0.416   4.654
   42   2HB   GLU   6          2HB       GLU   6 -18.619   2.061   5.066
   43   1HG   GLU   6          1HG       GLU   6 -19.417   2.952   3.004
   44   2HG   GLU   6          2HG       GLU   6 -19.615   1.335   2.293
   45    H    THR   7           H        THR   7 -15.726   0.404   1.772
   46    HA   THR   7           HA       THR   7 -16.754  -2.256   1.292
   47    HB   THR   7           HB       THR   7 -17.655   0.043  -0.374
   48    HG1  THR   7           1HG      THR   7 -19.428  -1.186  -0.421
   49   1HG2  THR   7          1HG2      THR   7 -16.084  -2.167  -1.464
   50   2HG2  THR   7          2HG2      THR   7 -17.740  -2.165  -2.116
   51   3HG2  THR   7          3HG2      THR   7 -16.717  -0.719  -2.283
   52    H    PHE   8           H        PHE   8 -15.561  -0.254  -1.347
   53    HA   PHE   8           HA       PHE   8 -13.379  -1.892  -1.941
   54   1HB   PHE   8          1HB       PHE   8 -12.550   0.560  -2.813
   55   2HB   PHE   8          2HB       PHE   8 -13.683  -0.492  -3.679
   56    HD1  PHE   8           1HD      PHE   8 -14.342   1.464  -0.568
   57    HD2  PHE   8           2HD      PHE   8 -15.057   1.073  -4.786
   58    HE1  PHE   8           1HE      PHE   8 -16.082   3.226  -0.436
   59    HE2  PHE   8           2HE      PHE   8 -16.798   2.835  -4.654
   60    HZ   PHE   8           HZ       PHE   8 -17.310   3.911  -2.479
   61    H    SER   9           H        SER   9 -13.800   0.322   0.676
   62    HA   SER   9           HA       SER   9 -10.988   0.910   1.069
   63   1HB   SER   9          1HB       SER   9 -11.890   2.461   2.414
   64   2HB   SER   9          2HB       SER   9 -13.504   1.776   2.105
   65    HG   SER   9           HG       SER   9 -13.449   0.812   3.969
   66    H    ASP  10           H        ASP  10 -13.259  -1.615   2.016
   67    HA   ASP  10           HA       ASP  10 -11.848  -2.658   4.241
   68   1HB   ASP  10          1HB       ASP  10 -14.212  -3.194   3.071
   69   2HB   ASP  10          2HB       ASP  10 -13.254  -4.517   2.371
   70    H    LEU  11           H        LEU  11 -11.267  -2.806   0.782
   71    HA   LEU  11           HA       LEU  11  -9.393  -5.048   1.030
   72   1HB   LEU  11          1HB       LEU  11  -9.055  -3.912  -1.480
   73   2HB   LEU  11          2HB       LEU  11 -10.166  -5.244  -1.083
   74    HG   LEU  11           HG       LEU  11 -11.629  -3.715  -2.069
   75   1HD1  LEU  11          1HD1      LEU  11 -11.783  -2.421   0.631
   76   2HD1  LEU  11          2HD1      LEU  11 -13.074  -3.139  -0.363
   77   3HD1  LEU  11          3HD1      LEU  11 -11.970  -4.189   0.557
   78   1HD2  LEU  11          1HD2      LEU  11 -11.441  -1.299  -1.882
   79   2HD2  LEU  11          2HD2      LEU  11 -10.194  -1.451  -0.621
   80   3HD2  LEU  11          3HD2      LEU  11  -9.837  -1.953  -2.291
   81    H    TRP  12           H        TRP  12  -8.497  -2.454  -1.094
   82    HA   TRP  12           HA       TRP  12  -6.152  -1.813  -1.093
   83   1HB   TRP  12          1HB       TRP  12  -7.328   0.147   0.842
   84   2HB   TRP  12          2HB       TRP  12  -6.354   0.436  -0.606
   85    HD1  TRP  12           HD       TRP  12  -9.490   1.387   0.445
   86    HE1  TRP  12           1HE      TRP  12 -11.273   1.500  -1.370
   87    HE3  TRP  12           3HE      TRP  12  -7.203  -1.496  -3.112
   88    HZ2  TRP  12           2HZ      TRP  12 -11.669   0.467  -4.044
   89    HZ3  TRP  12           3HZ      TRP  12  -8.312  -1.908  -5.277
   90    HH2  TRP  12           HH       TRP  12 -10.539  -0.937  -5.758
   91    H    LYS  13           H        LYS  13  -7.622  -2.235   2.131
   92    HA   LYS  13           HA       LYS  13  -5.430  -1.701   3.759
   93   1HB   LYS  13          1HB       LYS  13  -7.820  -2.353   4.401
   94   2HB   LYS  13          2HB       LYS  13  -7.316  -4.044   4.164
   95   1HG   LYS  13          1HG       LYS  13  -5.261  -3.181   5.704
   96   2HG   LYS  13          2HG       LYS  13  -6.542  -2.097   6.295
   97   1HD   LYS  13          1HD       LYS  13  -7.825  -4.562   6.135
   98   2HD   LYS  13          2HD       LYS  13  -6.193  -4.991   6.701
   99   1HE   LYS  13          1HE       LYS  13  -6.378  -3.280   8.489
  100   2HE   LYS  13          2HE       LYS  13  -8.020  -2.888   7.934
  101   1HZ   LYS  13          1HZ       LYS  13  -7.055  -5.284   9.264
  102   2HZ   LYS  13          2HZ       LYS  13  -8.390  -4.371   9.585
  103   3HZ   LYS  13          3HZ       LYS  13  -8.376  -5.381   8.282
  104    H    LEU  14           H        LEU  14  -5.547  -3.894   1.210
  105    HA   LEU  14           HA       LEU  14  -3.729  -5.855   2.439
  106   1HB   LEU  14          1HB       LEU  14  -3.843  -6.828   0.074
  107   2HB   LEU  14          2HB       LEU  14  -5.369  -6.797   0.989
  108    HG   LEU  14           HG       LEU  14  -5.541  -5.979  -1.415
  109   1HD1  LEU  14          1HD1      LEU  14  -7.338  -4.846  -0.657
  110   2HD1  LEU  14          2HD1      LEU  14  -6.669  -4.978   0.987
  111   3HD1  LEU  14          3HD1      LEU  14  -6.300  -3.552  -0.013
  112   1HD2  LEU  14          1HD2      LEU  14  -4.455  -3.337  -0.616
  113   2HD2  LEU  14          2HD2      LEU  14  -3.232  -4.615  -0.812
  114   3HD2  LEU  14          3HD2      LEU  14  -4.317  -4.207  -2.163
  115    H    LEU  15           H        LEU  15  -3.722  -3.140   0.140
  116    HA   LEU  15           HA       LEU  15  -0.857  -3.580  -0.421
  117   1HB   LEU  15          1HB       LEU  15  -3.018  -1.782  -1.546
  118   2HB   LEU  15          2HB       LEU  15  -1.297  -1.513  -1.912
  119    HG   LEU  15           HG       LEU  15  -3.011  -3.934  -2.553
  120   1HD1  LEU  15          1HD1      LEU  15  -1.027  -2.502  -4.333
  121   2HD1  LEU  15          2HD1      LEU  15  -2.465  -3.447  -4.790
  122   3HD1  LEU  15          3HD1      LEU  15  -2.655  -1.829  -4.074
  123   1HD2  LEU  15          1HD2      LEU  15  -1.022  -4.887  -1.598
  124   2HD2  LEU  15          2HD2      LEU  15  -0.808  -4.943  -3.364
  125   3HD2  LEU  15          3HD2      LEU  15   0.018  -3.690  -2.407
  126    H    LYS  16           H        LYS  16  -2.935  -1.829   1.702
  127    HA   LYS  16           HA       LYS  16  -1.892   0.604   2.181
  128   1HB   LYS  16          1HB       LYS  16  -3.127   0.331   4.033
  129   2HB   LYS  16          2HB       LYS  16  -3.177  -1.424   3.740
  130   1HG   LYS  16          1HG       LYS  16  -0.814  -0.039   5.062
  131   2HG   LYS  16          2HG       LYS  16  -2.185  -0.700   5.985
  132   1HD   LYS  16          1HD       LYS  16  -0.805  -2.433   3.937
  133   2HD   LYS  16          2HD       LYS  16  -0.052  -2.197   5.532
  134   1HE   LYS  16          1HE       LYS  16  -2.960  -2.779   5.595
  135   2HE   LYS  16          2HE       LYS  16  -1.950  -4.102   4.974
  136   1HZ   LYS  16          1HZ       LYS  16  -1.073  -2.766   7.377
  137   2HZ   LYS  16          2HZ       LYS  16  -2.387  -3.755   7.503
  138   3HZ   LYS  16          3HZ       LYS  16  -0.955  -4.352   6.943
  139    H    LYS  17           H        LYS  17  -0.114  -2.385   2.293
  140    HA   LYS  17           HA       LYS  17   2.117  -1.173   3.785
  141   1HB   LYS  17          1HB       LYS  17   3.044  -3.365   3.816
  142   2HB   LYS  17          2HB       LYS  17   1.294  -3.588   4.058
  143   1HG   LYS  17          1HG       LYS  17   0.972  -4.211   1.753
  144   2HG   LYS  17          2HG       LYS  17   2.631  -3.724   1.327
  145   1HD   LYS  17          1HD       LYS  17   2.864  -6.041   1.545
  146   2HD   LYS  17          2HD       LYS  17   3.312  -5.482   3.175
  147   1HE   LYS  17          1HE       LYS  17   0.409  -5.895   2.792
  148   2HE   LYS  17          2HE       LYS  17   1.378  -7.375   2.622
  149   1HZ   LYS  17          1HZ       LYS  17   0.917  -7.229   4.845
  150   2HZ   LYS  17          2HZ       LYS  17   2.444  -6.612   4.757
  151   3HZ   LYS  17          3HZ       LYS  17   1.154  -5.599   4.925
  152    H    TRP  18           H        TRP  18   0.965  -1.364   0.580
  153    HA   TRP  18           HA       TRP  18   3.472  -1.594  -0.802
  154   1HB   TRP  18          1HB       TRP  18   2.172  -0.705  -2.715
  155   2HB   TRP  18          2HB       TRP  18   1.395  -2.080  -1.918
  156    HD1  TRP  18           HD       TRP  18  -0.605  -0.706  -3.512
  157    HE1  TRP  18           1HE      TRP  18  -2.434   0.832  -2.632
  158    HE3  TRP  18           3HE      TRP  18   1.526   0.611   0.952
  159    HZ2  TRP  18           2HZ      TRP  18  -2.923   2.445  -0.279
  160    HZ3  TRP  18           3HZ      TRP  18   0.351   2.148   2.483
  161    HH2  TRP  18           HH       TRP  18  -1.868   3.072   1.885
  162    H    LYS  19           H        LYS  19   1.433   1.178   0.240
  163    HA   LYS  19           HA       LYS  19   3.271   3.139  -0.820
  164   1HB   LYS  19          1HB       LYS  19   0.680   3.238  -0.186
  165   2HB   LYS  19          2HB       LYS  19   1.335   3.777   1.379
  166   1HG   LYS  19          1HG       LYS  19   1.284   5.828   0.344
  167   2HG   LYS  19          2HG       LYS  19   2.857   5.282  -0.286
  168   1HD   LYS  19          1HD       LYS  19   1.956   4.693  -2.380
  169   2HD   LYS  19          2HD       LYS  19   0.296   4.595  -1.744
  170   1HE   LYS  19          1HE       LYS  19   1.558   7.246  -1.408
  171   2HE   LYS  19          2HE       LYS  19   1.356   6.756  -3.104
  172   1HZ   LYS  19          1HZ       LYS  19  -0.805   7.008  -2.948
  173   2HZ   LYS  19          2HZ       LYS  19  -0.920   6.219  -1.505
  174   3HZ   LYS  19          3HZ       LYS  19  -0.540   7.823  -1.540
  175    H    MET  20           H        MET  20   3.537   0.987   1.717
  176    HA   MET  20           HA       MET  20   4.949   2.875   3.501
  177   1HB   MET  20          1HB       MET  20   4.208  -0.064   3.772
  178   2HB   MET  20          2HB       MET  20   5.061   0.888   5.011
  179   1HG   MET  20          1HG       MET  20   2.454   1.864   3.848
  180   2HG   MET  20          2HG       MET  20   2.454   0.642   5.131
  181   1HE   MET  20          1HE       MET  20   2.098   4.019   4.185
  182   2HE   MET  20          2HE       MET  20   2.669   5.083   5.493
  183   3HE   MET  20          3HE       MET  20   3.827   4.421   4.315
  184    H    ARG  21           H        ARG  21   7.114   2.282   4.306
  185    HA   ARG  21           HA       ARG  21   9.308   1.727   3.967
  186   1HB   ARG  21          1HB       ARG  21   8.003  -0.590   3.608
  187   2HB   ARG  21          2HB       ARG  21   8.632  -0.384   1.955
  188   1HG   ARG  21          1HG       ARG  21  10.779  -0.766   2.601
  189   2HG   ARG  21          2HG       ARG  21  10.604   0.208   4.080
  190   1HD   ARG  21          1HD       ARG  21   9.025  -1.861   4.764
  191   2HD   ARG  21          2HD       ARG  21  10.100  -2.710   3.634
  192    HE   ARG  21           HE       ARG  21  11.751  -1.205   5.335
  193   1HH1  ARG  21          2HH2      ARG  21   9.398  -3.835   5.559
  194   2HH1  ARG  21          1HH2      ARG  21  10.152  -4.574   6.954
  195   1HH2  ARG  21          2HH1      ARG  21  12.747  -2.181   7.178
  196   2HH2  ARG  21          1HH1      ARG  21  12.061  -3.631   7.877
  197    H    ARG  22           H        ARG  22   7.416   3.243   1.868
  198    HA   ARG  22           HA       ARG  22   9.241   3.166  -0.451
  199   1HB   ARG  22          1HB       ARG  22   6.704   4.792  -0.051
  200   2HB   ARG  22          2HB       ARG  22   7.532   4.426  -1.584
  201   1HG   ARG  22          1HG       ARG  22   6.252   2.378   0.278
  202   2HG   ARG  22          2HG       ARG  22   5.563   2.957  -1.258
  203   1HD   ARG  22          1HD       ARG  22   6.779   1.442  -2.388
  204   2HD   ARG  22          2HD       ARG  22   8.275   2.150  -1.740
  205    HE   ARG  22           HE       ARG  22   7.396   0.602   0.336
  206   1HH1  ARG  22          2HH2      ARG  22   7.914   0.023  -3.113
  207   2HH1  ARG  22          1HH2      ARG  22   8.317  -1.668  -2.908
  208   1HH2  ARG  22          2HH1      ARG  22   7.928  -1.630   0.606
  209   2HH2  ARG  22          1HH1      ARG  22   8.324  -2.610  -0.788
  210    H    ASN  23           H        ASN  23  10.915   4.049   1.208
  211    HA   ASN  23           HA       ASN  23  10.605   6.936   1.699
  212   1HB   ASN  23          1HB       ASN  23  11.531   5.766   3.534
  213   2HB   ASN  23          2HB       ASN  23  12.613   4.816   2.493
  214   1HD2  ASN  23          1HD2      ASN  23  11.882   8.238   3.380
  215   2HD2  ASN  23          2HD2      ASN  23  13.547   8.777   3.361
  216    H    GLN  24           H        GLN  24  13.726   5.499   0.952
  217    HA   GLN  24           HA       GLN  24  13.757   6.553  -1.776
  218   1HB   GLN  24          1HB       GLN  24  14.417   8.297   0.291
  219   2HB   GLN  24          2HB       GLN  24  15.995   7.672  -0.244
  220   1HG   GLN  24          1HG       GLN  24  14.225   8.262  -2.501
  221   2HG   GLN  24          2HG       GLN  24  14.495   9.691  -1.480
  222   1HE2  GLN  24          1HE2      GLN  24  15.512  10.103  -3.833
  223   2HE2  GLN  24          2HE2      GLN  24  17.238   9.822  -3.912
  224    H    PHE  25           H        PHE  25  15.567   5.240   1.027
  225    HA   PHE  25           HA       PHE  25  17.364   3.832  -0.869
  226   1HB   PHE  25          1HB       PHE  25  18.606   4.998   0.758
  227   2HB   PHE  25          2HB       PHE  25  17.494   4.546   2.062
  228    HD1  PHE  25           1HD      PHE  25  17.265   1.863   2.354
  229    HD2  PHE  25           2HD      PHE  25  20.655   3.935   0.721
  230    HE1  PHE  25           1HE      PHE  25  18.718  -0.063   2.929
  231    HE2  PHE  25           2HE      PHE  25  22.108   2.009   1.296
  232    HZ   PHE  25           HZ       PHE  25  21.140   0.011   2.400
  233    H    TRP  26           H        TRP  26  14.990   3.354   1.751
  234    HA   TRP  26           HA       TRP  26  15.239   0.420   1.404
  235   1HB   TRP  26          1HB       TRP  26  13.663   0.436   3.399
  236   2HB   TRP  26          2HB       TRP  26  15.304   1.035   3.675
  237    HD1  TRP  26           HD       TRP  26  11.698   2.026   3.867
  238    HE1  TRP  26           1HE      TRP  26  11.447   4.383   4.798
  239    HE3  TRP  26           3HE      TRP  26  16.600   3.487   3.694
  240    HZ2  TRP  26           2HZ      TRP  26  13.159   6.638   5.398
  241    HZ3  TRP  26           3HZ      TRP  26  17.250   5.743   4.452
  242    HH2  TRP  26           HH       TRP  26  15.547   7.327   5.304
  243    H    VAL  27           H        VAL  27  14.113   2.072  -0.714
  244    HA   VAL  27           HA       VAL  27  11.209   1.651  -0.518
  245    HB   VAL  27           HB       VAL  27  11.324   2.665  -2.870
  246   1HG1  VAL  27          1HG1      VAL  27  12.196   4.004  -0.310
  247   2HG1  VAL  27          2HG1      VAL  27  12.152   4.944  -1.820
  248   3HG1  VAL  27          3HG1      VAL  27  10.669   4.173  -1.208
  249   1HG2  VAL  27          1HG2      VAL  27  13.380   3.653  -3.588
  250   2HG2  VAL  27          2HG2      VAL  27  14.158   3.354  -2.015
  251   3HG2  VAL  27          3HG2      VAL  27  13.793   1.991  -3.101
  252    H    LYS  28           H        LYS  28  12.208  -0.784  -0.240
  253    HA   LYS  28           HA       LYS  28  11.086  -2.389  -2.118
  254   1HB   LYS  28          1HB       LYS  28  13.591  -1.205  -3.157
  255   2HB   LYS  28          2HB       LYS  28  13.494  -2.976  -3.303
  256   1HG   LYS  28          1HG       LYS  28  11.677  -2.897  -4.733
  257   2HG   LYS  28          2HG       LYS  28  11.064  -1.377  -4.040
  258   1HD   LYS  28          1HD       LYS  28  12.911  -0.135  -5.116
  259   2HD   LYS  28          2HD       LYS  28  13.540  -1.654  -5.798
  260   1HE   LYS  28          1HE       LYS  28  12.266  -0.812  -7.571
  261   2HE   LYS  28          2HE       LYS  28  11.122  -1.916  -6.777
  262   1HZ   LYS  28          1HZ       LYS  28  11.234   1.001  -6.604
  263   2HZ   LYS  28          2HZ       LYS  28   9.990   0.051  -7.123
  264   3HZ   LYS  28          3HZ       LYS  28  10.385   0.092  -5.522
  265    H    VAL  29           H        VAL  29  11.663  -2.395   0.622
  266    HA   VAL  29           HA       VAL  29  13.660  -4.576   0.917
  267    HB   VAL  29           HB       VAL  29  12.325  -2.888   3.066
  268   1HG1  VAL  29          1HG1      VAL  29  14.994  -4.041   3.519
  269   2HG1  VAL  29          2HG1      VAL  29  13.538  -4.111   4.540
  270   3HG1  VAL  29          3HG1      VAL  29  13.751  -5.278   3.213
  271   1HG2  VAL  29          1HG2      VAL  29  14.862  -2.507   1.448
  272   2HG2  VAL  29          2HG2      VAL  29  13.572  -1.328   1.788
  273   3HG2  VAL  29          3HG2      VAL  29  14.691  -1.821   3.081
  274    H    GLN  30           H        GLN  30  10.927  -4.881  -0.236
  275    HA   GLN  30           HA       GLN  30  10.175  -7.244   1.167
  276   1HB   GLN  30          1HB       GLN  30   9.368  -5.493   2.796
  277   2HB   GLN  30          2HB       GLN  30   8.267  -4.904   1.527
  278   1HG   GLN  30          1HG       GLN  30   7.848  -7.658   1.520
  279   2HG   GLN  30          2HG       GLN  30   8.059  -7.282   3.244
  280   1HE2  GLN  30          1HE2      GLN  30   5.957  -7.117   0.499
  281   2HE2  GLN  30          2HE2      GLN  30   4.651  -6.230   1.255
  282    H    ARG  31           H        ARG  31  10.564  -7.631  -1.196
  283    HA   ARG  31           HA       ARG  31   8.905  -6.571  -3.216
  284   1HB   ARG  31          1HB       ARG  31  11.045  -8.082  -3.311
  285   2HB   ARG  31          2HB       ARG  31   9.881  -9.427  -3.244
  286   1HG   ARG  31          1HG       ARG  31   8.687  -7.866  -5.126
  287   2HG   ARG  31          2HG       ARG  31  10.393  -7.449  -5.417
  288   1HD   ARG  31          1HD       ARG  31  10.551  -9.361  -6.600
  289   2HD   ARG  31          2HD       ARG  31  10.409 -10.228  -5.056
  290    HE   ARG  31           HE       ARG  31   7.799  -9.569  -5.936
  291   1HH1  ARG  31          2HH2      ARG  31  10.554 -11.585  -6.856
  292   2HH1  ARG  31          1HH2      ARG  31   9.575 -12.803  -7.643
  293   1HH2  ARG  31          2HH1      ARG  31   6.506 -11.178  -6.975
  294   2HH2  ARG  31          1HH1      ARG  31   7.267 -12.570  -7.710
  295    H    GLY  32           H        GLY  32   6.940  -7.212  -4.106
  296   1HA   GLY  32          1HA       GLY  32   5.536  -9.539  -3.036
  297   2HA   GLY  32          2HA       GLY  32   4.852  -7.973  -2.547
  Start of MODEL   14
    1    HA   PRO   1           HA       PRO   1 -18.690  12.523  -7.382
    2   1HB   PRO   1          1HB       PRO   1 -16.030  12.877  -7.850
    3   2HB   PRO   1          2HB       PRO   1 -17.276  13.862  -8.683
    4   1HG   PRO   1          1HG       PRO   1 -15.721  14.594  -6.185
    5   2HG   PRO   1          2HG       PRO   1 -15.903  15.571  -7.679
    6   1HD   PRO   1          1HD       PRO   1 -17.510  15.971  -5.514
    7   2HD   PRO   1          2HD       PRO   1 -18.185  16.043  -7.171
    8    HA   PRO   2           HA       PRO   2 -17.426  10.420  -3.609
    9   1HB   PRO   2          1HB       PRO   2 -18.313   7.947  -4.330
   10   2HB   PRO   2          2HB       PRO   2 -19.446   9.269  -3.900
   11   1HG   PRO   2          1HG       PRO   2 -18.545   8.450  -6.677
   12   2HG   PRO   2          2HG       PRO   2 -20.230   8.659  -6.097
   13   1HD   PRO   2          1HD       PRO   2 -18.923  10.655  -7.414
   14   2HD   PRO   2          2HD       PRO   2 -19.979  11.029  -6.019
   15    H    LEU   3           H        LEU   3 -15.755   8.890  -3.110
   16    HA   LEU   3           HA       LEU   3 -14.344   7.366  -5.025
   17   1HB   LEU   3          1HB       LEU   3 -12.233   8.893  -4.982
   18   2HB   LEU   3          2HB       LEU   3 -13.545   9.287  -6.118
   19    HG   LEU   3           HG       LEU   3 -14.312  10.593  -3.780
   20   1HD1  LEU   3          1HD1      LEU   3 -12.320  10.455  -2.571
   21   2HD1  LEU   3          2HD1      LEU   3 -11.310  10.464  -4.037
   22   3HD1  LEU   3          3HD1      LEU   3 -12.069  11.971  -3.471
   23   1HD2  LEU   3          1HD2      LEU   3 -14.626  11.826  -5.699
   24   2HD2  LEU   3          2HD2      LEU   3 -13.112  12.586  -5.152
   25   3HD2  LEU   3          3HD2      LEU   3 -13.072  11.321  -6.404
   26    H    SER   4           H        SER   4 -14.009   5.795  -3.534
   27    HA   SER   4           HA       SER   4 -13.248   4.752  -1.642
   28   1HB   SER   4          1HB       SER   4 -11.165   6.197  -2.725
   29   2HB   SER   4          2HB       SER   4 -11.176   6.767  -1.038
   30    HG   SER   4           HG       SER   4 -10.124   4.582  -1.864
   31    H    GLN   5           H        GLN   5 -14.758   4.870  -0.055
   32    HA   GLN   5           HA       GLN   5 -14.333   6.755   2.093
   33   1HB   GLN   5          1HB       GLN   5 -16.301   7.357   0.002
   34   2HB   GLN   5          2HB       GLN   5 -17.029   7.266   1.624
   35   1HG   GLN   5          1HG       GLN   5 -14.459   8.666   1.656
   36   2HG   GLN   5          2HG       GLN   5 -15.615   9.435   0.547
   37   1HE2  GLN   5          1HE2      GLN   5 -15.453  11.230   2.173
   38   2HE2  GLN   5          2HE2      GLN   5 -16.508  11.170   3.568
   39    H    GLU   6           H        GLU   6 -17.540   5.545   1.222
   40    HA   GLU   6           HA       GLU   6 -17.217   3.451   3.321
   41   1HB   GLU   6          1HB       GLU   6 -19.560   5.242   2.602
   42   2HB   GLU   6          2HB       GLU   6 -19.735   3.778   3.599
   43   1HG   GLU   6          1HG       GLU   6 -17.506   5.549   4.408
   44   2HG   GLU   6          2HG       GLU   6 -19.117   6.282   4.572
   45    H    THR   7           H        THR   7 -16.463   2.901   0.685
   46    HA   THR   7           HA       THR   7 -18.181   0.669   0.114
   47    HB   THR   7           HB       THR   7 -18.574   3.223  -1.363
   48    HG1  THR   7           1HG      THR   7 -20.059   0.839  -0.939
   49   1HG2  THR   7          1HG2      THR   7 -17.934   2.390  -3.366
   50   2HG2  THR   7          2HG2      THR   7 -17.670   0.769  -2.680
   51   3HG2  THR   7          3HG2      THR   7 -19.295   1.250  -3.225
   52    H    PHE   8           H        PHE   8 -16.655   2.497  -2.488
   53    HA   PHE   8           HA       PHE   8 -15.023   0.418  -3.361
   54   1HB   PHE   8          1HB       PHE   8 -13.592   2.641  -4.064
   55   2HB   PHE   8          2HB       PHE   8 -14.995   2.015  -4.946
   56    HD1  PHE   8           1HD      PHE   8 -15.040   3.723  -1.632
   57    HD2  PHE   8           2HD      PHE   8 -15.897   4.017  -5.831
   58    HE1  PHE   8           1HE      PHE   8 -16.242   5.856  -1.237
   59    HE2  PHE   8           2HE      PHE   8 -17.099   6.150  -5.436
   60    HZ   PHE   8           HZ       PHE   8 -17.272   7.069  -3.139
   61    H    SER   9           H        SER   9 -14.691   2.409  -0.550
   62    HA   SER   9           HA       SER   9 -11.810   2.118  -0.309
   63   1HB   SER   9          1HB       SER   9 -13.212   4.005   0.652
   64   2HB   SER   9          2HB       SER   9 -13.831   2.835   1.843
   65    HG   SER   9           HG       SER   9 -11.518   4.168   1.850
   66    H    ASP  10           H        ASP  10 -14.665   0.263   0.506
   67    HA   ASP  10           HA       ASP  10 -13.550  -1.294   2.624
   68   1HB   ASP  10          1HB       ASP  10 -16.017  -1.000   1.627
   69   2HB   ASP  10          2HB       ASP  10 -15.553  -2.463   0.731
   70    H    LEU  11           H        LEU  11 -13.145  -1.299  -0.850
   71    HA   LEU  11           HA       LEU  11 -12.060  -4.029  -0.878
   72   1HB   LEU  11          1HB       LEU  11 -11.499  -2.844  -3.326
   73   2HB   LEU  11          2HB       LEU  11 -12.942  -3.813  -2.945
   74    HG   LEU  11           HG       LEU  11 -13.906  -1.837  -3.740
   75   1HD1  LEU  11          1HD1      LEU  11 -15.066  -1.036  -1.916
   76   2HD1  LEU  11          2HD1      LEU  11 -14.270  -2.420  -1.130
   77   3HD1  LEU  11          3HD1      LEU  11 -13.589  -0.785  -0.954
   78   1HD2  LEU  11          1HD2      LEU  11 -12.997   0.391  -3.371
   79   2HD2  LEU  11          2HD2      LEU  11 -11.807  -0.244  -2.210
   80   3HD2  LEU  11          3HD2      LEU  11 -11.682  -0.668  -3.934
   81    H    TRP  12           H        TRP  12 -10.517  -1.628  -2.866
   82    HA   TRP  12           HA       TRP  12  -8.088  -1.729  -2.987
   83   1HB   TRP  12          1HB       TRP  12  -8.523   0.312  -0.839
   84   2HB   TRP  12          2HB       TRP  12  -7.577   0.425  -2.330
   85    HD1  TRP  12           HD       TRP  12 -10.230   2.163  -0.986
   86    HE1  TRP  12           1HE      TRP  12 -11.976   2.968  -2.656
   87    HE3  TRP  12           3HE      TRP  12  -9.079  -0.923  -4.904
   88    HZ2  TRP  12           2HZ      TRP  12 -12.784   2.353  -5.366
   89    HZ3  TRP  12           3HZ      TRP  12 -10.358  -0.784  -7.010
   90    HH2  TRP  12           HH       TRP  12 -12.209   0.844  -7.257
   91    H    LYS  13           H        LYS  13  -9.470  -1.973   0.295
   92    HA   LYS  13           HA       LYS  13  -7.157  -2.263   1.806
   93   1HB   LYS  13          1HB       LYS  13  -9.612  -2.252   2.545
   94   2HB   LYS  13          2HB       LYS  13  -9.625  -3.990   2.161
   95   1HG   LYS  13          1HG       LYS  13  -7.305  -3.761   3.631
   96   2HG   LYS  13          2HG       LYS  13  -8.351  -2.554   4.418
   97   1HD   LYS  13          1HD       LYS  13 -10.169  -4.369   4.446
   98   2HD   LYS  13          2HD       LYS  13  -8.882  -5.519   4.013
   99   1HE   LYS  13          1HE       LYS  13  -8.201  -5.604   6.153
  100   2HE   LYS  13          2HE       LYS  13  -7.945  -3.845   6.159
  101   1HZ   LYS  13          1HZ       LYS  13 -10.641  -4.877   6.433
  102   2HZ   LYS  13          2HZ       LYS  13  -9.634  -4.938   7.737
  103   3HZ   LYS  13          3HZ       LYS  13  -9.978  -3.489   7.030
  104    H    LEU  14           H        LEU  14  -8.051  -4.100  -0.878
  105    HA   LEU  14           HA       LEU  14  -6.859  -6.611   0.065
  106   1HB   LEU  14          1HB       LEU  14  -7.303  -7.247  -2.383
  107   2HB   LEU  14          2HB       LEU  14  -8.727  -6.883  -1.380
  108    HG   LEU  14           HG       LEU  14  -8.712  -5.786  -3.681
  109   1HD1  LEU  14          1HD1      LEU  14  -9.442  -4.781  -1.124
  110   2HD1  LEU  14          2HD1      LEU  14  -8.725  -3.415  -2.013
  111   3HD1  LEU  14          3HD1      LEU  14 -10.103  -4.304  -2.706
  112   1HD2  LEU  14          1HD2      LEU  14  -6.094  -5.184  -3.020
  113   2HD2  LEU  14          2HD2      LEU  14  -7.028  -4.394  -4.313
  114   3HD2  LEU  14          3HD2      LEU  14  -6.926  -3.642  -2.703
  115    H    LEU  15           H        LEU  15  -6.104  -3.852  -2.071
  116    HA   LEU  15           HA       LEU  15  -3.713  -4.953  -3.173
  117   1HB   LEU  15          1HB       LEU  15  -3.534  -2.927  -4.221
  118   2HB   LEU  15          2HB       LEU  15  -5.225  -2.769  -3.688
  119    HG   LEU  15           HG       LEU  15  -4.454  -0.821  -2.758
  120   1HD1  LEU  15          1HD1      LEU  15  -4.690  -2.832  -0.925
  121   2HD1  LEU  15          2HD1      LEU  15  -3.023  -2.296  -0.604
  122   3HD1  LEU  15          3HD1      LEU  15  -4.368  -1.135  -0.493
  123   1HD2  LEU  15          1HD2      LEU  15  -1.762  -2.200  -2.879
  124   2HD2  LEU  15          2HD2      LEU  15  -2.293  -0.705  -3.687
  125   3HD2  LEU  15          3HD2      LEU  15  -1.971  -0.704  -1.936
  126    H    LYS  16           H        LYS  16  -4.499  -4.002  -0.002
  127    HA   LYS  16           HA       LYS  16  -2.176  -2.740   0.923
  128   1HB   LYS  16          1HB       LYS  16  -3.609  -2.812   2.667
  129   2HB   LYS  16          2HB       LYS  16  -4.426  -4.265   2.044
  130   1HG   LYS  16          1HG       LYS  16  -1.649  -4.457   3.230
  131   2HG   LYS  16          2HG       LYS  16  -3.081  -4.438   4.286
  132   1HD   LYS  16          1HD       LYS  16  -2.432  -6.422   2.072
  133   2HD   LYS  16          2HD       LYS  16  -2.589  -6.750   3.814
  134   1HE   LYS  16          1HE       LYS  16  -5.009  -5.628   3.351
  135   2HE   LYS  16          2HE       LYS  16  -4.701  -6.323   1.745
  136   1HZ   LYS  16          1HZ       LYS  16  -5.209  -7.631   4.241
  137   2HZ   LYS  16          2HZ       LYS  16  -5.538  -8.119   2.700
  138   3HZ   LYS  16          3HZ       LYS  16  -4.024  -8.319   3.323
  139    H    LYS  17           H        LYS  17  -2.894  -6.239   0.531
  140    HA   LYS  17           HA       LYS  17  -0.532  -7.251   1.661
  141   1HB   LYS  17          1HB       LYS  17  -2.095  -8.889   1.183
  142   2HB   LYS  17          2HB       LYS  17  -2.507  -8.186  -0.400
  143   1HG   LYS  17          1HG       LYS  17  -1.165  -9.778  -1.293
  144   2HG   LYS  17          2HG       LYS  17   0.197  -8.825  -0.657
  145   1HD   LYS  17          1HD       LYS  17  -1.121 -10.573   1.342
  146   2HD   LYS  17          2HD       LYS  17  -0.322 -11.444   0.012
  147   1HE   LYS  17          1HE       LYS  17   1.760 -10.206   0.423
  148   2HE   LYS  17          2HE       LYS  17   0.969  -9.270   1.710
  149   1HZ   LYS  17          1HZ       LYS  17   0.520 -11.827   2.388
  150   2HZ   LYS  17          2HZ       LYS  17   2.054 -11.883   1.785
  151   3HZ   LYS  17          3HZ       LYS  17   1.691 -10.854   3.021
  152    H    TRP  18           H        TRP  18  -1.129  -5.687  -1.448
  153    HA   TRP  18           HA       TRP  18   1.648  -6.331  -2.287
  154   1HB   TRP  18          1HB       TRP  18   0.513  -5.014  -4.383
  155   2HB   TRP  18          2HB       TRP  18   0.519  -6.771  -4.179
  156    HD1  TRP  18           HD       TRP  18  -1.740  -4.046  -4.911
  157    HE1  TRP  18           1HE      TRP  18  -4.186  -4.667  -4.563
  158    HE3  TRP  18           3HE      TRP  18  -1.105  -8.340  -2.199
  159    HZ2  TRP  18           2HZ      TRP  18  -5.695  -6.768  -3.266
  160    HZ3  TRP  18           3HZ      TRP  18  -3.067  -9.622  -1.426
  161    HH2  TRP  18           HH       TRP  18  -5.363  -8.852  -1.949
  162    H    LYS  19           H        LYS  19  -0.294  -3.898  -0.860
  163    HA   LYS  19           HA       LYS  19   1.424  -1.708  -1.853
  164   1HB   LYS  19          1HB       LYS  19  -1.216  -1.737  -1.476
  165   2HB   LYS  19          2HB       LYS  19  -0.742  -1.322   0.188
  166   1HG   LYS  19          1HG       LYS  19   0.771   0.479  -0.877
  167   2HG   LYS  19          2HG       LYS  19  -0.143   0.190  -2.376
  168   1HD   LYS  19          1HD       LYS  19  -1.410   1.895  -1.424
  169   2HD   LYS  19          2HD       LYS  19  -2.238   0.465  -0.763
  170   1HE   LYS  19          1HE       LYS  19  -0.141   0.910   1.027
  171   2HE   LYS  19          2HE       LYS  19  -0.700   2.547   0.619
  172   1HZ   LYS  19          1HZ       LYS  19  -2.014   1.893   2.359
  173   2HZ   LYS  19          2HZ       LYS  19  -2.977   1.599   1.053
  174   3HZ   LYS  19          3HZ       LYS  19  -2.208   0.351   1.809
  175    H    MET  20           H        MET  20   1.547  -4.056   0.509
  176    HA   MET  20           HA       MET  20   2.470  -2.401   2.717
  177   1HB   MET  20          1HB       MET  20   2.069  -5.304   2.140
  178   2HB   MET  20          2HB       MET  20   3.285  -4.886   3.371
  179   1HG   MET  20          1HG       MET  20   0.404  -3.917   3.312
  180   2HG   MET  20          2HG       MET  20   1.034  -5.203   4.355
  181   1HE   MET  20          1HE       MET  20   1.633  -0.841   4.133
  182   2HE   MET  20          2HE       MET  20   0.346  -1.892   3.496
  183   3HE   MET  20          3HE       MET  20   0.189  -1.177   5.119
  184    H    ARG  21           H        ARG  21   4.688  -2.955   3.705
  185    HA   ARG  21           HA       ARG  21   6.969  -2.885   3.539
  186   1HB   ARG  21          1HB       ARG  21   6.280  -5.043   2.085
  187   2HB   ARG  21          2HB       ARG  21   6.987  -4.052   0.787
  188   1HG   ARG  21          1HG       ARG  21   9.103  -4.047   1.755
  189   2HG   ARG  21          2HG       ARG  21   8.465  -4.285   3.400
  190   1HD   ARG  21          1HD       ARG  21   8.956  -6.472   3.169
  191   2HD   ARG  21          2HD       ARG  21   7.634  -6.562   1.985
  192    HE   ARG  21           HE       ARG  21  10.205  -5.654   0.909
  193   1HH1  ARG  21          2HH2      ARG  21   8.045  -8.369   1.590
  194   2HH1  ARG  21          1HH2      ARG  21   8.766  -9.421   0.392
  195   1HH2  ARG  21          2HH1      ARG  21  11.158  -7.044  -0.673
  196   2HH2  ARG  21          1HH1      ARG  21  10.541  -8.665  -0.898
  197    H    ARG  22           H        ARG  22   4.900  -1.069   1.849
  198    HA   ARG  22           HA       ARG  22   6.909   0.218   0.099
  199   1HB   ARG  22          1HB       ARG  22   3.951   0.057   0.248
  200   2HB   ARG  22          2HB       ARG  22   4.599   1.653  -0.198
  201   1HG   ARG  22          1HG       ARG  22   4.163  -0.076  -2.101
  202   2HG   ARG  22          2HG       ARG  22   5.710   0.804  -2.103
  203   1HD   ARG  22          1HD       ARG  22   6.786  -1.170  -2.046
  204   2HD   ARG  22          2HD       ARG  22   6.084  -1.467  -0.440
  205    HE   ARG  22           HE       ARG  22   4.051  -2.285  -1.950
  206   1HH1  ARG  22          2HH2      ARG  22   7.525  -2.771  -2.394
  207   2HH1  ARG  22          1HH2      ARG  22   7.344  -4.304  -3.218
  208   1HH2  ARG  22          2HH1      ARG  22   3.812  -4.310  -3.038
  209   2HH2  ARG  22          1HH1      ARG  22   5.227  -5.181  -3.585
  210    H    ASN  23           H        ASN  23   7.980   0.690   2.357
  211    HA   ASN  23           HA       ASN  23   6.830   3.226   3.418
  212   1HB   ASN  23          1HB       ASN  23   7.068   1.317   5.020
  213   2HB   ASN  23          2HB       ASN  23   8.818   1.324   4.712
  214   1HD2  ASN  23          1HD2      ASN  23   7.840   1.697   7.298
  215   2HD2  ASN  23          2HD2      ASN  23   8.126   3.351   7.796
  216    H    GLN  24           H        GLN  24  10.011   2.564   4.416
  217    HA   GLN  24           HA       GLN  24  11.426   3.695   2.171
  218   1HB   GLN  24          1HB       GLN  24  10.078   5.549   3.784
  219   2HB   GLN  24          2HB       GLN  24  11.757   5.582   4.374
  220   1HG   GLN  24          1HG       GLN  24  12.275   5.559   1.744
  221   2HG   GLN  24          2HG       GLN  24  10.657   6.290   1.674
  222   1HE2  GLN  24          1HE2      GLN  24  11.656   8.263   0.893
  223   2HE2  GLN  24          2HE2      GLN  24  12.447   9.352   2.012
  224    H    PHE  25           H        PHE  25  11.155   2.601   5.490
  225    HA   PHE  25           HA       PHE  25  13.533   2.773   6.680
  226   1HB   PHE  25          1HB       PHE  25  13.278   0.133   6.995
  227   2HB   PHE  25          2HB       PHE  25  12.190   1.293   7.777
  228    HD1  PHE  25           1HD      PHE  25  11.634   1.255   4.269
  229    HD2  PHE  25           2HD      PHE  25  10.780  -0.918   7.875
  230    HE1  PHE  25           1HE      PHE  25   9.690   0.183   3.163
  231    HE2  PHE  25           2HE      PHE  25   8.837  -1.990   6.769
  232    HZ   PHE  25           HZ       PHE  25   8.292  -1.440   4.413
  233    H    TRP  26           H        TRP  26  12.952   0.419   4.002
  234    HA   TRP  26           HA       TRP  26  15.736  -0.291   3.824
  235   1HB   TRP  26          1HB       TRP  26  14.818  -1.121   1.491
  236   2HB   TRP  26          2HB       TRP  26  14.403  -1.954   2.995
  237    HD1  TRP  26           HD       TRP  26  11.998  -2.657   2.984
  238    HE1  TRP  26           1HE      TRP  26   9.767  -1.741   2.165
  239    HE3  TRP  26           3HE      TRP  26  13.643   1.703   0.867
  240    HZ2  TRP  26           2HZ      TRP  26   8.802   0.598   0.760
  241    HZ3  TRP  26           3HZ      TRP  26  12.041   3.247  -0.200
  242    HH2  TRP  26           HH       TRP  26   9.623   2.711  -0.263
  243    H    VAL  27           H        VAL  27  15.539   2.516   3.853
  244    HA   VAL  27           HA       VAL  27  15.733   3.487   1.109
  245    HB   VAL  27           HB       VAL  27  15.497   4.586   3.798
  246   1HG1  VAL  27          1HG1      VAL  27  17.945   5.064   3.314
  247   2HG1  VAL  27          2HG1      VAL  27  17.408   6.019   1.911
  248   3HG1  VAL  27          3HG1      VAL  27  16.936   6.510   3.556
  249   1HG2  VAL  27          1HG2      VAL  27  14.051   5.936   2.684
  250   2HG2  VAL  27          2HG2      VAL  27  15.272   6.380   1.468
  251   3HG2  VAL  27          3HG2      VAL  27  14.345   4.871   1.288
  252    H    LYS  28           H        LYS  28  17.666   1.460   2.674
  253    HA   LYS  28           HA       LYS  28  20.089   2.590   1.405
  254   1HB   LYS  28          1HB       LYS  28  19.618   2.544   4.225
  255   2HB   LYS  28          2HB       LYS  28  20.845   1.308   3.860
  256   1HG   LYS  28          1HG       LYS  28  21.053   4.022   2.560
  257   2HG   LYS  28          2HG       LYS  28  21.569   3.826   4.252
  258   1HD   LYS  28          1HD       LYS  28  22.930   1.797   3.428
  259   2HD   LYS  28          2HD       LYS  28  22.629   2.409   1.784
  260   1HE   LYS  28          1HE       LYS  28  24.115   4.099   2.026
  261   2HE   LYS  28          2HE       LYS  28  23.512   4.507   3.647
  262   1HZ   LYS  28          1HZ       LYS  28  25.856   3.604   3.377
  263   2HZ   LYS  28          2HZ       LYS  28  24.922   3.022   4.606
  264   3HZ   LYS  28          3HZ       LYS  28  25.136   2.126   3.238
  265    H    VAL  29           H        VAL  29  18.776   0.756   0.069
  266    HA   VAL  29           HA       VAL  29  19.788  -1.905   0.901
  267    HB   VAL  29           HB       VAL  29  18.292  -2.557  -1.146
  268   1HG1  VAL  29          1HG1      VAL  29  17.070  -1.391   1.393
  269   2HG1  VAL  29          2HG1      VAL  29  16.320  -2.604   0.328
  270   3HG1  VAL  29          3HG1      VAL  29  17.786  -3.014   1.250
  271   1HG2  VAL  29          1HG2      VAL  29  17.074   0.137  -0.430
  272   2HG2  VAL  29          2HG2      VAL  29  18.118  -0.108  -1.851
  273   3HG2  VAL  29          3HG2      VAL  29  16.571  -0.980  -1.722
  274    H    GLN  30           H        GLN  30  22.013  -1.016   0.365
  275    HA   GLN  30           HA       GLN  30  22.931  -0.177  -2.071
  276   1HB   GLN  30          1HB       GLN  30  24.055  -1.180   0.248
  277   2HB   GLN  30          2HB       GLN  30  24.553  -2.378  -0.971
  278   1HG   GLN  30          1HG       GLN  30  25.476  -0.617  -2.386
  279   2HG   GLN  30          2HG       GLN  30  24.870   0.635  -1.279
  280   1HE2  GLN  30          1HE2      GLN  30  27.672  -0.276  -2.218
  281   2HE2  GLN  30          2HE2      GLN  30  28.572  -0.452  -0.727
  282    H    ARG  31           H        ARG  31  22.572  -3.648  -1.135
  283    HA   ARG  31           HA       ARG  31  23.194  -4.725  -3.655
  284   1HB   ARG  31          1HB       ARG  31  21.840  -6.696  -2.833
  285   2HB   ARG  31          2HB       ARG  31  23.086  -6.126  -1.696
  286   1HG   ARG  31          1HG       ARG  31  21.445  -5.961  -0.150
  287   2HG   ARG  31          2HG       ARG  31  20.818  -4.583  -1.087
  288   1HD   ARG  31          1HD       ARG  31  18.938  -5.889  -1.177
  289   2HD   ARG  31          2HD       ARG  31  19.797  -6.615  -2.552
  290    HE   ARG  31           HE       ARG  31  20.161  -8.547  -1.303
  291   1HH1  ARG  31          2HH2      ARG  31  18.932  -5.928   0.730
  292   2HH1  ARG  31          1HH2      ARG  31  18.635  -6.957   2.113
  293   1HH2  ARG  31          2HH1      ARG  31  19.768  -9.906   0.524
  294   2HH2  ARG  31          1HH1      ARG  31  19.111  -9.225   1.996
  295    H    GLY  32           H        GLY  32  20.197  -3.304  -2.393
  296   1HA   GLY  32          1HA       GLY  32  18.496  -2.389  -3.730
  297   2HA   GLY  32          2HA       GLY  32  19.123  -3.280  -5.136
  Start of MODEL   15
    1    HA   PRO   1           HA       PRO   1 -17.050  12.596  -5.670
    2   1HB   PRO   1          1HB       PRO   1 -14.868  11.666  -7.011
    3   2HB   PRO   1          2HB       PRO   1 -15.988  12.862  -7.742
    4   1HG   PRO   1          1HG       PRO   1 -13.382  13.427  -6.300
    5   2HG   PRO   1          2HG       PRO   1 -13.875  14.009  -7.923
    6   1HD   PRO   1          1HD       PRO   1 -14.212  15.548  -5.699
    7   2HD   PRO   1          2HD       PRO   1 -15.467  15.509  -6.974
    8    HA   PRO   2           HA       PRO   2 -15.110  10.913  -2.021
    9   1HB   PRO   2          1HB       PRO   2 -16.635   8.663  -1.825
   10   2HB   PRO   2          2HB       PRO   2 -17.312  10.295  -1.513
   11   1HG   PRO   2          1HG       PRO   2 -17.435   8.718  -4.100
   12   2HG   PRO   2          2HG       PRO   2 -18.804   9.473  -3.219
   13   1HD   PRO   2          1HD       PRO   2 -17.570  10.746  -5.290
   14   2HD   PRO   2          2HD       PRO   2 -18.082  11.660  -3.839
   15    H    LEU   3           H        LEU   3 -13.976   8.838  -1.470
   16    HA   LEU   3           HA       LEU   3 -13.398   6.882  -3.458
   17   1HB   LEU   3          1HB       LEU   3 -12.257   8.953  -4.428
   18   2HB   LEU   3          2HB       LEU   3 -11.151   8.877  -3.036
   19    HG   LEU   3           HG       LEU   3 -10.229   7.688  -5.020
   20   1HD1  LEU   3          1HD1      LEU   3 -11.000   5.551  -3.034
   21   2HD1  LEU   3          2HD1      LEU   3  -9.422   5.869  -3.793
   22   3HD1  LEU   3          3HD1      LEU   3 -10.016   6.933  -2.496
   23   1HD2  LEU   3          1HD2      LEU   3 -11.677   6.541  -6.315
   24   2HD2  LEU   3          2HD2      LEU   3 -11.765   5.315  -5.027
   25   3HD2  LEU   3          3HD2      LEU   3 -12.946   6.646  -5.071
   26    H    SER   4           H        SER   4 -12.720   5.124  -2.370
   27    HA   SER   4           HA       SER   4 -12.027   3.830  -0.612
   28   1HB   SER   4          1HB       SER   4  -9.924   5.435  -1.383
   29   2HB   SER   4          2HB       SER   4 -10.017   5.760   0.364
   30    HG   SER   4           HG       SER   4  -8.756   3.850  -0.437
   31    H    GLN   5           H        GLN   5 -13.602   3.702   0.909
   32    HA   GLN   5           HA       GLN   5 -13.304   5.273   3.317
   33   1HB   GLN   5          1HB       GLN   5 -15.150   6.174   1.245
   34   2HB   GLN   5          2HB       GLN   5 -16.008   5.771   2.751
   35   1HG   GLN   5          1HG       GLN   5 -15.356   7.791   3.518
   36   2HG   GLN   5          2HG       GLN   5 -13.718   7.109   3.626
   37   1HE2  GLN   5          1HE2      GLN   5 -12.939   9.315   3.248
   38   2HE2  GLN   5          2HE2      GLN   5 -12.879   9.940   1.614
   39    H    GLU   6           H        GLU   6 -16.418   4.100   2.084
   40    HA   GLU   6           HA       GLU   6 -16.158   1.776   3.936
   41   1HB   GLU   6          1HB       GLU   6 -18.550   3.517   3.238
   42   2HB   GLU   6          2HB       GLU   6 -18.672   1.977   4.122
   43   1HG   GLU   6          1HG       GLU   6 -16.575   3.635   5.258
   44   2HG   GLU   6          2HG       GLU   6 -18.106   4.535   5.195
   45    H    THR   7           H        THR   7 -15.205   1.594   1.305
   46    HA   THR   7           HA       THR   7 -16.719  -0.637   0.357
   47    HB   THR   7           HB       THR   7 -17.275   2.053  -0.812
   48    HG1  THR   7           1HG      THR   7 -19.169   1.273  -0.438
   49   1HG2  THR   7          1HG2      THR   7 -16.617   1.489  -2.897
   50   2HG2  THR   7          2HG2      THR   7 -16.180  -0.154  -2.370
   51   3HG2  THR   7          3HG2      THR   7 -17.851   0.206  -2.868
   52    H    PHE   8           H        PHE   8 -15.345   1.597  -1.980
   53    HA   PHE   8           HA       PHE   8 -13.517  -0.160  -3.072
   54   1HB   PHE   8          1HB       PHE   8 -12.228   2.231  -3.365
   55   2HB   PHE   8          2HB       PHE   8 -13.572   1.675  -4.376
   56    HD1  PHE   8           1HD      PHE   8 -13.780   2.817  -0.832
   57    HD2  PHE   8           2HD      PHE   8 -14.589   3.732  -4.951
   58    HE1  PHE   8           1HE      PHE   8 -15.123   4.781  -0.132
   59    HE2  PHE   8           2HE      PHE   8 -15.932   5.696  -4.251
   60    HZ   PHE   8           HZ       PHE   8 -16.199   6.220  -1.841
   61    H    SER   9           H        SER   9 -13.413   1.319   0.043
   62    HA   SER   9           HA       SER   9 -10.524   1.222   0.343
   63   1HB   SER   9          1HB       SER   9 -10.993   1.824   2.656
   64   2HB   SER   9          2HB       SER   9 -12.009   2.811   1.578
   65    HG   SER   9           HG       SER   9 -12.712   0.866   3.396
   66    H    ASP  10           H        ASP  10 -13.308  -0.881   1.010
   67    HA   ASP  10           HA       ASP  10 -12.092  -2.720   2.752
   68   1HB   ASP  10          1HB       ASP  10 -13.827  -4.005   0.801
   69   2HB   ASP  10          2HB       ASP  10 -14.084  -3.731   2.538
   70    H    LEU  11           H        LEU  11 -11.741  -2.227  -0.727
   71    HA   LEU  11           HA       LEU  11 -10.392  -4.781  -1.138
   72   1HB   LEU  11          1HB       LEU  11  -9.835  -3.175  -3.326
   73   2HB   LEU  11          2HB       LEU  11 -11.239  -4.258  -3.168
   74    HG   LEU  11           HG       LEU  11 -12.294  -2.234  -3.646
   75   1HD1  LEU  11          1HD1      LEU  11 -12.707  -3.228  -1.195
   76   2HD1  LEU  11          2HD1      LEU  11 -12.030  -1.655  -0.710
   77   3HD1  LEU  11          3HD1      LEU  11 -13.488  -1.720  -1.728
   78   1HD2  LEU  11          1HD2      LEU  11 -10.322  -0.779  -1.839
   79   2HD2  LEU  11          2HD2      LEU  11 -10.096  -0.970  -3.594
   80   3HD2  LEU  11          3HD2      LEU  11 -11.490  -0.055  -2.971
   81    H    TRP  12           H        TRP  12  -8.924  -2.050  -2.673
   82    HA   TRP  12           HA       TRP  12  -6.501  -1.964  -2.682
   83   1HB   TRP  12          1HB       TRP  12  -7.158  -0.327  -0.258
   84   2HB   TRP  12          2HB       TRP  12  -6.149   0.078  -1.653
   85    HD1  TRP  12           HD       TRP  12  -8.949   1.452  -0.216
   86    HE1  TRP  12           1HE      TRP  12 -10.665   2.411  -1.836
   87    HE3  TRP  12           3HE      TRP  12  -7.460  -0.949  -4.484
   88    HZ2  TRP  12           2HZ      TRP  12 -11.321   2.172  -4.645
   89    HZ3  TRP  12           3HZ      TRP  12  -8.653  -0.559  -6.609
   90    HH2  TRP  12           HH       TRP  12 -10.581   0.995  -6.706
   91    H    LYS  13           H        LYS  13  -7.973  -2.805   0.461
   92    HA   LYS  13           HA       LYS  13  -5.689  -3.208   1.996
   93   1HB   LYS  13          1HB       LYS  13  -8.202  -3.451   2.584
   94   2HB   LYS  13          2HB       LYS  13  -8.027  -5.131   2.023
   95   1HG   LYS  13          1HG       LYS  13  -5.804  -4.840   3.629
   96   2HG   LYS  13          2HG       LYS  13  -7.000  -3.835   4.480
   97   1HD   LYS  13          1HD       LYS  13  -8.505  -6.045   3.822
   98   2HD   LYS  13          2HD       LYS  13  -6.907  -6.774   4.111
   99   1HE   LYS  13          1HE       LYS  13  -8.343  -4.877   6.013
  100   2HE   LYS  13          2HE       LYS  13  -8.281  -6.644   6.187
  101   1HZ   LYS  13          1HZ       LYS  13  -5.782  -5.219   5.910
  102   2HZ   LYS  13          2HZ       LYS  13  -6.579  -5.091   7.349
  103   3HZ   LYS  13          3HZ       LYS  13  -6.137  -6.575   6.780
  104    H    LEU  14           H        LEU  14  -6.408  -4.647  -0.969
  105    HA   LEU  14           HA       LEU  14  -5.061  -7.194  -0.364
  106   1HB   LEU  14          1HB       LEU  14  -5.511  -7.563  -2.850
  107   2HB   LEU  14          2HB       LEU  14  -6.949  -7.376  -1.818
  108    HG   LEU  14           HG       LEU  14  -7.036  -6.034  -3.958
  109   1HD1  LEU  14          1HD1      LEU  14  -7.725  -5.317  -1.319
  110   2HD1  LEU  14          2HD1      LEU  14  -6.986  -3.857  -2.018
  111   3HD1  LEU  14          3HD1      LEU  14  -8.379  -4.620  -2.820
  112   1HD2  LEU  14          1HD2      LEU  14  -5.390  -4.572  -4.523
  113   2HD2  LEU  14          2HD2      LEU  14  -5.244  -3.960  -2.858
  114   3HD2  LEU  14          3HD2      LEU  14  -4.400  -5.453  -3.335
  115    H    LEU  15           H        LEU  15  -4.548  -4.139  -2.144
  116    HA   LEU  15           HA       LEU  15  -1.971  -5.008  -3.182
  117   1HB   LEU  15          1HB       LEU  15  -2.425  -3.330  -4.600
  118   2HB   LEU  15          2HB       LEU  15  -3.850  -2.882  -3.632
  119    HG   LEU  15           HG       LEU  15  -2.186  -1.700  -2.049
  120   1HD1  LEU  15          1HD1      LEU  15  -0.212  -2.913  -3.186
  121   2HD1  LEU  15          2HD1      LEU  15  -0.417  -1.748  -4.516
  122   3HD1  LEU  15          3HD1      LEU  15  -0.017  -1.170  -2.881
  123   1HD2  LEU  15          1HD2      LEU  15  -2.460  -0.666  -4.904
  124   2HD2  LEU  15          2HD2      LEU  15  -3.717  -0.544  -3.649
  125   3HD2  LEU  15          3HD2      LEU  15  -2.171   0.316  -3.448
  126    H    LYS  16           H        LYS  16  -3.134  -3.929  -0.174
  127    HA   LYS  16           HA       LYS  16  -1.320  -2.159   0.853
  128   1HB   LYS  16          1HB       LYS  16  -2.714  -2.770   2.531
  129   2HB   LYS  16          2HB       LYS  16  -2.901  -4.424   1.901
  130   1HG   LYS  16          1HG       LYS  16  -0.283  -3.565   3.142
  131   2HG   LYS  16          2HG       LYS  16  -1.644  -4.049   4.182
  132   1HD   LYS  16          1HD       LYS  16  -0.163  -5.690   2.107
  133   2HD   LYS  16          2HD       LYS  16  -0.466  -6.070   3.820
  134   1HE   LYS  16          1HE       LYS  16  -3.003  -5.928   3.088
  135   2HE   LYS  16          2HE       LYS  16  -2.342  -6.220   1.464
  136   1HZ   LYS  16          1HZ       LYS  16  -2.070  -7.924   3.832
  137   2HZ   LYS  16          2HZ       LYS  16  -2.846  -8.274   2.420
  138   3HZ   LYS  16          3HZ       LYS  16  -1.201  -8.150   2.449
  139    H    LYS  17           H        LYS  17  -0.825  -5.720   0.570
  140    HA   LYS  17           HA       LYS  17   1.747  -5.846   1.654
  141   1HB   LYS  17          1HB       LYS  17   0.780  -7.915   1.219
  142   2HB   LYS  17          2HB       LYS  17   0.224  -7.434  -0.402
  143   1HG   LYS  17          1HG       LYS  17   2.043  -8.544  -1.179
  144   2HG   LYS  17          2HG       LYS  17   2.988  -7.160  -0.578
  145   1HD   LYS  17          1HD       LYS  17   4.066  -8.839   0.577
  146   2HD   LYS  17          2HD       LYS  17   2.748  -8.525   1.732
  147   1HE   LYS  17          1HE       LYS  17   1.428 -10.344   0.798
  148   2HE   LYS  17          2HE       LYS  17   2.622 -10.599  -0.493
  149   1HZ   LYS  17          1HZ       LYS  17   3.361 -12.107   0.933
  150   2HZ   LYS  17          2HZ       LYS  17   4.128 -10.832   1.644
  151   3HZ   LYS  17          3HZ       LYS  17   2.704 -11.388   2.263
  152    H    TRP  18           H        TRP  18   0.647  -4.610  -1.458
  153    HA   TRP  18           HA       TRP  18   3.490  -4.238  -2.264
  154   1HB   TRP  18          1HB       TRP  18   2.071  -3.646  -4.484
  155   2HB   TRP  18          2HB       TRP  18   2.674  -5.264  -4.099
  156    HD1  TRP  18           HD       TRP  18  -0.372  -3.518  -5.065
  157    HE1  TRP  18           1HE      TRP  18  -2.457  -4.944  -4.738
  158    HE3  TRP  18           3HE      TRP  18   1.624  -7.206  -2.130
  159    HZ2  TRP  18           2HZ      TRP  18  -3.182  -7.390  -3.371
  160    HZ3  TRP  18           3HZ      TRP  18   0.208  -9.064  -1.336
  161    HH2  TRP  18           HH       TRP  18  -2.191  -9.170  -1.945
  162    H    LYS  19           H        LYS  19   0.712  -2.685  -1.023
  163    HA   LYS  19           HA       LYS  19   1.415  -0.071  -2.202
  164   1HB   LYS  19          1HB       LYS  19  -0.869  -0.120  -2.155
  165   2HB   LYS  19          2HB       LYS  19  -0.923  -1.278  -0.805
  166   1HG   LYS  19          1HG       LYS  19  -0.229   0.539   0.752
  167   2HG   LYS  19          2HG       LYS  19  -0.250   1.689  -0.606
  168   1HD   LYS  19          1HD       LYS  19  -2.584   1.573  -0.837
  169   2HD   LYS  19          2HD       LYS  19  -2.686   0.003  -0.006
  170   1HE   LYS  19          1HE       LYS  19  -1.821   1.243   2.081
  171   2HE   LYS  19          2HE       LYS  19  -2.184   2.742   1.199
  172   1HZ   LYS  19          1HZ       LYS  19  -4.198   2.487   1.989
  173   2HZ   LYS  19          2HZ       LYS  19  -4.402   1.249   0.919
  174   3HZ   LYS  19          3HZ       LYS  19  -3.942   0.930   2.471
  175    H    MET  20           H        MET  20   2.432  -1.994   0.339
  176    HA   MET  20           HA       MET  20   2.934   0.349   2.104
  177   1HB   MET  20          1HB       MET  20   2.858  -2.647   2.594
  178   2HB   MET  20          2HB       MET  20   3.515  -1.490   3.777
  179   1HG   MET  20          1HG       MET  20   0.739  -1.292   2.562
  180   2HG   MET  20          2HG       MET  20   1.080  -2.092   4.105
  181   1HE   MET  20          1HE       MET  20   1.193   1.506   2.212
  182   2HE   MET  20          2HE       MET  20  -0.341   0.656   2.521
  183   3HE   MET  20          3HE       MET  20   0.036   2.160   3.395
  184    H    ARG  21           H        ARG  21   5.049   0.733   2.894
  185    HA   ARG  21           HA       ARG  21   7.326   0.877   2.722
  186   1HB   ARG  21          1HB       ARG  21   6.779  -1.791   3.000
  187   2HB   ARG  21          2HB       ARG  21   7.682  -1.784   1.466
  188   1HG   ARG  21          1HG       ARG  21   9.569  -0.701   2.474
  189   2HG   ARG  21          2HG       ARG  21   8.649  -0.320   3.950
  190   1HD   ARG  21          1HD       ARG  21   8.335  -2.901   4.144
  191   2HD   ARG  21          2HD       ARG  21   9.684  -2.999   2.991
  192    HE   ARG  21           HE       ARG  21  10.651  -1.302   4.905
  193   1HH1  ARG  21          2HH2      ARG  21   9.112  -4.484   4.993
  194   2HH1  ARG  21          1HH2      ARG  21   9.961  -5.007   6.431
  195   1HH2  ARG  21          2HH1      ARG  21  11.772  -1.992   6.805
  196   2HH2  ARG  21          1HH1      ARG  21  11.478  -3.586   7.464
  197    H    ARG  22           H        ARG  22   5.430   1.436   0.400
  198    HA   ARG  22           HA       ARG  22   7.239   0.982  -1.894
  199   1HB   ARG  22          1HB       ARG  22   5.059   2.386  -2.831
  200   2HB   ARG  22          2HB       ARG  22   5.195   0.611  -2.796
  201   1HG   ARG  22          1HG       ARG  22   3.107   1.194  -1.726
  202   2HG   ARG  22          2HG       ARG  22   4.234   0.682  -0.446
  203   1HD   ARG  22          1HD       ARG  22   4.705   3.438  -0.772
  204   2HD   ARG  22          2HD       ARG  22   2.938   3.266  -0.854
  205    HE   ARG  22           HE       ARG  22   4.109   1.768   1.338
  206   1HH1  ARG  22          2HH2      ARG  22   2.998   4.945   0.253
  207   2HH1  ARG  22          1HH2      ARG  22   2.660   5.529   1.867
  208   1HH2  ARG  22          2HH1      ARG  22   3.662   2.540   3.470
  209   2HH2  ARG  22          1HH1      ARG  22   3.038   4.158   3.701
  210    H    ASN  23           H        ASN  23   8.779   2.490  -0.616
  211    HA   ASN  23           HA       ASN  23   8.143   5.302  -1.380
  212   1HB   ASN  23          1HB       ASN  23   8.324   4.599   1.140
  213   2HB   ASN  23          2HB       ASN  23  10.071   4.563   0.817
  214   1HD2  ASN  23          1HD2      ASN  23   9.464   6.723  -1.359
  215   2HD2  ASN  23          2HD2      ASN  23   9.415   8.211  -0.438
  216    H    GLN  24           H        GLN  24  11.091   5.641  -0.306
  217    HA   GLN  24           HA       GLN  24  12.288   5.245  -2.970
  218   1HB   GLN  24          1HB       GLN  24  13.166   6.720  -0.461
  219   2HB   GLN  24          2HB       GLN  24  14.160   6.593  -1.931
  220   1HG   GLN  24          1HG       GLN  24  11.304   7.517  -2.170
  221   2HG   GLN  24          2HG       GLN  24  12.531   8.657  -1.574
  222   1HE2  GLN  24          1HE2      GLN  24  11.020   8.817  -4.078
  223   2HE2  GLN  24          2HE2      GLN  24  12.194   8.770  -5.376
  224    H    PHE  25           H        PHE  25  14.235   5.207  -0.045
  225    HA   PHE  25           HA       PHE  25  15.508   2.746  -0.872
  226   1HB   PHE  25          1HB       PHE  25  15.991   3.626   1.878
  227   2HB   PHE  25          2HB       PHE  25  17.126   3.419   0.533
  228    HD1  PHE  25           1HD      PHE  25  14.509   5.759   1.845
  229    HD2  PHE  25           2HD      PHE  25  18.079   5.287  -0.496
  230    HE1  PHE  25           1HE      PHE  25  14.681   8.222   1.611
  231    HE2  PHE  25           2HE      PHE  25  18.252   7.750  -0.730
  232    HZ   PHE  25           HZ       PHE  25  16.553   9.218   0.324
  233    H    TRP  26           H        TRP  26  13.081   3.711   1.551
  234    HA   TRP  26           HA       TRP  26  13.022   1.512   3.215
  235   1HB   TRP  26          1HB       TRP  26  10.675   2.994   1.990
  236   2HB   TRP  26          2HB       TRP  26  10.589   1.948   3.415
  237    HD1  TRP  26           HD       TRP  26  11.320   2.925   5.697
  238    HE1  TRP  26           1HE      TRP  26  11.948   5.244   6.545
  239    HE3  TRP  26           3HE      TRP  26  11.939   5.290   1.200
  240    HZ2  TRP  26           2HZ      TRP  26  12.636   7.819   5.417
  241    HZ3  TRP  26           3HZ      TRP  26  12.579   7.672   1.127
  242    HH2  TRP  26           HH       TRP  26  12.930   8.948   3.221
  243    H    VAL  27           H        VAL  27  12.256   1.669  -0.194
  244    HA   VAL  27           HA       VAL  27  10.735  -0.806  -0.235
  245    HB   VAL  27           HB       VAL  27  11.449   1.340  -2.056
  246   1HG1  VAL  27          1HG1      VAL  27  13.025  -0.493  -2.867
  247   2HG1  VAL  27          2HG1      VAL  27  11.579  -1.468  -3.222
  248   3HG1  VAL  27          3HG1      VAL  27  11.841   0.076  -4.068
  249   1HG2  VAL  27          1HG2      VAL  27   9.348  -0.735  -1.631
  250   2HG2  VAL  27          2HG2      VAL  27   9.182   1.008  -1.947
  251   3HG2  VAL  27          3HG2      VAL  27   9.510  -0.113  -3.290
  252    H    LYS  28           H        LYS  28  13.741  -0.418   0.738
  253    HA   LYS  28           HA       LYS  28  14.557  -3.070   0.022
  254   1HB   LYS  28          1HB       LYS  28  15.237  -0.977  -1.833
  255   2HB   LYS  28          2HB       LYS  28  16.723  -1.541  -1.030
  256   1HG   LYS  28          1HG       LYS  28  16.086  -3.892  -1.556
  257   2HG   LYS  28          2HG       LYS  28  14.646  -3.293  -2.413
  258   1HD   LYS  28          1HD       LYS  28  17.171  -1.990  -3.237
  259   2HD   LYS  28          2HD       LYS  28  17.107  -3.735  -3.583
  260   1HE   LYS  28          1HE       LYS  28  15.561  -3.458  -5.210
  261   2HE   LYS  28          2HE       LYS  28  14.584  -2.366  -4.204
  262   1HZ   LYS  28          1HZ       LYS  28  15.930  -0.577  -4.828
  263   2HZ   LYS  28          2HZ       LYS  28  17.045  -1.543  -5.566
  264   3HZ   LYS  28          3HZ       LYS  28  15.540  -1.370  -6.220
  265    H    VAL  29           H        VAL  29  14.143  -1.548   2.408
  266    HA   VAL  29           HA       VAL  29  16.944  -1.294   3.399
  267    HB   VAL  29           HB       VAL  29  14.368   0.071   4.262
  268   1HG1  VAL  29          1HG1      VAL  29  17.015  -0.327   5.630
  269   2HG1  VAL  29          2HG1      VAL  29  16.217   1.256   5.787
  270   3HG1  VAL  29          3HG1      VAL  29  15.381  -0.219   6.328
  271   1HG2  VAL  29          1HG2      VAL  29  15.159   1.886   3.149
  272   2HG2  VAL  29          2HG2      VAL  29  16.819   1.628   3.738
  273   3HG2  VAL  29          3HG2      VAL  29  16.230   0.735   2.315
  274    H    GLN  30           H        GLN  30  15.268  -3.754   3.084
  275    HA   GLN  30           HA       GLN  30  15.679  -4.763   5.789
  276   1HB   GLN  30          1HB       GLN  30  13.415  -3.775   5.952
  277   2HB   GLN  30          2HB       GLN  30  12.897  -4.748   4.554
  278   1HG   GLN  30          1HG       GLN  30  12.220  -5.904   6.576
  279   2HG   GLN  30          2HG       GLN  30  13.552  -6.814   5.831
  280   1HE2  GLN  30          1HE2      GLN  30  13.677  -7.709   8.102
  281   2HE2  GLN  30          2HE2      GLN  30  14.665  -6.842   9.258
  282    H    ARG  31           H        ARG  31  13.688  -5.661   2.914
  283    HA   ARG  31           HA       ARG  31  13.748  -7.517   1.577
  284   1HB   ARG  31          1HB       ARG  31  16.665  -7.094   2.242
  285   2HB   ARG  31          2HB       ARG  31  16.152  -8.481   1.252
  286   1HG   ARG  31          1HG       ARG  31  14.984  -5.837   0.514
  287   2HG   ARG  31          2HG       ARG  31  16.725  -6.039   0.205
  288   1HD   ARG  31          1HD       ARG  31  15.260  -8.428  -0.572
  289   2HD   ARG  31          2HD       ARG  31  14.581  -6.994  -1.373
  290    HE   ARG  31           HE       ARG  31  17.425  -6.907  -1.549
  291   1HH1  ARG  31          2HH2      ARG  31  14.626  -8.691  -2.768
  292   2HH1  ARG  31          1HH2      ARG  31  15.389  -9.123  -4.282
  293   1HH2  ARG  31          2HH1      ARG  31  18.433  -7.479  -3.549
  294   2HH2  ARG  31          1HH1      ARG  31  17.559  -8.432  -4.727
  295    H    GLY  32           H        GLY  32  12.425  -8.780   2.964
  296   1HA   GLY  32          1HA       GLY  32  13.442 -11.278   3.710
  297   2HA   GLY  32          2HA       GLY  32  13.464 -10.269   5.174
  Start of MODEL   16
    1    HA   PRO   1           HA       PRO   1 -13.727   4.451  11.455
    2   1HB   PRO   1          1HB       PRO   1 -11.381   3.121  11.068
    3   2HB   PRO   1          2HB       PRO   1 -11.711   4.036  12.575
    4   1HG   PRO   1          1HG       PRO   1 -12.097   1.066  12.105
    5   2HG   PRO   1          2HG       PRO   1 -11.195   1.847  13.443
    6   1HD   PRO   1          1HD       PRO   1 -13.786   1.058  13.747
    7   2HD   PRO   1          2HD       PRO   1 -13.218   2.600  14.456
    8    HA   PRO   2           HA       PRO   2 -14.965   2.296   7.810
    9   1HB   PRO   2          1HB       PRO   2 -13.784   3.829   5.892
   10   2HB   PRO   2          2HB       PRO   2 -15.093   4.467   6.940
   11   1HG   PRO   2          1HG       PRO   2 -12.104   4.772   7.342
   12   2HG   PRO   2          2HG       PRO   2 -13.338   6.074   7.330
   13   1HD   PRO   2          1HD       PRO   2 -12.467   4.961   9.661
   14   2HD   PRO   2          2HD       PRO   2 -14.196   5.369   9.440
   15    H    LEU   3           H        LEU   3 -13.474   2.005   5.459
   16    HA   LEU   3           HA       LEU   3 -10.843   0.931   6.107
   17   1HB   LEU   3          1HB       LEU   3 -12.141  -0.940   6.883
   18   2HB   LEU   3          2HB       LEU   3 -13.193  -0.880   5.448
   19    HG   LEU   3           HG       LEU   3 -10.276  -1.118   4.897
   20   1HD1  LEU   3          1HD1      LEU   3 -11.572  -2.859   6.808
   21   2HD1  LEU   3          2HD1      LEU   3 -11.207  -3.776   5.326
   22   3HD1  LEU   3          3HD1      LEU   3  -9.904  -2.925   6.190
   23   1HD2  LEU   3          1HD2      LEU   3 -12.195  -1.154   3.218
   24   2HD2  LEU   3          2HD2      LEU   3 -11.075  -2.534   3.120
   25   3HD2  LEU   3          3HD2      LEU   3 -12.660  -2.729   3.906
   26    H    SER   4           H        SER   4  -9.576   1.264   4.375
   27    HA   SER   4           HA       SER   4  -8.962   1.831   2.242
   28   1HB   SER   4          1HB       SER   4 -10.252  -0.602   2.151
   29   2HB   SER   4          2HB       SER   4 -11.147   0.337   0.933
   30    HG   SER   4           HG       SER   4  -9.331  -0.631   0.005
   31    H    GLN   5           H        GLN   5  -9.307   3.948   1.822
   32    HA   GLN   5           HA       GLN   5 -11.649   4.687   0.290
   33   1HB   GLN   5          1HB       GLN   5 -12.285   4.727   2.837
   34   2HB   GLN   5          2HB       GLN   5 -11.311   6.216   2.868
   35   1HG   GLN   5          1HG       GLN   5 -12.673   7.109   0.979
   36   2HG   GLN   5          2HG       GLN   5 -13.675   5.643   1.035
   37   1HE2  GLN   5          1HE2      GLN   5 -15.504   7.098   1.435
   38   2HE2  GLN   5          2HE2      GLN   5 -15.790   7.697   3.055
   39    H    GLU   6           H        GLU   6  -9.818   6.784   2.519
   40    HA   GLU   6           HA       GLU   6  -8.307   7.811   0.164
   41   1HB   GLU   6          1HB       GLU   6  -8.601  10.069   1.015
   42   2HB   GLU   6          2HB       GLU   6 -10.200   9.311   0.829
   43   1HG   GLU   6          1HG       GLU   6 -10.626   9.505   3.033
   44   2HG   GLU   6          2HG       GLU   6  -9.081   8.734   3.453
   45    H    THR   7           H        THR   7  -7.338   5.792   1.871
   46    HA   THR   7           HA       THR   7  -4.890   6.993   2.737
   47    HB   THR   7           HB       THR   7  -7.079   6.686   4.713
   48    HG1  THR   7           1HG      THR   7  -4.592   8.053   4.587
   49   1HG2  THR   7          1HG2      THR   7  -4.799   6.257   6.272
   50   2HG2  THR   7          2HG2      THR   7  -6.062   5.056   5.913
   51   3HG2  THR   7          3HG2      THR   7  -4.595   5.131   4.908
   52    H    PHE   8           H        PHE   8  -6.483   4.379   4.531
   53    HA   PHE   8           HA       PHE   8  -4.456   2.509   4.167
   54   1HB   PHE   8          1HB       PHE   8  -6.687   0.939   4.354
   55   2HB   PHE   8          2HB       PHE   8  -5.861   1.697   5.726
   56    HD1  PHE   8           1HD      PHE   8  -7.934   3.413   3.143
   57    HD2  PHE   8           2HD      PHE   8  -7.667   2.055   7.210
   58    HE1  PHE   8           1HE      PHE   8 -10.002   4.666   3.698
   59    HE2  PHE   8           2HE      PHE   8  -9.734   3.308   7.764
   60    HZ   PHE   8           HZ       PHE   8 -10.902   4.614   6.008
   61    H    SER   9           H        SER   9  -6.786   3.661   1.878
   62    HA   SER   9           HA       SER   9  -6.731   1.300   0.183
   63   1HB   SER   9          1HB       SER   9  -8.601   3.041   0.358
   64   2HB   SER   9          2HB       SER   9  -7.546   4.119  -0.587
   65    HG   SER   9           HG       SER   9  -8.285   3.093  -2.247
   66    H    ASP  10           H        ASP  10  -4.790   4.171   0.668
   67    HA   ASP  10           HA       ASP  10  -3.588   4.301  -1.918
   68   1HB   ASP  10          1HB       ASP  10  -3.581   5.969   0.106
   69   2HB   ASP  10          2HB       ASP  10  -2.158   5.043   0.631
   70    H    LEU  11           H        LEU  11  -3.178   2.174   0.832
   71    HA   LEU  11           HA       LEU  11  -0.558   1.223  -0.086
   72   1HB   LEU  11          1HB       LEU  11  -1.503  -0.525   1.864
   73   2HB   LEU  11          2HB       LEU  11  -0.458   0.889   2.143
   74    HG   LEU  11           HG       LEU  11  -2.231   1.354   3.586
   75   1HD1  LEU  11          1HD1      LEU  11  -3.173   3.277   2.724
   76   2HD1  LEU  11          2HD1      LEU  11  -1.948   2.989   1.465
   77   3HD1  LEU  11          3HD1      LEU  11  -3.636   2.493   1.195
   78   1HD2  LEU  11          1HD2      LEU  11  -4.555   0.775   3.157
   79   2HD2  LEU  11          2HD2      LEU  11  -4.176   0.330   1.476
   80   3HD2  LEU  11          3HD2      LEU  11  -3.548  -0.654   2.820
   81    H    TRP  12           H        TRP  12  -2.830  -1.117   1.132
   82    HA   TRP  12           HA       TRP  12  -2.871  -3.260  -0.037
   83   1HB   TRP  12          1HB       TRP  12  -5.141  -1.794  -1.322
   84   2HB   TRP  12          2HB       TRP  12  -5.124  -3.368  -0.516
   85    HD1  TRP  12           HD       TRP  12  -6.843  -0.427  -0.055
   86    HE1  TRP  12           1HE      TRP  12  -7.287   0.223   2.367
   87    HE3  TRP  12           3HE      TRP  12  -3.323  -3.361   2.226
   88    HZ2  TRP  12           2HZ      TRP  12  -6.246  -0.442   4.984
   89    HZ3  TRP  12           3HZ      TRP  12  -3.080  -3.326   4.681
   90    HH2  TRP  12           HH       TRP  12  -4.529  -1.876   6.071
   91    H    LYS  13           H        LYS  13  -2.916  -0.360  -2.106
   92    HA   LYS  13           HA       LYS  13  -3.010  -1.539  -4.628
   93   1HB   LYS  13          1HB       LYS  13  -3.070   0.842  -4.424
   94   2HB   LYS  13          2HB       LYS  13  -1.503   0.879  -3.580
   95   1HG   LYS  13          1HG       LYS  13  -0.305   0.663  -5.519
   96   2HG   LYS  13          2HG       LYS  13  -1.498  -0.436  -6.253
   97   1HD   LYS  13          1HD       LYS  13  -1.690   1.543  -7.538
   98   2HD   LYS  13          2HD       LYS  13  -3.036   1.659  -6.379
   99   1HE   LYS  13          1HE       LYS  13  -0.499   2.756  -5.352
  100   2HE   LYS  13          2HE       LYS  13  -1.099   3.599  -6.797
  101   1HZ   LYS  13          1HZ       LYS  13  -3.030   3.013  -4.749
  102   2HZ   LYS  13          2HZ       LYS  13  -1.901   4.156  -4.378
  103   3HZ   LYS  13          3HZ       LYS  13  -2.866   4.348  -5.702
  104    H    LEU  14           H        LEU  14  -0.731  -2.084  -2.168
  105    HA   LEU  14           HA       LEU  14   1.535  -2.600  -3.941
  106   1HB   LEU  14          1HB       LEU  14   2.464  -3.564  -1.730
  107   2HB   LEU  14          2HB       LEU  14   2.134  -1.816  -1.792
  108    HG   LEU  14           HG       LEU  14   1.255  -3.279   0.242
  109   1HD1  LEU  14          1HD1      LEU  14  -0.957  -1.766   0.020
  110   2HD1  LEU  14          2HD1      LEU  14   0.637  -1.057   0.373
  111   3HD1  LEU  14          3HD1      LEU  14  -0.002  -1.026  -1.288
  112   1HD2  LEU  14          1HD2      LEU  14  -0.659  -4.515  -0.093
  113   2HD2  LEU  14          2HD2      LEU  14  -1.225  -3.474  -1.422
  114   3HD2  LEU  14          3HD2      LEU  14   0.042  -4.688  -1.720
  115    H    LEU  15           H        LEU  15  -1.100  -4.371  -2.368
  116    HA   LEU  15           HA       LEU  15   0.061  -6.969  -3.074
  117   1HB   LEU  15          1HB       LEU  15  -2.431  -6.008  -1.658
  118   2HB   LEU  15          2HB       LEU  15  -2.283  -7.699  -2.193
  119    HG   LEU  15           HG       LEU  15  -1.204  -6.527   0.161
  120   1HD1  LEU  15          1HD1      LEU  15  -1.972  -8.949  -0.556
  121   2HD1  LEU  15          2HD1      LEU  15  -0.255  -9.158  -0.976
  122   3HD1  LEU  15          3HD1      LEU  15  -0.720  -8.753   0.694
  123   1HD2  LEU  15          1HD2      LEU  15   0.892  -5.902  -0.395
  124   2HD2  LEU  15          2HD2      LEU  15   1.232  -7.608  -0.771
  125   3HD2  LEU  15          3HD2      LEU  15   0.686  -6.505  -2.057
  126    H    LYS  16           H        LYS  16  -1.393  -4.548  -4.797
  127    HA   LYS  16           HA       LYS  16  -2.896  -6.444  -6.531
  128   1HB   LYS  16          1HB       LYS  16  -3.033  -3.464  -6.855
  129   2HB   LYS  16          2HB       LYS  16  -4.291  -4.697  -7.112
  130   1HG   LYS  16          1HG       LYS  16  -3.339  -3.449  -4.530
  131   2HG   LYS  16          2HG       LYS  16  -5.002  -3.684  -5.120
  132   1HD   LYS  16          1HD       LYS  16  -3.915  -6.276  -4.988
  133   2HD   LYS  16          2HD       LYS  16  -3.337  -5.466  -3.513
  134   1HE   LYS  16          1HE       LYS  16  -5.524  -6.531  -3.121
  135   2HE   LYS  16          2HE       LYS  16  -5.650  -4.763  -2.993
  136   1HZ   LYS  16          1HZ       LYS  16  -6.718  -4.644  -4.993
  137   2HZ   LYS  16          2HZ       LYS  16  -6.206  -6.124  -5.510
  138   3HZ   LYS  16          3HZ       LYS  16  -7.363  -6.014  -4.340
  139    H    LYS  17           H        LYS  17  -0.780  -3.522  -6.746
  140    HA   LYS  17           HA       LYS  17  -0.057  -4.166  -9.486
  141   1HB   LYS  17          1HB       LYS  17   1.107  -2.125  -9.452
  142   2HB   LYS  17          2HB       LYS  17  -0.246  -1.840  -8.331
  143   1HG   LYS  17          1HG       LYS  17   1.309  -2.573  -6.449
  144   2HG   LYS  17          2HG       LYS  17   2.636  -2.524  -7.634
  145   1HD   LYS  17          1HD       LYS  17   1.218  -0.308  -6.293
  146   2HD   LYS  17          2HD       LYS  17   2.826  -0.335  -7.055
  147   1HE   LYS  17          1HE       LYS  17   1.635  -0.332  -9.305
  148   2HE   LYS  17          2HE       LYS  17   0.127  -0.014  -8.419
  149   1HZ   LYS  17          1HZ       LYS  17   0.910   2.043  -8.993
  150   2HZ   LYS  17          2HZ       LYS  17   1.417   1.895  -7.431
  151   3HZ   LYS  17          3HZ       LYS  17   2.486   1.683  -8.669
  152    H    TRP  18           H        TRP  18   0.893  -5.297  -6.425
  153    HA   TRP  18           HA       TRP  18   3.132  -5.912  -5.724
  154   1HB   TRP  18          1HB       TRP  18   1.745  -7.842  -7.578
  155   2HB   TRP  18          2HB       TRP  18   3.283  -8.270  -6.814
  156    HD1  TRP  18           HD       TRP  18   3.004  -7.447  -3.932
  157    HE1  TRP  18           1HE      TRP  18   1.277  -8.433  -2.340
  158    HE3  TRP  18           3HE      TRP  18  -0.403  -9.116  -7.368
  159    HZ2  TRP  18           2HZ      TRP  18  -1.275  -9.785  -2.524
  160    HZ3  TRP  18           3HZ      TRP  18  -2.466 -10.246  -6.623
  161    HH2  TRP  18           HH       TRP  18  -2.916 -10.588  -4.211
  162    H    LYS  19           H        LYS  19   2.659  -6.135  -9.284
  163    HA   LYS  19           HA       LYS  19   5.454  -6.427  -9.856
  164   1HB   LYS  19          1HB       LYS  19   3.054  -5.564 -11.508
  165   2HB   LYS  19          2HB       LYS  19   4.688  -5.767 -12.185
  166   1HG   LYS  19          1HG       LYS  19   4.090  -8.074 -10.581
  167   2HG   LYS  19          2HG       LYS  19   2.713  -7.785 -11.672
  168   1HD   LYS  19          1HD       LYS  19   4.341  -7.594 -13.580
  169   2HD   LYS  19          2HD       LYS  19   5.645  -8.050 -12.459
  170   1HE   LYS  19          1HE       LYS  19   4.931 -10.233 -12.294
  171   2HE   LYS  19          2HE       LYS  19   3.221  -9.803 -12.521
  172   1HZ   LYS  19          1HZ       LYS  19   3.401 -10.095 -14.676
  173   2HZ   LYS  19          2HZ       LYS  19   4.831  -9.282 -14.798
  174   3HZ   LYS  19          3HZ       LYS  19   4.822 -10.877 -14.375
  175    H    MET  20           H        MET  20   3.834  -3.888  -8.462
  176    HA   MET  20           HA       MET  20   5.881  -1.978  -9.451
  177   1HB   MET  20          1HB       MET  20   2.896  -1.729  -9.523
  178   2HB   MET  20          2HB       MET  20   3.842  -0.283  -9.098
  179   1HG   MET  20          1HG       MET  20   4.512  -2.005 -11.496
  180   2HG   MET  20          2HG       MET  20   3.332  -0.688 -11.594
  181   1HE   MET  20          1HE       MET  20   7.723  -0.743 -11.932
  182   2HE   MET  20          2HE       MET  20   7.410  -0.863 -10.184
  183   3HE   MET  20          3HE       MET  20   6.641  -2.010 -11.306
  184    H    ARG  21           H        ARG  21   6.329  -0.236  -7.940
  185    HA   ARG  21           HA       ARG  21   6.848   0.496  -5.834
  186   1HB   ARG  21          1HB       ARG  21   4.156   0.572  -6.039
  187   2HB   ARG  21          2HB       ARG  21   4.308  -0.571  -4.683
  188   1HG   ARG  21          1HG       ARG  21   5.536   0.997  -3.366
  189   2HG   ARG  21          2HG       ARG  21   5.828   2.059  -4.765
  190   1HD   ARG  21          1HD       ARG  21   2.990   1.648  -4.480
  191   2HD   ARG  21          2HD       ARG  21   3.656   2.140  -2.908
  192    HE   ARG  21           HE       ARG  21   4.636   3.760  -5.112
  193   1HH1  ARG  21          2HH2      ARG  21   1.995   3.247  -2.817
  194   2HH1  ARG  21          1HH2      ARG  21   1.452   4.909  -2.861
  195   1HH2  ARG  21          2HH1      ARG  21   3.917   5.956  -5.169
  196   2HH2  ARG  21          1HH1      ARG  21   2.548   6.453  -4.202
  197    H    ARG  22           H        ARG  22   7.171  -2.476  -6.687
  198    HA   ARG  22           HA       ARG  22   7.161  -3.807  -4.066
  199   1HB   ARG  22          1HB       ARG  22   8.372  -5.541  -5.797
  200   2HB   ARG  22          2HB       ARG  22   6.612  -5.432  -5.559
  201   1HG   ARG  22          1HG       ARG  22   7.101  -5.328  -7.951
  202   2HG   ARG  22          2HG       ARG  22   6.517  -3.737  -7.407
  203   1HD   ARG  22          1HD       ARG  22   9.419  -4.013  -7.111
  204   2HD   ARG  22          2HD       ARG  22   8.895  -4.250  -8.792
  205    HE   ARG  22           HE       ARG  22   7.553  -2.019  -8.235
  206   1HH1  ARG  22          2HH2      ARG  22  10.850  -2.948  -7.360
  207   2HH1  ARG  22          1HH2      ARG  22  11.454  -1.306  -7.343
  208   1HH2  ARG  22          2HH1      ARG  22   8.351   0.150  -8.212
  209   2HH2  ARG  22          1HH1      ARG  22  10.029   0.460  -7.829
  210    H    ASN  23           H        ASN  23   8.726  -1.944  -3.397
  211    HA   ASN  23           HA       ASN  23  11.508  -2.658  -4.166
  212   1HB   ASN  23          1HB       ASN  23  10.975  -0.331  -4.534
  213   2HB   ASN  23          2HB       ASN  23  10.288  -0.179  -2.902
  214   1HD2  ASN  23          1HD2      ASN  23  13.320  -0.895  -4.689
  215   2HD2  ASN  23          2HD2      ASN  23  14.402  -0.285  -3.454
  216    H    GLN  24           H        GLN  24  10.959  -0.861  -1.257
  217    HA   GLN  24           HA       GLN  24  11.315  -3.312   0.387
  218   1HB   GLN  24          1HB       GLN  24  13.212  -1.119  -0.058
  219   2HB   GLN  24          2HB       GLN  24  12.822  -1.349   1.664
  220   1HG   GLN  24          1HG       GLN  24  13.287  -3.832   0.083
  221   2HG   GLN  24          2HG       GLN  24  14.709  -2.799   0.344
  222   1HE2  GLN  24          1HE2      GLN  24  11.906  -4.210   2.126
  223   2HE2  GLN  24          2HE2      GLN  24  12.787  -4.528   3.605
  224    H    PHE  25           H        PHE  25  11.570   0.073   1.427
  225    HA   PHE  25           HA       PHE  25   9.306  -0.356   3.238
  226   1HB   PHE  25          1HB       PHE  25  11.235   0.720   4.153
  227   2HB   PHE  25          2HB       PHE  25  11.308   1.878   2.814
  228    HD1  PHE  25           1HD      PHE  25   9.062   3.316   2.511
  229    HD2  PHE  25           2HD      PHE  25  10.351   1.452   6.161
  230    HE1  PHE  25           1HE      PHE  25   7.682   4.912   3.814
  231    HE2  PHE  25           2HE      PHE  25   8.971   3.049   7.463
  232    HZ   PHE  25           HZ       PHE  25   7.636   4.779   6.290
  233    H    TRP  26           H        TRP  26   9.859   0.872   0.077
  234    HA   TRP  26           HA       TRP  26   8.008   3.001  -0.045
  235   1HB   TRP  26          1HB       TRP  26   8.389   1.037  -2.292
  236   2HB   TRP  26          2HB       TRP  26   8.183   2.793  -2.364
  237    HD1  TRP  26           HD       TRP  26  10.517   1.416  -3.909
  238    HE1  TRP  26           1HE      TRP  26  12.952   1.957  -3.397
  239    HE3  TRP  26           3HE      TRP  26   9.960   3.210   0.852
  240    HZ2  TRP  26           2HZ      TRP  26  14.484   3.037  -1.191
  241    HZ3  TRP  26           3HZ      TRP  26  11.927   3.984   2.125
  242    HH2  TRP  26           HH       TRP  26  14.190   3.904   1.121
  243    H    VAL  27           H        VAL  27   7.531  -0.376   0.464
  244    HA   VAL  27           HA       VAL  27   4.995  -0.736  -0.757
  245    HB   VAL  27           HB       VAL  27   6.597  -2.480   0.243
  246   1HG1  VAL  27          1HG1      VAL  27   5.226  -2.609   2.774
  247   2HG1  VAL  27          2HG1      VAL  27   6.970  -2.439   2.464
  248   3HG1  VAL  27          3HG1      VAL  27   5.944  -0.990   2.594
  249   1HG2  VAL  27          1HG2      VAL  27   4.332  -3.609   1.338
  250   2HG2  VAL  27          2HG2      VAL  27   3.639  -2.348   0.290
  251   3HG2  VAL  27          3HG2      VAL  27   4.714  -3.587  -0.401
  252    H    LYS  28           H        LYS  28   3.814  -1.701   1.930
  253    HA   LYS  28           HA       LYS  28   2.466   0.863   2.512
  254   1HB   LYS  28          1HB       LYS  28   1.123  -1.160   1.976
  255   2HB   LYS  28          2HB       LYS  28   1.823  -1.979   3.393
  256   1HG   LYS  28          1HG       LYS  28   0.956   0.453   4.433
  257   2HG   LYS  28          2HG       LYS  28  -0.312   0.044   3.254
  258   1HD   LYS  28          1HD       LYS  28  -1.138  -1.519   4.651
  259   2HD   LYS  28          2HD       LYS  28   0.439  -2.344   4.689
  260   1HE   LYS  28          1HE       LYS  28   1.060  -0.332   6.322
  261   2HE   LYS  28          2HE       LYS  28  -0.699  -0.292   6.570
  262   1HZ   LYS  28          1HZ       LYS  28   0.647  -2.849   6.709
  263   2HZ   LYS  28          2HZ       LYS  28   0.837  -1.808   7.974
  264   3HZ   LYS  28          3HZ       LYS  28  -0.673  -2.303   7.533
  265    H    VAL  29           H        VAL  29   5.174   0.611   3.400
  266    HA   VAL  29           HA       VAL  29   4.896   0.112   6.310
  267    HB   VAL  29           HB       VAL  29   7.364   0.638   4.608
  268   1HG1  VAL  29          1HG1      VAL  29   7.923   1.217   6.826
  269   2HG1  VAL  29          2HG1      VAL  29   6.867  -0.037   7.518
  270   3HG1  VAL  29          3HG1      VAL  29   8.392  -0.497   6.724
  271   1HG2  VAL  29          1HG2      VAL  29   7.040  -2.016   5.806
  272   2HG2  VAL  29          2HG2      VAL  29   5.723  -1.633   4.672
  273   3HG2  VAL  29          3HG2      VAL  29   7.415  -1.571   4.124
  274    H    GLN  30           H        GLN  30   3.696   2.442   4.876
  275    HA   GLN  30           HA       GLN  30   5.376   4.675   5.836
  276   1HB   GLN  30          1HB       GLN  30   3.638   4.284   3.644
  277   2HB   GLN  30          2HB       GLN  30   2.805   5.430   4.721
  278   1HG   GLN  30          1HG       GLN  30   4.356   7.067   4.388
  279   2HG   GLN  30          2HG       GLN  30   5.711   5.918   4.383
  280   1HE2  GLN  30          1HE2      GLN  30   6.413   7.386   2.555
  281   2HE2  GLN  30          2HE2      GLN  30   5.838   7.000   0.947
  282    H    ARG  31           H        ARG  31   2.081   3.287   6.240
  283    HA   ARG  31           HA       ARG  31   0.609   3.416   7.987
  284   1HB   ARG  31          1HB       ARG  31   3.219   3.369   9.157
  285   2HB   ARG  31          2HB       ARG  31   2.230   4.528  10.077
  286   1HG   ARG  31          1HG       ARG  31   0.713   2.912  10.750
  287   2HG   ARG  31          2HG       ARG  31   0.982   1.906   9.306
  288   1HD   ARG  31          1HD       ARG  31   2.062   0.657  10.958
  289   2HD   ARG  31          2HD       ARG  31   3.402   1.617  10.296
  290    HE   ARG  31           HE       ARG  31   3.626   2.624  12.353
  291   1HH1  ARG  31          2HH2      ARG  31   0.356   1.320  12.018
  292   2HH1  ARG  31          1HH2      ARG  31  -0.123   1.733  13.649
  293   1HH2  ARG  31          2HH1      ARG  31   2.992   3.169  14.508
  294   2HH2  ARG  31          1HH1      ARG  31   1.380   2.787  15.069
  295    H    GLY  32           H        GLY  32   2.762   6.105   9.005
  296   1HA   GLY  32          1HA       GLY  32   2.101   8.387   8.119
  297   2HA   GLY  32          2HA       GLY  32   0.445   7.938   8.585
  Start of MODEL   17
    1    HA   PRO   1           HA       PRO   1  -5.844  13.025   2.264
    2   1HB   PRO   1          1HB       PRO   1  -5.193  10.380   2.338
    3   2HB   PRO   1          2HB       PRO   1  -4.612  11.532   3.584
    4   1HG   PRO   1          1HG       PRO   1  -7.037   9.720   3.746
    5   2HG   PRO   1          2HG       PRO   1  -5.708   9.869   4.942
    6   1HD   PRO   1          1HD       PRO   1  -8.040  11.249   5.230
    7   2HD   PRO   1          2HD       PRO   1  -6.474  12.021   5.624
    8    HA   PRO   2           HA       PRO   2  -8.959  11.823  -0.684
    9   1HB   PRO   2          1HB       PRO   2  -7.607  12.524  -2.943
   10   2HB   PRO   2          2HB       PRO   2  -8.214  13.752  -1.785
   11   1HG   PRO   2          1HG       PRO   2  -5.427  12.566  -1.913
   12   2HG   PRO   2          2HG       PRO   2  -5.870  14.304  -1.887
   13   1HD   PRO   2          1HD       PRO   2  -5.181  12.977   0.393
   14   2HD   PRO   2          2HD       PRO   2  -6.513  14.172   0.406
   15    H    LEU   3           H        LEU   3  -9.187  10.210  -2.400
   16    HA   LEU   3           HA       LEU   3  -8.781   8.177  -3.373
   17   1HB   LEU   3          1HB       LEU   3  -5.885   8.857  -2.728
   18   2HB   LEU   3          2HB       LEU   3  -6.414   7.506  -3.759
   19    HG   LEU   3           HG       LEU   3  -7.628  10.108  -4.470
   20   1HD1  LEU   3          1HD1      LEU   3  -5.066  10.212  -5.680
   21   2HD1  LEU   3          2HD1      LEU   3  -5.744  11.346  -4.487
   22   3HD1  LEU   3          3HD1      LEU   3  -4.777   9.954  -3.942
   23   1HD2  LEU   3          1HD2      LEU   3  -6.532   9.218  -6.722
   24   2HD2  LEU   3          2HD2      LEU   3  -6.372   7.710  -5.791
   25   3HD2  LEU   3          3HD2      LEU   3  -7.979   8.432  -6.047
   26    H    SER   4           H        SER   4  -9.276   6.251  -2.500
   27    HA   SER   4           HA       SER   4  -9.368   4.512  -1.014
   28   1HB   SER   4          1HB       SER   4  -7.216   3.857  -0.836
   29   2HB   SER   4          2HB       SER   4  -6.625   5.535  -0.796
   30    HG   SER   4           HG       SER   4  -6.486   4.058   1.179
   31    H    GLN   5           H        GLN   5 -11.113   4.870   0.259
   32    HA   GLN   5           HA       GLN   5 -10.678   5.907   2.924
   33   1HB   GLN   5          1HB       GLN   5 -11.641   7.690   0.821
   34   2HB   GLN   5          2HB       GLN   5 -12.833   7.515   2.131
   35   1HG   GLN   5          1HG       GLN   5 -10.084   7.761   3.134
   36   2HG   GLN   5          2HG       GLN   5 -10.580   9.165   2.163
   37   1HE2  GLN   5          1HE2      GLN   5 -10.159   8.656   5.177
   38   2HE2  GLN   5          2HE2      GLN   5 -11.624   9.272   5.913
   39    H    GLU   6           H        GLU   6 -13.734   6.258   1.167
   40    HA   GLU   6           HA       GLU   6 -14.709   3.812   2.569
   41   1HB   GLU   6          1HB       GLU   6 -16.112   6.444   1.972
   42   2HB   GLU   6          2HB       GLU   6 -16.930   4.989   2.591
   43   1HG   GLU   6          1HG       GLU   6 -14.858   5.147   4.343
   44   2HG   GLU   6          2HG       GLU   6 -15.069   6.870   3.966
   45    H    THR   7           H        THR   7 -13.492   3.592   0.062
   46    HA   THR   7           HA       THR   7 -15.614   2.380  -1.440
   47    HB   THR   7           HB       THR   7 -14.777   5.156  -2.117
   48    HG1  THR   7           1HG      THR   7 -16.870   4.990  -1.792
   49   1HG2  THR   7          1HG2      THR   7 -15.582   4.066  -4.578
   50   2HG2  THR   7          2HG2      THR   7 -13.945   4.621  -4.150
   51   3HG2  THR   7          3HG2      THR   7 -14.386   2.908  -3.948
   52    H    PHE   8           H        PHE   8 -12.964   4.036  -3.076
   53    HA   PHE   8           HA       PHE   8 -11.905   1.766  -4.277
   54   1HB   PHE   8          1HB       PHE   8  -9.702   3.365  -3.977
   55   2HB   PHE   8          2HB       PHE   8 -10.933   3.553  -5.237
   56    HD1  PHE   8           1HD      PHE   8 -11.336   4.312  -1.609
   57    HD2  PHE   8           2HD      PHE   8 -10.878   5.894  -5.576
   58    HE1  PHE   8           1HE      PHE   8 -11.858   6.584  -0.763
   59    HE2  PHE   8           2HE      PHE   8 -11.400   8.166  -4.730
   60    HZ   PHE   8           HZ       PHE   8 -11.890   8.511  -2.323
   61    H    SER   9           H        SER   9 -11.703   2.762  -0.963
   62    HA   SER   9           HA       SER   9  -9.255   1.324  -0.359
   63   1HB   SER   9          1HB       SER   9 -10.175   3.317   0.914
   64   2HB   SER   9          2HB       SER   9 -11.440   2.236   1.545
   65    HG   SER   9           HG       SER   9  -9.271   2.547   2.704
   66    H    ASP  10           H        ASP  10 -12.691   0.606  -0.574
   67    HA   ASP  10           HA       ASP  10 -12.760  -1.710   1.063
   68   1HB   ASP  10          1HB       ASP  10 -14.650  -0.317  -0.112
   69   2HB   ASP  10          2HB       ASP  10 -14.379  -1.436  -1.465
   70    H    LEU  11           H        LEU  11 -11.448  -1.095  -2.131
   71    HA   LEU  11           HA       LEU  11 -11.296  -3.948  -2.793
   72   1HB   LEU  11          1HB       LEU  11  -9.719  -2.529  -4.599
   73   2HB   LEU  11          2HB       LEU  11 -11.428  -2.973  -4.822
   74    HG   LEU  11           HG       LEU  11 -11.543  -0.666  -5.116
   75   1HD1  LEU  11          1HD1      LEU  11 -12.798   0.101  -3.331
   76   2HD1  LEU  11          2HD1      LEU  11 -12.734  -1.628  -2.913
   77   3HD1  LEU  11          3HD1      LEU  11 -11.628  -0.481  -2.122
   78   1HD2  LEU  11          1HD2      LEU  11 -10.127   0.950  -3.972
   79   2HD2  LEU  11          2HD2      LEU  11  -9.513  -0.308  -2.873
   80   3HD2  LEU  11          3HD2      LEU  11  -9.096  -0.357  -4.602
   81    H    TRP  12           H        TRP  12  -8.572  -2.018  -3.690
   82    HA   TRP  12           HA       TRP  12  -6.375  -2.982  -3.368
   83   1HB   TRP  12          1HB       TRP  12  -6.704  -1.464  -0.810
   84   2HB   TRP  12          2HB       TRP  12  -5.411  -1.384  -2.014
   85    HD1  TRP  12           HD       TRP  12  -7.578   0.903  -0.666
   86    HE1  TRP  12           1HE      TRP  12  -8.484   2.657  -2.276
   87    HE3  TRP  12           3HE      TRP  12  -6.592  -1.476  -5.090
   88    HZ2  TRP  12           2HZ      TRP  12  -8.753   2.996  -5.137
   89    HZ3  TRP  12           3HZ      TRP  12  -7.187  -0.408  -7.233
   90    HH2  TRP  12           HH       TRP  12  -8.265   1.822  -7.275
   91    H    LYS  13           H        LYS  13  -8.638  -3.415  -0.649
   92    HA   LYS  13           HA       LYS  13  -7.012  -4.926   1.063
   93   1HB   LYS  13          1HB       LYS  13  -9.354  -4.038   1.481
   94   2HB   LYS  13          2HB       LYS  13  -9.964  -5.414   0.530
   95   1HG   LYS  13          1HG       LYS  13  -8.130  -6.570   2.306
   96   2HG   LYS  13          2HG       LYS  13  -8.971  -5.345   3.287
   97   1HD   LYS  13          1HD       LYS  13 -11.109  -6.294   2.827
   98   2HD   LYS  13          2HD       LYS  13 -10.472  -7.278   1.488
   99   1HE   LYS  13          1HE       LYS  13  -9.018  -8.472   3.192
  100   2HE   LYS  13          2HE       LYS  13  -9.917  -7.611   4.461
  101   1HZ   LYS  13          1HZ       LYS  13 -11.254  -9.340   4.323
  102   2HZ   LYS  13          2HZ       LYS  13 -11.857  -8.631   2.961
  103   3HZ   LYS  13          3HZ       LYS  13 -10.714  -9.814   2.838
  104    H    LEU  14           H        LEU  14  -7.411  -5.557  -2.109
  105    HA   LEU  14           HA       LEU  14  -7.570  -8.504  -1.762
  106   1HB   LEU  14          1HB       LEU  14  -7.741  -8.368  -4.339
  107   2HB   LEU  14          2HB       LEU  14  -9.136  -7.804  -3.388
  108    HG   LEU  14           HG       LEU  14  -8.209  -6.300  -5.340
  109   1HD1  LEU  14          1HD1      LEU  14  -8.583  -4.247  -3.713
  110   2HD1  LEU  14          2HD1      LEU  14  -9.927  -5.358  -4.068
  111   3HD1  LEU  14          3HD1      LEU  14  -9.022  -5.514  -2.543
  112   1HD2  LEU  14          1HD2      LEU  14  -6.485  -5.106  -3.206
  113   2HD2  LEU  14          2HD2      LEU  14  -5.862  -6.559  -4.024
  114   3HD2  LEU  14          3HD2      LEU  14  -6.273  -5.110  -4.974
  115    H    LEU  15           H        LEU  15  -5.506  -5.810  -2.733
  116    HA   LEU  15           HA       LEU  15  -3.393  -7.726  -3.558
  117   1HB   LEU  15          1HB       LEU  15  -3.711  -4.723  -3.924
  118   2HB   LEU  15          2HB       LEU  15  -2.276  -5.650  -4.424
  119    HG   LEU  15           HG       LEU  15  -4.957  -5.490  -5.667
  120   1HD1  LEU  15          1HD1      LEU  15  -3.670  -5.356  -7.530
  121   2HD1  LEU  15          2HD1      LEU  15  -2.292  -5.220  -6.413
  122   3HD1  LEU  15          3HD1      LEU  15  -2.737  -6.806  -7.088
  123   1HD2  LEU  15          1HD2      LEU  15  -4.692  -7.840  -4.466
  124   2HD2  LEU  15          2HD2      LEU  15  -5.293  -7.749  -6.139
  125   3HD2  LEU  15          3HD2      LEU  15  -3.593  -8.174  -5.825
  126    H    LYS  16           H        LYS  16  -4.511  -6.083  -0.849
  127    HA   LYS  16           HA       LYS  16  -2.573  -4.800   0.466
  128   1HB   LYS  16          1HB       LYS  16  -3.348  -6.977   2.196
  129   2HB   LYS  16          2HB       LYS  16  -3.898  -5.285   2.210
  130   1HG   LYS  16          1HG       LYS  16  -5.845  -6.677   1.863
  131   2HG   LYS  16          2HG       LYS  16  -5.476  -5.881   0.315
  132   1HD   LYS  16          1HD       LYS  16  -5.514  -7.965  -0.580
  133   2HD   LYS  16          2HD       LYS  16  -3.937  -8.195   0.212
  134   1HE   LYS  16          1HE       LYS  16  -6.319  -8.581   1.951
  135   2HE   LYS  16          2HE       LYS  16  -6.114  -9.783   0.658
  136   1HZ   LYS  16          1HZ       LYS  16  -3.991  -9.031   2.534
  137   2HZ   LYS  16          2HZ       LYS  16  -4.999 -10.316   2.759
  138   3HZ   LYS  16          3HZ       LYS  16  -3.984 -10.282   1.460
  139    H    LYS  17           H        LYS  17  -2.623  -8.351   1.003
  140    HA   LYS  17           HA       LYS  17  -0.075  -8.677   1.931
  141   1HB   LYS  17          1HB       LYS  17  -1.420 -10.596   1.902
  142   2HB   LYS  17          2HB       LYS  17  -1.826 -10.406   0.179
  143   1HG   LYS  17          1HG       LYS  17  -0.212 -11.986  -0.139
  144   2HG   LYS  17          2HG       LYS  17   0.912 -10.622   0.067
  145   1HD   LYS  17          1HD       LYS  17   1.770 -12.015   1.691
  146   2HD   LYS  17          2HD       LYS  17   0.509 -11.222   2.665
  147   1HE   LYS  17          1HE       LYS  17  -0.863 -13.076   2.654
  148   2HE   LYS  17          2HE       LYS  17  -0.290 -13.623   1.063
  149   1HZ   LYS  17          1HZ       LYS  17   0.772 -14.151   3.680
  150   2HZ   LYS  17          2HZ       LYS  17   0.760 -15.096   2.328
  151   3HZ   LYS  17          3HZ       LYS  17   1.886 -13.901   2.489
  152    H    TRP  18           H        TRP  18  -1.058  -7.970  -1.385
  153    HA   TRP  18           HA       TRP  18   1.796  -8.171  -2.216
  154   1HB   TRP  18          1HB       TRP  18   0.390  -7.879  -4.525
  155   2HB   TRP  18          2HB       TRP  18   0.854  -9.434  -3.820
  156    HD1  TRP  18           HD       TRP  18  -2.063  -7.569  -5.022
  157    HE1  TRP  18           1HE      TRP  18  -4.254  -8.718  -4.414
  158    HE3  TRP  18           3HE      TRP  18  -0.289 -10.925  -1.588
  159    HZ2  TRP  18           2HZ      TRP  18  -5.140 -10.836  -2.653
  160    HZ3  TRP  18           3HZ      TRP  18  -1.834 -12.489  -0.468
  161    HH2  TRP  18           HH       TRP  18  -4.256 -12.458  -0.987
  162    H    LYS  19           H        LYS  19  -0.709  -6.029  -1.356
  163    HA   LYS  19           HA       LYS  19   0.442  -3.841  -3.004
  164   1HB   LYS  19          1HB       LYS  19  -2.071  -4.352  -2.971
  165   2HB   LYS  19          2HB       LYS  19  -2.064  -3.752  -1.296
  166   1HG   LYS  19          1HG       LYS  19  -0.605  -1.838  -2.766
  167   2HG   LYS  19          2HG       LYS  19  -1.996  -2.251  -3.797
  168   1HD   LYS  19          1HD       LYS  19  -3.048  -0.687  -2.485
  169   2HD   LYS  19          2HD       LYS  19  -3.245  -2.078  -1.392
  170   1HE   LYS  19          1HE       LYS  19  -1.302  -1.450  -0.115
  171   2HE   LYS  19          2HE       LYS  19  -0.843  -0.217  -1.309
  172   1HZ   LYS  19          1HZ       LYS  19  -2.293   1.203  -0.473
  173   2HZ   LYS  19          2HZ       LYS  19  -3.464   0.073  -0.209
  174   3HZ   LYS  19          3HZ       LYS  19  -2.241   0.263   0.881
  175    H    MET  20           H        MET  20   1.024  -5.295  -0.123
  176    HA   MET  20           HA       MET  20   0.990  -3.140   1.741
  177   1HB   MET  20          1HB       MET  20   2.129  -4.606   3.157
  178   2HB   MET  20          2HB       MET  20   1.300  -5.730   2.054
  179   1HG   MET  20          1HG       MET  20   4.107  -4.703   1.551
  180   2HG   MET  20          2HG       MET  20   3.787  -6.167   2.495
  181   1HE   MET  20          1HE       MET  20   4.490  -4.507  -0.537
  182   2HE   MET  20          2HE       MET  20   4.293  -5.665  -1.875
  183   3HE   MET  20          3HE       MET  20   2.911  -4.679  -1.341
  184    H    ARG  21           H        ARG  21   3.292  -2.571   2.808
  185    HA   ARG  21           HA       ARG  21   5.062  -1.128   2.564
  186   1HB   ARG  21          1HB       ARG  21   5.736  -3.578   1.562
  187   2HB   ARG  21          2HB       ARG  21   6.079  -2.538   0.158
  188   1HG   ARG  21          1HG       ARG  21   7.603  -1.188   1.400
  189   2HG   ARG  21          2HG       ARG  21   7.040  -1.845   2.955
  190   1HD   ARG  21          1HD       ARG  21   8.422  -3.628   2.812
  191   2HD   ARG  21          2HD       ARG  21   7.965  -3.942   1.124
  192    HE   ARG  21           HE       ARG  21   9.602  -1.684   1.051
  193   1HH1  ARG  21          2HH2      ARG  21   9.834  -5.039   2.142
  194   2HH1  ARG  21          1HH2      ARG  21  11.551  -5.165   1.833
  195   1HH2  ARG  21          2HH1      ARG  21  11.870  -1.850   0.643
  196   2HH2  ARG  21          1HH1      ARG  21  12.712  -3.346   0.978
  197    H    ARG  22           H        ARG  22   2.530  -0.873   0.730
  198    HA   ARG  22           HA       ARG  22   3.725   0.744  -1.442
  199   1HB   ARG  22          1HB       ARG  22   0.951  -0.346  -0.877
  200   2HB   ARG  22          2HB       ARG  22   1.261   0.855  -2.153
  201   1HG   ARG  22          1HG       ARG  22   3.015  -1.584  -2.033
  202   2HG   ARG  22          2HG       ARG  22   1.362  -1.762  -2.671
  203   1HD   ARG  22          1HD       ARG  22   2.464  -1.181  -4.618
  204   2HD   ARG  22          2HD       ARG  22   2.033   0.438  -4.025
  205    HE   ARG  22           HE       ARG  22   4.616  -0.513  -3.065
  206   1HH1  ARG  22          2HH2      ARG  22   2.861   1.113  -5.669
  207   2HH1  ARG  22          1HH2      ARG  22   4.263   1.978  -6.258
  208   1HH2  ARG  22          2HH1      ARG  22   6.467   0.631  -3.844
  209   2HH2  ARG  22          1HH1      ARG  22   6.318   1.704  -5.217
  210    H    ASN  23           H        ASN  23   4.446   2.159   0.532
  211    HA   ASN  23           HA       ASN  23   2.239   4.048   1.194
  212   1HB   ASN  23          1HB       ASN  23   3.225   3.033   3.163
  213   2HB   ASN  23          2HB       ASN  23   4.863   3.424   2.595
  214   1HD2  ASN  23          1HD2      ASN  23   1.738   4.883   3.589
  215   2HD2  ASN  23          2HD2      ASN  23   2.422   6.381   4.184
  216    H    GLN  24           H        GLN  24   5.509   4.997   1.789
  217    HA   GLN  24           HA       GLN  24   5.567   6.577  -0.730
  218   1HB   GLN  24          1HB       GLN  24   5.283   7.536   2.028
  219   2HB   GLN  24          2HB       GLN  24   6.700   8.231   1.204
  220   1HG   GLN  24          1HG       GLN  24   5.391   9.532  -0.087
  221   2HG   GLN  24          2HG       GLN  24   4.418   8.134  -0.594
  222   1HE2  GLN  24          1HE2      GLN  24   2.382   9.059  -0.453
  223   2HE2  GLN  24          2HE2      GLN  24   1.676   9.610   1.052
  224    H    PHE  25           H        PHE  25   7.707   6.866   2.090
  225    HA   PHE  25           HA       PHE  25   9.974   6.108   0.387
  226   1HB   PHE  25          1HB       PHE  25  10.258   8.057   1.742
  227   2HB   PHE  25          2HB       PHE  25   9.687   7.215   3.192
  228    HD1  PHE  25           1HD      PHE  25  11.109   5.046   3.828
  229    HD2  PHE  25           2HD      PHE  25  12.540   8.337   1.468
  230    HE1  PHE  25           1HE      PHE  25  13.445   4.438   4.397
  231    HE2  PHE  25           2HE      PHE  25  14.876   7.730   2.038
  232    HZ   PHE  25           HZ       PHE  25  15.328   5.780   3.502
  233    H    TRP  26           H        TRP  26   7.787   4.599   2.543
  234    HA   TRP  26           HA       TRP  26   9.459   2.751   3.875
  235   1HB   TRP  26          1HB       TRP  26   6.713   2.062   2.850
  236   2HB   TRP  26          2HB       TRP  26   7.489   1.586   4.367
  237    HD1  TRP  26           HD       TRP  26   4.626   2.789   4.418
  238    HE1  TRP  26           1HE      TRP  26   4.112   4.974   5.622
  239    HE3  TRP  26           3HE      TRP  26   9.328   4.810   4.463
  240    HZ2  TRP  26           2HZ      TRP  26   5.558   7.321   6.502
  241    HZ3  TRP  26           3HZ      TRP  26   9.720   7.019   5.492
  242    HH2  TRP  26           HH       TRP  26   7.851   8.284   6.512
  243    H    VAL  27           H        VAL  27   8.746   3.119   0.537
  244    HA   VAL  27           HA       VAL  27   8.786   0.434  -0.352
  245    HB   VAL  27           HB       VAL  27   8.484   2.875  -1.524
  246   1HG1  VAL  27          1HG1      VAL  27  10.367   3.138  -3.132
  247   2HG1  VAL  27          2HG1      VAL  27  10.898   3.358  -1.447
  248   3HG1  VAL  27          3HG1      VAL  27  11.243   1.833  -2.298
  249   1HG2  VAL  27          1HG2      VAL  27   9.394   0.345  -2.959
  250   2HG2  VAL  27          2HG2      VAL  27   7.749   0.611  -2.332
  251   3HG2  VAL  27          3HG2      VAL  27   8.385   1.649  -3.631
  252    H    LYS  28           H        LYS  28  11.147   2.161   1.333
  253    HA   LYS  28           HA       LYS  28  13.217   0.229   0.426
  254   1HB   LYS  28          1HB       LYS  28  13.262   3.186   0.344
  255   2HB   LYS  28          2HB       LYS  28  14.681   2.447   1.125
  256   1HG   LYS  28          1HG       LYS  28  15.275   1.243  -0.807
  257   2HG   LYS  28          2HG       LYS  28  13.641   1.363  -1.501
  258   1HD   LYS  28          1HD       LYS  28  14.064   3.922  -1.553
  259   2HD   LYS  28          2HD       LYS  28  15.777   3.508  -1.304
  260   1HE   LYS  28          1HE       LYS  28  15.695   2.035  -3.302
  261   2HE   LYS  28          2HE       LYS  28  13.998   2.496  -3.561
  262   1HZ   LYS  28          1HZ       LYS  28  16.326   4.280  -3.634
  263   2HZ   LYS  28          2HZ       LYS  28  15.409   3.799  -4.918
  264   3HZ   LYS  28          3HZ       LYS  28  14.759   4.778  -3.760
  265    H    VAL  29           H        VAL  29  11.902  -0.626   2.474
  266    HA   VAL  29           HA       VAL  29  13.027   0.510   4.959
  267    HB   VAL  29           HB       VAL  29  10.939  -1.639   4.425
  268   1HG1  VAL  29          1HG1      VAL  29  11.646  -2.302   6.510
  269   2HG1  VAL  29          2HG1      VAL  29  12.368  -0.719   6.884
  270   3HG1  VAL  29          3HG1      VAL  29  10.609  -0.949   7.022
  271   1HG2  VAL  29          1HG2      VAL  29  10.211   0.790   5.917
  272   2HG2  VAL  29          2HG2      VAL  29  10.767   1.138   4.263
  273   3HG2  VAL  29          3HG2      VAL  29   9.403   0.026   4.527
  274    H    GLN  30           H        GLN  30  14.679  -0.920   2.914
  275    HA   GLN  30           HA       GLN  30  15.920  -2.807   4.790
  276   1HB   GLN  30          1HB       GLN  30  14.224  -4.114   3.439
  277   2HB   GLN  30          2HB       GLN  30  15.154  -3.688   1.983
  278   1HG   GLN  30          1HG       GLN  30  16.593  -4.876   4.346
  279   2HG   GLN  30          2HG       GLN  30  15.646  -5.945   3.289
  280   1HE2  GLN  30          1HE2      GLN  30  18.495  -6.081   3.606
  281   2HE2  GLN  30          2HE2      GLN  30  19.225  -5.678   2.067
  282    H    ARG  31           H        ARG  31  18.115  -3.350   4.167
  283    HA   ARG  31           HA       ARG  31  19.714  -1.295   3.387
  284   1HB   ARG  31          1HB       ARG  31  19.973  -4.122   3.723
  285   2HB   ARG  31          2HB       ARG  31  20.821  -3.675   2.223
  286   1HG   ARG  31          1HG       ARG  31  22.445  -2.560   3.349
  287   2HG   ARG  31          2HG       ARG  31  21.269  -1.766   4.424
  288   1HD   ARG  31          1HD       ARG  31  21.232  -3.583   5.927
  289   2HD   ARG  31          2HD       ARG  31  21.913  -4.706   4.730
  290    HE   ARG  31           HE       ARG  31  23.375  -2.881   6.477
  291   1HH1  ARG  31          2HH2      ARG  31  23.404  -4.753   3.477
  292   2HH1  ARG  31          1HH2      ARG  31  25.148  -4.860   3.400
  293   1HH2  ARG  31          2HH1      ARG  31  25.679  -3.022   6.375
  294   2HH2  ARG  31          1HH1      ARG  31  26.445  -3.873   5.052
  295    H    GLY  32           H        GLY  32  19.622   0.015   1.659
  296   1HA   GLY  32          1HA       GLY  32  18.621  -1.057  -0.903
  297   2HA   GLY  32          2HA       GLY  32  18.884   0.652  -0.488
  Start of MODEL   18
    1    HA   PRO   1           HA       PRO   1 -16.769  13.770  -3.305
    2   1HB   PRO   1          1HB       PRO   1 -17.041  11.179  -4.104
    3   2HB   PRO   1          2HB       PRO   1 -17.973  12.507  -4.869
    4   1HG   PRO   1          1HG       PRO   1 -15.373  11.288  -5.842
    5   2HG   PRO   1          2HG       PRO   1 -16.884  11.520  -6.780
    6   1HD   PRO   1          1HD       PRO   1 -14.848  13.329  -6.894
    7   2HD   PRO   1          2HD       PRO   1 -16.551  13.880  -6.859
    8    HA   PRO   2           HA       PRO   2 -13.615  11.848  -0.907
    9   1HB   PRO   2          1HB       PRO   2 -14.896   9.951   0.570
   10   2HB   PRO   2          2HB       PRO   2 -15.268  11.696   0.746
   11   1HG   PRO   2          1HG       PRO   2 -16.741   9.665  -0.956
   12   2HG   PRO   2          2HG       PRO   2 -17.446  10.787   0.254
   13   1HD   PRO   2          1HD       PRO   2 -17.402  11.404  -2.401
   14   2HD   PRO   2          2HD       PRO   2 -17.073  12.662  -1.172
   15    H    LEU   3           H        LEU   3 -13.228   9.222  -0.068
   16    HA   LEU   3           HA       LEU   3 -13.550   7.265  -2.106
   17   1HB   LEU   3          1HB       LEU   3 -12.030   8.753  -3.369
   18   2HB   LEU   3          2HB       LEU   3 -10.841   8.653  -2.048
   19    HG   LEU   3           HG       LEU   3 -11.193   6.027  -2.421
   20   1HD1  LEU   3          1HD1      LEU   3 -11.784   5.398  -4.609
   21   2HD1  LEU   3          2HD1      LEU   3 -12.941   6.703  -4.255
   22   3HD1  LEU   3          3HD1      LEU   3 -11.507   7.033  -5.256
   23   1HD2  LEU   3          1HD2      LEU   3  -9.317   8.028  -3.280
   24   2HD2  LEU   3          2HD2      LEU   3  -9.021   6.305  -2.948
   25   3HD2  LEU   3          3HD2      LEU   3  -9.489   6.828  -4.584
   26    H    SER   4           H        SER   4 -13.280   5.335  -1.133
   27    HA   SER   4           HA       SER   4 -12.557   3.750   0.358
   28   1HB   SER   4          1HB       SER   4 -10.304   3.873   0.277
   29   2HB   SER   4          2HB       SER   4 -10.323   5.651   0.209
   30    HG   SER   4           HG       SER   4 -10.263   3.935   2.421
   31    H    GLN   5           H        GLN   5 -14.015   3.460   1.938
   32    HA   GLN   5           HA       GLN   5 -13.728   4.882   4.438
   33   1HB   GLN   5          1HB       GLN   5 -15.091   6.410   2.797
   34   2HB   GLN   5          2HB       GLN   5 -16.410   5.256   3.109
   35   1HG   GLN   5          1HG       GLN   5 -15.512   5.670   5.648
   36   2HG   GLN   5          2HG       GLN   5 -15.144   7.250   4.922
   37   1HE2  GLN   5          1HE2      GLN   5 -17.151   7.717   3.163
   38   2HE2  GLN   5          2HE2      GLN   5 -18.704   7.753   3.972
   39    H    GLU   6           H        GLU   6 -16.774   3.664   3.039
   40    HA   GLU   6           HA       GLU   6 -16.466   1.235   4.742
   41   1HB   GLU   6          1HB       GLU   6 -18.976   2.882   4.236
   42   2HB   GLU   6          2HB       GLU   6 -18.889   1.380   5.187
   43   1HG   GLU   6          1HG       GLU   6 -17.232   2.478   6.700
   44   2HG   GLU   6          2HG       GLU   6 -17.430   3.987   5.783
   45    H    THR   7           H        THR   7 -15.624   1.313   2.063
   46    HA   THR   7           HA       THR   7 -17.092  -0.866   0.979
   47    HB   THR   7           HB       THR   7 -17.952   1.868   0.194
   48    HG1  THR   7           1HG      THR   7 -19.258   0.201   1.152
   49   1HG2  THR   7          1HG2      THR   7 -16.775  -0.006  -1.727
   50   2HG2  THR   7          2HG2      THR   7 -18.481   0.342  -2.096
   51   3HG2  THR   7          3HG2      THR   7 -17.309   1.675  -1.966
   52    H    PHE   8           H        PHE   8 -15.985   1.769  -1.106
   53    HA   PHE   8           HA       PHE   8 -14.198   0.268  -2.589
   54   1HB   PHE   8          1HB       PHE   8 -13.008   2.719  -2.618
   55   2HB   PHE   8          2HB       PHE   8 -14.427   2.279  -3.583
   56    HD1  PHE   8           1HD      PHE   8 -14.344   2.853   0.099
   57    HD2  PHE   8           2HD      PHE   8 -15.525   4.370  -3.742
   58    HE1  PHE   8           1HE      PHE   8 -15.656   4.640   1.209
   59    HE2  PHE   8           2HE      PHE   8 -16.837   6.158  -2.632
   60    HZ   PHE   8           HZ       PHE   8 -16.902   6.293  -0.156
   61    H    SER   9           H        SER   9 -13.911   1.245   0.703
   62    HA   SER   9           HA       SER   9 -11.002   1.223   0.777
   63   1HB   SER   9          1HB       SER   9 -12.359   2.580   2.339
   64   2HB   SER   9          2HB       SER   9 -13.073   1.091   3.004
   65    HG   SER   9           HG       SER   9 -11.350   0.836   4.149
   66    H    ASP  10           H        ASP  10 -13.670  -1.058   1.268
   67    HA   ASP  10           HA       ASP  10 -12.288  -3.084   2.654
   68   1HB   ASP  10          1HB       ASP  10 -14.130  -4.120   0.649
   69   2HB   ASP  10          2HB       ASP  10 -14.260  -4.133   2.422
   70    H    LEU  11           H        LEU  11 -12.170  -2.053  -0.714
   71    HA   LEU  11           HA       LEU  11 -10.800  -4.477  -1.596
   72   1HB   LEU  11          1HB       LEU  11 -10.443  -2.550  -3.553
   73   2HB   LEU  11          2HB       LEU  11 -11.804  -3.694  -3.464
   74    HG   LEU  11           HG       LEU  11 -12.936  -1.656  -3.570
   75   1HD1  LEU  11          1HD1      LEU  11 -14.023  -1.494  -1.534
   76   2HD1  LEU  11          2HD1      LEU  11 -13.152  -3.024  -1.273
   77   3HD1  LEU  11          3HD1      LEU  11 -12.506  -1.507  -0.603
   78   1HD2  LEU  11          1HD2      LEU  11 -10.777  -0.335  -3.459
   79   2HD2  LEU  11          2HD2      LEU  11 -12.146   0.422  -2.609
   80   3HD2  LEU  11          3HD2      LEU  11 -10.884  -0.427  -1.685
   81    H    TRP  12           H        TRP  12  -9.523  -1.489  -2.791
   82    HA   TRP  12           HA       TRP  12  -7.109  -1.315  -2.951
   83   1HB   TRP  12          1HB       TRP  12  -7.636  -0.079  -0.272
   84   2HB   TRP  12          2HB       TRP  12  -6.740   0.565  -1.655
   85    HD1  TRP  12           HD       TRP  12  -9.472   1.601   0.154
   86    HE1  TRP  12           1HE      TRP  12 -11.322   2.725  -1.187
   87    HE3  TRP  12           3HE      TRP  12  -8.216  -0.075  -4.516
   88    HZ2  TRP  12           2HZ      TRP  12 -12.165   2.884  -3.951
   89    HZ3  TRP  12           3HZ      TRP  12  -9.564   0.582  -6.475
   90    HH2  TRP  12           HH       TRP  12 -11.537   2.057  -6.211
   91    H    LYS  13           H        LYS  13  -8.332  -2.671   0.116
   92    HA   LYS  13           HA       LYS  13  -5.936  -3.207   1.423
   93   1HB   LYS  13          1HB       LYS  13  -8.396  -3.634   2.124
   94   2HB   LYS  13          2HB       LYS  13  -8.205  -5.206   1.311
   95   1HG   LYS  13          1HG       LYS  13  -5.882  -5.019   2.813
   96   2HG   LYS  13          2HG       LYS  13  -7.091  -4.259   3.875
   97   1HD   LYS  13          1HD       LYS  13  -7.055  -6.654   4.324
   98   2HD   LYS  13          2HD       LYS  13  -8.582  -6.251   3.504
   99   1HE   LYS  13          1HE       LYS  13  -6.788  -6.751   1.412
  100   2HE   LYS  13          2HE       LYS  13  -6.390  -7.985   2.627
  101   1HZ   LYS  13          1HZ       LYS  13  -8.340  -8.969   2.348
  102   2HZ   LYS  13          2HZ       LYS  13  -9.183  -7.568   2.137
  103   3HZ   LYS  13          3HZ       LYS  13  -8.338  -8.219   0.879
  104    H    LEU  14           H        LEU  14  -6.820  -4.218  -1.673
  105    HA   LEU  14           HA       LEU  14  -5.365  -6.773  -1.549
  106   1HB   LEU  14          1HB       LEU  14  -5.968  -6.783  -4.028
  107   2HB   LEU  14          2HB       LEU  14  -7.341  -6.798  -2.895
  108    HG   LEU  14           HG       LEU  14  -7.591  -5.155  -4.803
  109   1HD1  LEU  14          1HD1      LEU  14  -7.480  -3.293  -2.560
  110   2HD1  LEU  14          2HD1      LEU  14  -8.899  -3.975  -3.390
  111   3HD1  LEU  14          3HD1      LEU  14  -8.138  -4.867  -2.051
  112   1HD2  LEU  14          1HD2      LEU  14  -5.790  -3.209  -3.502
  113   2HD2  LEU  14          2HD2      LEU  14  -4.938  -4.583  -4.246
  114   3HD2  LEU  14          3HD2      LEU  14  -6.021  -3.570  -5.230
  115    H    LEU  15           H        LEU  15  -5.048  -3.466  -2.861
  116    HA   LEU  15           HA       LEU  15  -2.535  -4.066  -4.194
  117   1HB   LEU  15          1HB       LEU  15  -3.092  -2.173  -5.260
  118   2HB   LEU  15          2HB       LEU  15  -4.482  -1.966  -4.167
  119    HG   LEU  15           HG       LEU  15  -2.824  -0.986  -2.474
  120   1HD1  LEU  15          1HD1      LEU  15  -0.848  -1.967  -3.848
  121   2HD1  LEU  15          2HD1      LEU  15  -1.078  -0.562  -4.916
  122   3HD1  LEU  15          3HD1      LEU  15  -0.671  -0.318  -3.201
  123   1HD2  LEU  15          1HD2      LEU  15  -4.096   0.708  -3.360
  124   2HD2  LEU  15          2HD2      LEU  15  -2.554   1.146  -4.133
  125   3HD2  LEU  15          3HD2      LEU  15  -3.771   0.215  -5.039
  126    H    LYS  16           H        LYS  16  -3.504  -3.508  -0.972
  127    HA   LYS  16           HA       LYS  16  -1.631  -1.900   0.202
  128   1HB   LYS  16          1HB       LYS  16  -2.920  -2.793   1.840
  129   2HB   LYS  16          2HB       LYS  16  -3.116  -4.338   0.978
  130   1HG   LYS  16          1HG       LYS  16  -0.439  -3.606   2.172
  131   2HG   LYS  16          2HG       LYS  16  -1.722  -4.272   3.210
  132   1HD   LYS  16          1HD       LYS  16  -0.336  -5.553   0.842
  133   2HD   LYS  16          2HD       LYS  16  -0.562  -6.195   2.486
  134   1HE   LYS  16          1HE       LYS  16  -3.121  -6.013   1.910
  135   2HE   LYS  16          2HE       LYS  16  -2.553  -5.989   0.226
  136   1HZ   LYS  16          1HZ       LYS  16  -1.196  -8.013   1.130
  137   2HZ   LYS  16          2HZ       LYS  16  -2.477  -8.121   2.163
  138   3HZ   LYS  16          3HZ       LYS  16  -2.724  -8.176   0.533
  139    H    LYS  17           H        LYS  17  -1.141  -5.381  -0.618
  140    HA   LYS  17           HA       LYS  17   1.489  -5.647   0.241
  141   1HB   LYS  17          1HB       LYS  17   0.504  -7.623  -0.486
  142   2HB   LYS  17          2HB       LYS  17  -0.148  -6.878  -1.966
  143   1HG   LYS  17          1HG       LYS  17   1.625  -7.821  -3.023
  144   2HG   LYS  17          2HG       LYS  17   2.597  -6.542  -2.257
  145   1HD   LYS  17          1HD       LYS  17   2.618  -8.200  -0.199
  146   2HD   LYS  17          2HD       LYS  17   2.236  -9.423  -1.434
  147   1HE   LYS  17          1HE       LYS  17   4.250  -7.984  -2.653
  148   2HE   LYS  17          2HE       LYS  17   4.746  -7.935  -0.947
  149   1HZ   LYS  17          1HZ       LYS  17   5.489  -9.870  -2.338
  150   2HZ   LYS  17          2HZ       LYS  17   4.836 -10.213  -0.863
  151   3HZ   LYS  17          3HZ       LYS  17   3.942 -10.430  -2.231
  152    H    TRP  18           H        TRP  18   0.206  -3.926  -2.559
  153    HA   TRP  18           HA       TRP  18   2.998  -3.380  -3.443
  154   1HB   TRP  18          1HB       TRP  18   1.456  -2.442  -5.449
  155   2HB   TRP  18          2HB       TRP  18   2.080  -4.095  -5.376
  156    HD1  TRP  18           HD       TRP  18  -1.017  -2.239  -5.861
  157    HE1  TRP  18           1HE      TRP  18  -3.080  -3.720  -5.666
  158    HE3  TRP  18           3HE      TRP  18   1.142  -6.352  -3.712
  159    HZ2  TRP  18           2HZ      TRP  18  -3.726  -6.369  -4.695
  160    HZ3  TRP  18           3HZ      TRP  18  -0.227  -8.331  -3.168
  161    HH2  TRP  18           HH       TRP  18  -2.656  -8.356  -3.651
  162    H    LYS  19           H        LYS  19   0.308  -2.100  -1.784
  163    HA   LYS  19           HA       LYS  19   0.850   0.682  -2.576
  164   1HB   LYS  19          1HB       LYS  19  -1.419  -0.692  -1.762
  165   2HB   LYS  19          2HB       LYS  19  -0.951   0.211  -0.301
  166   1HG   LYS  19          1HG       LYS  19  -0.683   1.830  -2.731
  167   2HG   LYS  19          2HG       LYS  19  -2.345   1.236  -2.503
  168   1HD   LYS  19          1HD       LYS  19  -2.184   2.037  -0.091
  169   2HD   LYS  19          2HD       LYS  19  -0.656   2.832  -0.538
  170   1HE   LYS  19          1HE       LYS  19  -2.108   4.575  -0.954
  171   2HE   LYS  19          2HE       LYS  19  -2.166   3.772  -2.538
  172   1HZ   LYS  19          1HZ       LYS  19  -4.100   3.555  -0.350
  173   2HZ   LYS  19          2HZ       LYS  19  -4.346   4.157  -1.866
  174   3HZ   LYS  19          3HZ       LYS  19  -4.098   2.541  -1.650
  175    H    MET  20           H        MET  20   2.159  -1.594  -0.468
  176    HA   MET  20           HA       MET  20   3.001   0.538   1.438
  177   1HB   MET  20          1HB       MET  20   2.676  -2.466   1.770
  178   2HB   MET  20          2HB       MET  20   3.498  -1.428   2.960
  179   1HG   MET  20          1HG       MET  20   0.644  -1.079   1.971
  180   2HG   MET  20          2HG       MET  20   1.110  -1.797   3.522
  181   1HE   MET  20          1HE       MET  20   0.238   0.897   1.436
  182   2HE   MET  20          2HE       MET  20  -0.763   1.417   2.813
  183   3HE   MET  20          3HE       MET  20   0.574   2.447   2.246
  184    H    ARG  21           H        ARG  21   5.210   0.642   2.029
  185    HA   ARG  21           HA       ARG  21   7.472   0.456   1.714
  186   1HB   ARG  21          1HB       ARG  21   6.675  -2.104   1.711
  187   2HB   ARG  21          2HB       ARG  21   7.210  -1.998   0.016
  188   1HG   ARG  21          1HG       ARG  21   9.401  -1.873   0.601
  189   2HG   ARG  21          2HG       ARG  21   9.072  -0.727   1.922
  190   1HD   ARG  21          1HD       ARG  21   8.541  -2.455   3.447
  191   2HD   ARG  21          2HD       ARG  21   8.306  -3.648   2.151
  192    HE   ARG  21           HE       ARG  21  10.838  -2.830   3.372
  193   1HH1  ARG  21          2HH2      ARG  21   9.212  -4.344   0.622
  194   2HH1  ARG  21          1HH2      ARG  21  10.616  -5.259   0.121
  195   1HH2  ARG  21          2HH1      ARG  21  12.693  -4.038   2.709
  196   2HH2  ARG  21          1HH1      ARG  21  12.600  -5.084   1.310
  197    H    ARG  22           H        ARG  22   5.221   1.094  -0.565
  198    HA   ARG  22           HA       ARG  22   6.931   1.079  -2.932
  199   1HB   ARG  22          1HB       ARG  22   5.012   1.854  -4.079
  200   2HB   ARG  22          2HB       ARG  22   4.368   0.765  -2.827
  201   1HG   ARG  22          1HG       ARG  22   4.581   3.798  -2.594
  202   2HG   ARG  22          2HG       ARG  22   3.087   2.891  -2.934
  203   1HD   ARG  22          1HD       ARG  22   2.932   3.140  -0.627
  204   2HD   ARG  22          2HD       ARG  22   3.754   1.569  -0.743
  205    HE   ARG  22           HE       ARG  22   5.623   2.508   0.232
  206   1HH1  ARG  22          2HH2      ARG  22   3.520   5.047  -1.045
  207   2HH1  ARG  22          1HH2      ARG  22   4.459   6.357  -0.366
  208   1HH2  ARG  22          2HH1      ARG  22   6.864   4.239   1.130
  209   2HH2  ARG  22          1HH1      ARG  22   6.366   5.896   0.874
  210    H    ASN  23           H        ASN  23   8.589   2.353  -1.517
  211    HA   ASN  23           HA       ASN  23   7.992   5.263  -1.774
  212   1HB   ASN  23          1HB       ASN  23   8.424   4.325   0.540
  213   2HB   ASN  23          2HB       ASN  23  10.069   3.931  -0.003
  214   1HD2  ASN  23          1HD2      ASN  23   9.255   6.595  -1.767
  215   2HD2  ASN  23          2HD2      ASN  23   9.870   7.859  -0.724
  216    H    GLN  24           H        GLN  24  11.004   3.314  -1.487
  217    HA   GLN  24           HA       GLN  24  11.803   3.815  -4.209
  218   1HB   GLN  24          1HB       GLN  24  12.440   5.805  -2.146
  219   2HB   GLN  24          2HB       GLN  24  13.890   5.155  -2.949
  220   1HG   GLN  24          1HG       GLN  24  12.711   5.565  -5.165
  221   2HG   GLN  24          2HG       GLN  24  11.463   6.442  -4.253
  222   1HE2  GLN  24          1HE2      GLN  24  11.771   8.558  -4.761
  223   2HE2  GLN  24          2HE2      GLN  24  13.290   9.413  -4.597
  224    H    PHE  25           H        PHE  25  14.101   4.031  -1.538
  225    HA   PHE  25           HA       PHE  25  15.277   1.489  -2.362
  226   1HB   PHE  25          1HB       PHE  25  17.141   2.288  -1.383
  227   2HB   PHE  25          2HB       PHE  25  16.277   3.834  -1.388
  228    HD1  PHE  25           1HD      PHE  25  14.437   3.811   0.749
  229    HD2  PHE  25           2HD      PHE  25  18.303   1.945   0.582
  230    HE1  PHE  25           1HE      PHE  25  14.590   3.907   3.222
  231    HE2  PHE  25           2HE      PHE  25  18.455   2.041   3.055
  232    HZ   PHE  25           HZ       PHE  25  16.599   3.021   4.376
  233    H    TRP  26           H        TRP  26  13.058   2.673   0.060
  234    HA   TRP  26           HA       TRP  26  13.434   0.871   2.154
  235   1HB   TRP  26          1HB       TRP  26  10.900   2.024   0.958
  236   2HB   TRP  26          2HB       TRP  26  10.947   1.132   2.485
  237    HD1  TRP  26           HD       TRP  26  11.696   2.389   4.605
  238    HE1  TRP  26           1HE      TRP  26  12.290   4.801   5.167
  239    HE3  TRP  26           3HE      TRP  26  12.108   4.248  -0.146
  240    HZ2  TRP  26           2HZ      TRP  26  12.874   7.249   3.737
  241    HZ3  TRP  26           3HZ      TRP  26  12.684   6.621  -0.505
  242    HH2  TRP  26           HH       TRP  26  13.069   8.131   1.420
  243    H    VAL  27           H        VAL  27  12.417   0.274  -1.113
  244    HA   VAL  27           HA       VAL  27  11.030  -2.212  -0.544
  245    HB   VAL  27           HB       VAL  27  11.628  -0.504  -2.847
  246   1HG1  VAL  27          1HG1      VAL  27  11.760  -2.259  -4.522
  247   2HG1  VAL  27          2HG1      VAL  27  13.084  -2.504  -3.358
  248   3HG1  VAL  27          3HG1      VAL  27  11.625  -3.521  -3.274
  249   1HG2  VAL  27          1HG2      VAL  27   9.412  -0.874  -3.209
  250   2HG2  VAL  27          2HG2      VAL  27   9.586  -2.637  -3.034
  251   3HG2  VAL  27          3HG2      VAL  27   9.431  -1.610  -1.588
  252    H    LYS  28           H        LYS  28  14.099  -1.459   0.060
  253    HA   LYS  28           HA       LYS  28  14.997  -4.216  -0.353
  254   1HB   LYS  28          1HB       LYS  28  15.854  -1.977  -2.051
  255   2HB   LYS  28          2HB       LYS  28  17.213  -2.797  -1.245
  256   1HG   LYS  28          1HG       LYS  28  16.599  -4.922  -2.156
  257   2HG   LYS  28          2HG       LYS  28  15.007  -4.320  -2.677
  258   1HD   LYS  28          1HD       LYS  28  16.420  -4.415  -4.637
  259   2HD   LYS  28          2HD       LYS  28  16.227  -2.700  -4.203
  260   1HE   LYS  28          1HE       LYS  28  18.392  -2.769  -2.999
  261   2HE   LYS  28          2HE       LYS  28  18.586  -4.475  -3.454
  262   1HZ   LYS  28          1HZ       LYS  28  18.291  -3.561  -5.798
  263   2HZ   LYS  28          2HZ       LYS  28  18.697  -2.105  -5.137
  264   3HZ   LYS  28          3HZ       LYS  28  19.747  -3.374  -5.045
  265    H    VAL  29           H        VAL  29  14.297  -2.732   1.973
  266    HA   VAL  29           HA       VAL  29  16.978  -2.268   3.193
  267    HB   VAL  29           HB       VAL  29  14.234  -1.168   3.919
  268   1HG1  VAL  29          1HG1      VAL  29  16.150   0.215   5.366
  269   2HG1  VAL  29          2HG1      VAL  29  15.114  -1.081   6.011
  270   3HG1  VAL  29          3HG1      VAL  29  16.754  -1.458   5.431
  271   1HG2  VAL  29          1HG2      VAL  29  16.789   0.194   2.962
  272   2HG2  VAL  29          2HG2      VAL  29  15.373  -0.147   1.938
  273   3HG2  VAL  29          3HG2      VAL  29  15.231   0.984   3.305
  274    H    GLN  30           H        GLN  30  15.568  -4.863   2.733
  275    HA   GLN  30           HA       GLN  30  14.217  -5.914   4.880
  276   1HB   GLN  30          1HB       GLN  30  15.439  -8.063   4.338
  277   2HB   GLN  30          2HB       GLN  30  14.704  -7.250   2.935
  278   1HG   GLN  30          1HG       GLN  30  16.715  -7.045   1.948
  279   2HG   GLN  30          2HG       GLN  30  17.365  -6.208   3.374
  280   1HE2  GLN  30          1HE2      GLN  30  17.850  -8.808   1.391
  281   2HE2  GLN  30          2HE2      GLN  30  18.660  -9.894   2.500
  282    H    ARG  31           H        ARG  31  14.631  -6.482   6.968
  283    HA   ARG  31           HA       ARG  31  17.293  -6.855   7.990
  284   1HB   ARG  31          1HB       ARG  31  17.253  -4.873   9.527
  285   2HB   ARG  31          2HB       ARG  31  17.428  -4.436   7.810
  286   1HG   ARG  31          1HG       ARG  31  14.974  -4.024   7.687
  287   2HG   ARG  31          2HG       ARG  31  14.839  -4.404   9.421
  288   1HD   ARG  31          1HD       ARG  31  14.977  -1.948   8.975
  289   2HD   ARG  31          2HD       ARG  31  16.309  -2.543   9.989
  290    HE   ARG  31           HE       ARG  31  16.484  -1.547   7.223
  291   1HH1  ARG  31          2HH2      ARG  31  18.022  -3.207   9.940
  292   2HH1  ARG  31          1HH2      ARG  31  19.651  -2.925   9.367
  293   1HH2  ARG  31          2HH1      ARG  31  18.635  -1.175   6.467
  294   2HH2  ARG  31          1HH1      ARG  31  20.000  -1.766   7.387
  295    H    GLY  32           H        GLY  32  15.047  -8.472   7.999
  296   1HA   GLY  32          1HA       GLY  32  13.925  -9.816   9.495
  297   2HA   GLY  32          2HA       GLY  32  14.717  -8.936  10.823
  Start of MODEL   19
    1    HA   PRO   1           HA       PRO   1 -15.277   9.313 -10.335
    2   1HB   PRO   1          1HB       PRO   1 -17.044   8.097  -8.655
    3   2HB   PRO   1          2HB       PRO   1 -17.591   9.116 -10.026
    4   1HG   PRO   1          1HG       PRO   1 -17.298   6.099  -9.981
    5   2HG   PRO   1          2HG       PRO   1 -18.739   7.045 -10.478
    6   1HD   PRO   1          1HD       PRO   1 -16.937   6.132 -12.308
    7   2HD   PRO   1          2HD       PRO   1 -17.660   7.760 -12.481
    8    HA   PRO   2           HA       PRO   2 -12.515   6.891  -7.907
    9   1HB   PRO   2          1HB       PRO   2 -12.898   7.747  -5.348
   10   2HB   PRO   2          2HB       PRO   2 -12.286   8.842  -6.630
   11   1HG   PRO   2          1HG       PRO   2 -15.153   8.530  -5.693
   12   2HG   PRO   2          2HG       PRO   2 -14.217  10.053  -5.843
   13   1HD   PRO   2          1HD       PRO   2 -15.890   9.210  -7.824
   14   2HD   PRO   2          2HD       PRO   2 -14.311   9.952  -8.224
   15    H    LEU   3           H        LEU   3 -12.362   5.271  -6.075
   16    HA   LEU   3           HA       LEU   3 -14.970   4.022  -5.425
   17   1HB   LEU   3          1HB       LEU   3 -13.361   1.840  -5.907
   18   2HB   LEU   3          2HB       LEU   3 -14.567   2.488  -7.044
   19    HG   LEU   3           HG       LEU   3 -11.910   3.839  -7.053
   20   1HD1  LEU   3          1HD1      LEU   3 -11.682   1.184  -6.860
   21   2HD1  LEU   3          2HD1      LEU   3 -12.121   1.261  -8.583
   22   3HD1  LEU   3          3HD1      LEU   3 -10.676   2.116  -7.994
   23   1HD2  LEU   3          1HD2      LEU   3 -13.969   2.892  -9.076
   24   2HD2  LEU   3          2HD2      LEU   3 -13.532   4.564  -8.649
   25   3HD2  LEU   3          3HD2      LEU   3 -12.390   3.552  -9.565
   26    H    SER   4           H        SER   4 -14.712   4.722  -3.276
   27    HA   SER   4           HA       SER   4 -13.362   2.972  -1.541
   28   1HB   SER   4          1HB       SER   4 -11.518   4.630  -2.767
   29   2HB   SER   4          2HB       SER   4 -11.872   5.497  -1.253
   30    HG   SER   4           HG       SER   4 -10.968   3.948  -0.154
   31    H    GLN   5           H        GLN   5 -15.074   3.069  -0.171
   32    HA   GLN   5           HA       GLN   5 -15.370   5.439   1.464
   33   1HB   GLN   5          1HB       GLN   5 -17.046   5.126  -0.879
   34   2HB   GLN   5          2HB       GLN   5 -18.032   5.019   0.599
   35   1HG   GLN   5          1HG       GLN   5 -15.986   7.129   0.727
   36   2HG   GLN   5          2HG       GLN   5 -17.143   7.367  -0.600
   37   1HE2  GLN   5          1HE2      GLN   5 -19.220   8.026  -0.157
   38   2HE2  GLN   5          2HE2      GLN   5 -19.835   8.299   1.459
   39    H    GLU   6           H        GLU   6 -18.013   3.212   0.649
   40    HA   GLU   6           HA       GLU   6 -17.526   1.840   3.253
   41   1HB   GLU   6          1HB       GLU   6 -19.923   1.703   3.542
   42   2HB   GLU   6          2HB       GLU   6 -19.504   3.400   3.203
   43   1HG   GLU   6          1HG       GLU   6 -20.767   3.401   1.340
   44   2HG   GLU   6          2HG       GLU   6 -19.939   1.955   0.723
   45    H    THR   7           H        THR   7 -16.298   0.920   0.914
   46    HA   THR   7           HA       THR   7 -17.303  -1.759   0.816
   47    HB   THR   7           HB       THR   7 -18.203   0.170  -1.259
   48    HG1  THR   7           1HG      THR   7 -19.601  -1.020   0.087
   49   1HG2  THR   7          1HG2      THR   7 -16.513  -2.138  -1.900
   50   2HG2  THR   7          2HG2      THR   7 -18.130  -2.270  -2.633
   51   3HG2  THR   7          3HG2      THR   7 -17.117  -0.845  -2.965
   52    H    PHE   8           H        PHE   8 -16.017  -0.172  -2.069
   53    HA   PHE   8           HA       PHE   8 -13.821  -1.854  -2.359
   54   1HB   PHE   8          1HB       PHE   8 -12.930   0.491  -3.454
   55   2HB   PHE   8          2HB       PHE   8 -14.013  -0.659  -4.256
   56    HD1  PHE   8           1HD      PHE   8 -14.882   1.594  -1.415
   57    HD2  PHE   8           2HD      PHE   8 -15.285   0.801  -5.618
   58    HE1  PHE   8           1HE      PHE   8 -16.627   3.349  -1.579
   59    HE2  PHE   8           2HE      PHE   8 -17.030   2.556  -5.781
   60    HZ   PHE   8           HZ       PHE   8 -17.701   3.830  -3.762
   61    H    SER   9           H        SER   9 -14.328   0.671  -0.048
   62    HA   SER   9           HA       SER   9 -11.516   1.232   0.416
   63   1HB   SER   9          1HB       SER   9 -14.033   2.340   1.146
   64   2HB   SER   9          2HB       SER   9 -13.212   1.880   2.657
   65    HG   SER   9           HG       SER   9 -11.318   2.949   1.667
   66    H    ASP  10           H        ASP  10 -13.889  -1.121   1.480
   67    HA   ASP  10           HA       ASP  10 -12.660  -1.870   3.939
   68   1HB   ASP  10          1HB       ASP  10 -14.946  -2.541   2.538
   69   2HB   ASP  10          2HB       ASP  10 -13.969  -4.020   2.408
   70    H    LEU  11           H        LEU  11 -11.873  -2.462   0.579
   71    HA   LEU  11           HA       LEU  11 -10.119  -4.727   1.225
   72   1HB   LEU  11          1HB       LEU  11  -9.604  -3.946  -1.389
   73   2HB   LEU  11          2HB       LEU  11 -10.783  -5.180  -0.885
   74    HG   LEU  11           HG       LEU  11 -12.128  -3.750  -2.153
   75   1HD1  LEU  11          1HD1      LEU  11 -12.403  -2.114   0.342
   76   2HD1  LEU  11          2HD1      LEU  11 -13.651  -2.936  -0.624
   77   3HD1  LEU  11          3HD1      LEU  11 -12.629  -3.873   0.493
   78   1HD2  LEU  11          1HD2      LEU  11 -10.694  -1.365  -0.911
   79   2HD2  LEU  11          2HD2      LEU  11 -10.272  -2.078  -2.486
   80   3HD2  LEU  11          3HD2      LEU  11 -11.870  -1.331  -2.247
   81    H    TRP  12           H        TRP  12  -9.013  -2.465  -1.165
   82    HA   TRP  12           HA       TRP  12  -6.653  -1.896  -1.121
   83   1HB   TRP  12          1HB       TRP  12  -7.845   0.320   0.504
   84   2HB   TRP  12          2HB       TRP  12  -6.791   0.401  -0.914
   85    HD1  TRP  12           HD       TRP  12  -9.927   1.584  -0.159
   86    HE1  TRP  12           1HE      TRP  12 -11.616   1.530  -2.065
   87    HE3  TRP  12           3HE      TRP  12  -7.599  -1.808  -3.204
   88    HZ2  TRP  12           2HZ      TRP  12 -11.929   0.181  -4.606
   89    HZ3  TRP  12           3HZ      TRP  12  -8.622  -2.452  -5.355
   90    HH2  TRP  12           HH       TRP  12 -10.781  -1.470  -6.070
   91    H    LYS  13           H        LYS  13  -8.281  -1.821   2.060
   92    HA   LYS  13           HA       LYS  13  -6.146  -1.183   3.714
   93   1HB   LYS  13          1HB       LYS  13  -8.639  -1.758   4.231
   94   2HB   LYS  13          2HB       LYS  13  -8.048  -3.429   4.398
   95   1HG   LYS  13          1HG       LYS  13  -6.431  -2.727   6.095
   96   2HG   LYS  13          2HG       LYS  13  -6.896  -1.024   5.875
   97   1HD   LYS  13          1HD       LYS  13  -9.222  -1.601   6.579
   98   2HD   LYS  13          2HD       LYS  13  -8.693  -3.274   6.875
   99   1HE   LYS  13          1HE       LYS  13  -7.957  -2.688   8.915
  100   2HE   LYS  13          2HE       LYS  13  -6.842  -1.517   8.178
  101   1HZ   LYS  13          1HZ       LYS  13  -9.247  -1.061   9.561
  102   2HZ   LYS  13          2HZ       LYS  13  -8.069   0.007   9.122
  103   3HZ   LYS  13          3HZ       LYS  13  -9.287  -0.355   8.071
  104    H    LEU  14           H        LEU  14  -6.249  -3.686   1.460
  105    HA   LEU  14           HA       LEU  14  -4.504  -5.486   3.016
  106   1HB   LEU  14          1HB       LEU  14  -4.683  -6.894   0.928
  107   2HB   LEU  14          2HB       LEU  14  -6.239  -6.557   1.724
  108    HG   LEU  14           HG       LEU  14  -6.256  -6.252  -0.794
  109   1HD1  LEU  14          1HD1      LEU  14  -6.783  -3.513   0.094
  110   2HD1  LEU  14          2HD1      LEU  14  -7.925  -4.766  -0.449
  111   3HD1  LEU  14          3HD1      LEU  14  -7.405  -4.713   1.253
  112   1HD2  LEU  14          1HD2      LEU  14  -4.826  -4.819  -1.837
  113   2HD2  LEU  14          2HD2      LEU  14  -4.943  -3.608  -0.538
  114   3HD2  LEU  14          3HD2      LEU  14  -3.842  -4.996  -0.365
  115    H    LEU  15           H        LEU  15  -4.440  -3.120   0.384
  116    HA   LEU  15           HA       LEU  15  -1.575  -3.725  -0.093
  117   1HB   LEU  15          1HB       LEU  15  -1.963  -2.053  -2.006
  118   2HB   LEU  15          2HB       LEU  15  -2.797  -3.621  -2.128
  119    HG   LEU  15           HG       LEU  15  -4.845  -2.597  -1.172
  120   1HD1  LEU  15          1HD1      LEU  15  -4.131   0.180  -1.552
  121   2HD1  LEU  15          2HD1      LEU  15  -4.752  -0.622  -0.090
  122   3HD1  LEU  15          3HD1      LEU  15  -3.000  -0.569  -0.399
  123   1HD2  LEU  15          1HD2      LEU  15  -4.800  -2.608  -3.548
  124   2HD2  LEU  15          2HD2      LEU  15  -5.230  -0.935  -3.119
  125   3HD2  LEU  15          3HD2      LEU  15  -3.566  -1.328  -3.613
  126    H    LYS  16           H        LYS  16  -3.762  -1.460   1.412
  127    HA   LYS  16           HA       LYS  16  -2.533   0.961   1.387
  128   1HB   LYS  16          1HB       LYS  16  -4.059   1.274   3.000
  129   2HB   LYS  16          2HB       LYS  16  -4.250  -0.487   3.172
  130   1HG   LYS  16          1HG       LYS  16  -1.970   1.058   4.464
  131   2HG   LYS  16          2HG       LYS  16  -3.523   0.764   5.284
  132   1HD   LYS  16          1HD       LYS  16  -2.162  -1.588   4.016
  133   2HD   LYS  16          2HD       LYS  16  -1.449  -0.934   5.510
  134   1HE   LYS  16          1HE       LYS  16  -4.415  -1.524   5.269
  135   2HE   LYS  16          2HE       LYS  16  -3.248  -2.771   5.760
  136   1HZ   LYS  16          1HZ       LYS  16  -4.402  -1.301   7.498
  137   2HZ   LYS  16          2HZ       LYS  16  -2.811  -1.695   7.679
  138   3HZ   LYS  16          3HZ       LYS  16  -3.232  -0.205   7.113
  139    H    LYS  17           H        LYS  17  -1.146  -2.019   2.509
  140    HA   LYS  17           HA       LYS  17   0.964  -0.644   4.035
  141   1HB   LYS  17          1HB       LYS  17   1.621  -2.820   4.734
  142   2HB   LYS  17          2HB       LYS  17  -0.159  -2.852   4.712
  143   1HG   LYS  17          1HG       LYS  17  -0.200  -4.012   2.608
  144   2HG   LYS  17          2HG       LYS  17   1.541  -3.741   2.351
  145   1HD   LYS  17          1HD       LYS  17   2.103  -5.199   4.210
  146   2HD   LYS  17          2HD       LYS  17   0.389  -5.349   4.668
  147   1HE   LYS  17          1HE       LYS  17  -0.004  -6.929   3.095
  148   2HE   LYS  17          2HE       LYS  17   0.893  -6.031   1.851
  149   1HZ   LYS  17          1HZ       LYS  17   1.808  -8.070   3.666
  150   2HZ   LYS  17          2HZ       LYS  17   2.250  -7.761   2.108
  151   3HZ   LYS  17          3HZ       LYS  17   2.867  -6.849   3.336
  152    H    TRP  18           H        TRP  18   0.283  -1.521   0.813
  153    HA   TRP  18           HA       TRP  18   2.921  -2.277  -0.033
  154   1HB   TRP  18          1HB       TRP  18   2.025  -1.772  -2.293
  155   2HB   TRP  18          2HB       TRP  18   0.997  -2.861  -1.351
  156    HD1  TRP  18           HD       TRP  18  -0.616  -1.795  -3.497
  157    HE1  TRP  18           1HE      TRP  18  -2.371   0.041  -3.308
  158    HE3  TRP  18           3HE      TRP  18   1.030   0.456   0.795
  159    HZ2  TRP  18           2HZ      TRP  18  -2.993   2.228  -1.517
  160    HZ3  TRP  18           3HZ      TRP  18  -0.167   2.410   1.710
  161    HH2  TRP  18           HH       TRP  18  -2.175   3.306   0.569
  162    H    LYS  19           H        LYS  19   1.086   0.815  -0.020
  163    HA   LYS  19           HA       LYS  19   3.283   2.307  -1.164
  164   1HB   LYS  19          1HB       LYS  19   0.654   2.757  -1.040
  165   2HB   LYS  19          2HB       LYS  19   1.119   3.615   0.448
  166   1HG   LYS  19          1HG       LYS  19   2.710   4.992  -0.782
  167   2HG   LYS  19          2HG       LYS  19   2.420   4.060  -2.271
  168   1HD   LYS  19          1HD       LYS  19   0.109   4.821  -2.362
  169   2HD   LYS  19          2HD       LYS  19   0.269   5.620  -0.779
  170   1HE   LYS  19          1HE       LYS  19   1.653   7.310  -1.625
  171   2HE   LYS  19          2HE       LYS  19   2.150   6.339  -3.028
  172   1HZ   LYS  19          1HZ       LYS  19  -0.631   6.806  -2.980
  173   2HZ   LYS  19          2HZ       LYS  19   0.217   8.220  -2.981
  174   3HZ   LYS  19          3HZ       LYS  19   0.467   7.108  -4.173
  175    H    MET  20           H        MET  20   2.904   0.832   1.805
  176    HA   MET  20           HA       MET  20   4.251   2.989   3.318
  177   1HB   MET  20          1HB       MET  20   2.992   0.335   4.093
  178   2HB   MET  20          2HB       MET  20   3.909   1.349   5.232
  179   1HG   MET  20          1HG       MET  20   1.601   2.415   3.582
  180   2HG   MET  20          2HG       MET  20   1.362   1.670   5.172
  181   1HE   MET  20          1HE       MET  20   3.369   5.315   3.729
  182   2HE   MET  20          2HE       MET  20   2.103   4.291   3.010
  183   3HE   MET  20          3HE       MET  20   1.653   5.675   4.034
  184    H    ARG  21           H        ARG  21   6.041   2.141   4.851
  185    HA   ARG  21           HA       ARG  21   8.170   1.328   5.048
  186   1HB   ARG  21          1HB       ARG  21   6.600  -0.842   4.671
  187   2HB   ARG  21          2HB       ARG  21   7.650  -0.989   3.241
  188   1HG   ARG  21          1HG       ARG  21   9.619  -1.107   4.557
  189   2HG   ARG  21          2HG       ARG  21   8.799  -0.460   5.998
  190   1HD   ARG  21          1HD       ARG  21   7.474  -2.867   5.024
  191   2HD   ARG  21          2HD       ARG  21   9.195  -3.173   5.344
  192    HE   ARG  21           HE       ARG  21   8.337  -1.766   7.561
  193   1HH1  ARG  21          2HH2      ARG  21   7.322  -4.704   5.876
  194   2HH1  ARG  21          1HH2      ARG  21   6.716  -5.486   7.319
  195   1HH2  ARG  21          2HH1      ARG  21   7.535  -2.799   9.467
  196   2HH2  ARG  21          1HH1      ARG  21   6.837  -4.400   9.366
  197    H    ARG  22           H        ARG  22   7.055   2.784   2.464
  198    HA   ARG  22           HA       ARG  22   9.274   2.089   0.629
  199   1HB   ARG  22          1HB       ARG  22   6.575   3.315   0.391
  200   2HB   ARG  22          2HB       ARG  22   7.836   4.009  -0.656
  201   1HG   ARG  22          1HG       ARG  22   6.999   2.239  -1.961
  202   2HG   ARG  22          2HG       ARG  22   8.425   1.511  -1.184
  203   1HD   ARG  22          1HD       ARG  22   5.811   1.356   0.275
  204   2HD   ARG  22          2HD       ARG  22   6.018   0.318  -1.153
  205    HE   ARG  22           HE       ARG  22   8.228   0.241   0.772
  206   1HH1  ARG  22          2HH2      ARG  22   5.148  -1.129  -0.296
  207   2HH1  ARG  22          1HH2      ARG  22   5.414  -2.677   0.473
  208   1HH2  ARG  22          2HH1      ARG  22   8.578  -1.804   1.788
  209   2HH2  ARG  22          1HH1      ARG  22   7.370  -3.062   1.662
  210    H    ASN  23           H        ASN  23  10.625   3.066   2.538
  211    HA   ASN  23           HA       ASN  23  10.611   5.995   2.592
  212   1HB   ASN  23          1HB       ASN  23  11.076   4.988   4.678
  213   2HB   ASN  23          2HB       ASN  23  12.196   3.810   3.959
  214   1HD2  ASN  23          1HD2      ASN  23  14.264   4.210   4.486
  215   2HD2  ASN  23          2HD2      ASN  23  14.987   5.796   4.649
  216    H    GLN  24           H        GLN  24  13.626   4.179   2.571
  217    HA   GLN  24           HA       GLN  24  14.235   4.948  -0.194
  218   1HB   GLN  24          1HB       GLN  24  14.785   6.783   1.790
  219   2HB   GLN  24          2HB       GLN  24  16.311   5.871   1.691
  220   1HG   GLN  24          1HG       GLN  24  16.195   6.169  -0.833
  221   2HG   GLN  24          2HG       GLN  24  14.846   7.294  -0.563
  222   1HE2  GLN  24          1HE2      GLN  24  15.326   9.059   1.149
  223   2HE2  GLN  24          2HE2      GLN  24  16.902   9.816   1.045
  224    H    PHE  25           H        PHE  25  15.420   3.682   2.953
  225    HA   PHE  25           HA       PHE  25  17.218   1.851   1.465
  226   1HB   PHE  25          1HB       PHE  25  18.388   2.990   3.161
  227   2HB   PHE  25          2HB       PHE  25  17.053   2.833   4.315
  228    HD1  PHE  25           1HD      PHE  25  16.385   0.270   4.820
  229    HD2  PHE  25           2HD      PHE  25  20.232   1.635   3.482
  230    HE1  PHE  25           1HE      PHE  25  17.436  -1.770   5.760
  231    HE2  PHE  25           2HE      PHE  25  21.283  -0.405   4.422
  232    HZ   PHE  25           HZ       PHE  25  19.885  -2.108   5.561
  233    H    TRP  26           H        TRP  26  14.508   1.955   3.796
  234    HA   TRP  26           HA       TRP  26  14.347  -0.997   3.720
  235   1HB   TRP  26          1HB       TRP  26  12.508  -0.549   5.419
  236   2HB   TRP  26          2HB       TRP  26  14.161  -0.147   5.906
  237    HD1  TRP  26           HD       TRP  26  10.757   1.339   5.383
  238    HE1  TRP  26           1HE      TRP  26  10.724   3.795   6.055
  239    HE3  TRP  26           3HE      TRP  26  15.788   2.085   5.960
  240    HZ2  TRP  26           2HZ      TRP  26  12.642   5.845   6.759
  241    HZ3  TRP  26           3HZ      TRP  26  16.645   4.299   6.631
  242    HH2  TRP  26           HH       TRP  26  15.091   6.185   7.033
  243    H    VAL  27           H        VAL  27  13.808   0.512   1.299
  244    HA   VAL  27           HA       VAL  27  10.878   0.522   1.053
  245    HB   VAL  27           HB       VAL  27  11.353   1.356  -1.224
  246   1HG1  VAL  27          1HG1      VAL  27  11.258   3.191   0.172
  247   2HG1  VAL  27          2HG1      VAL  27  12.545   2.579   1.238
  248   3HG1  VAL  27          3HG1      VAL  27  12.962   3.322  -0.325
  249   1HG2  VAL  27          1HG2      VAL  27  13.364   1.079  -2.224
  250   2HG2  VAL  27          2HG2      VAL  27  14.232   1.723  -0.810
  251   3HG2  VAL  27          3HG2      VAL  27  13.780   0.003  -0.869
  252    H    LYS  28           H        LYS  28  11.615  -0.266  -1.925
  253    HA   LYS  28           HA       LYS  28  10.940  -3.091  -1.522
  254   1HB   LYS  28          1HB       LYS  28  11.163  -1.277  -3.946
  255   2HB   LYS  28          2HB       LYS  28  10.820  -3.019  -4.067
  256   1HG   LYS  28          1HG       LYS  28   8.668  -2.723  -3.437
  257   2HG   LYS  28          2HG       LYS  28   9.144  -1.718  -2.048
  258   1HD   LYS  28          1HD       LYS  28   8.944   0.254  -3.230
  259   2HD   LYS  28          2HD       LYS  28   9.399  -0.503  -4.776
  260   1HE   LYS  28          1HE       LYS  28   7.092  -1.816  -4.349
  261   2HE   LYS  28          2HE       LYS  28   6.725  -0.339  -3.432
  262   1HZ   LYS  28          1HZ       LYS  28   7.734   0.654  -5.653
  263   2HZ   LYS  28          2HZ       LYS  28   7.034  -0.714  -6.253
  264   3HZ   LYS  28          3HZ       LYS  28   6.124   0.381  -5.420
  265    H    VAL  29           H        VAL  29  13.481  -2.517  -0.511
  266    HA   VAL  29           HA       VAL  29  15.505  -3.099  -2.507
  267    HB   VAL  29           HB       VAL  29  16.901  -3.424  -0.356
  268   1HG1  VAL  29          1HG1      VAL  29  15.498  -0.746  -0.470
  269   2HG1  VAL  29          2HG1      VAL  29  17.222  -1.097  -0.204
  270   3HG1  VAL  29          3HG1      VAL  29  16.514  -1.290  -1.826
  271   1HG2  VAL  29          1HG2      VAL  29  14.764  -1.935   1.090
  272   2HG2  VAL  29          2HG2      VAL  29  14.461  -3.671   0.839
  273   3HG2  VAL  29          3HG2      VAL  29  15.927  -3.138   1.696
  274    H    GLN  30           H        GLN  30  14.155  -5.033  -3.291
  275    HA   GLN  30           HA       GLN  30  14.563  -7.417  -1.580
  276   1HB   GLN  30          1HB       GLN  30  12.436  -6.572  -3.148
  277   2HB   GLN  30          2HB       GLN  30  13.239  -7.778  -4.181
  278   1HG   GLN  30          1HG       GLN  30  13.257  -9.346  -2.205
  279   2HG   GLN  30          2HG       GLN  30  12.280  -8.158  -1.317
  280   1HE2  GLN  30          1HE2      GLN  30  11.803 -11.009  -2.450
  281   2HE2  GLN  30          2HE2      GLN  30  10.282 -10.860  -3.304
  282    H    ARG  31           H        ARG  31  15.336  -9.423  -2.696
  283    HA   ARG  31           HA       ARG  31  16.890  -9.117  -5.124
  284   1HB   ARG  31          1HB       ARG  31  18.147  -8.330  -2.750
  285   2HB   ARG  31          2HB       ARG  31  18.718  -9.994  -3.017
  286   1HG   ARG  31          1HG       ARG  31  20.136  -9.202  -4.580
  287   2HG   ARG  31          2HG       ARG  31  18.727  -8.737  -5.563
  288   1HD   ARG  31          1HD       ARG  31  18.662  -6.649  -3.948
  289   2HD   ARG  31          2HD       ARG  31  20.363  -7.070  -3.655
  290    HE   ARG  31           HE       ARG  31  19.617  -6.914  -6.480
  291   1HH1  ARG  31          2HH2      ARG  31  20.806  -5.205  -3.622
  292   2HH1  ARG  31          1HH2      ARG  31  21.585  -3.934  -4.538
  293   1HH2  ARG  31          2HH1      ARG  31  20.646  -5.236  -7.689
  294   2HH2  ARG  31          1HH1      ARG  31  21.494  -3.952  -6.857
  295    H    GLY  32           H        GLY  32  16.750 -11.044  -2.067
  296   1HA   GLY  32          1HA       GLY  32  16.398 -13.462  -3.786
  297   2HA   GLY  32          2HA       GLY  32  17.342 -13.457  -2.278
  Start of MODEL   20
    1    HA   PRO   1           HA       PRO   1 -10.712  14.896   3.466
    2   1HB   PRO   1          1HB       PRO   1  -8.893  13.860   1.722
    3   2HB   PRO   1          2HB       PRO   1  -8.412  14.988   3.032
    4   1HG   PRO   1          1HG       PRO   1  -8.311  11.958   3.085
    5   2HG   PRO   1          2HG       PRO   1  -6.981  13.098   3.474
    6   1HD   PRO   1          1HD       PRO   1  -8.549  12.024   5.428
    7   2HD   PRO   1          2HD       PRO   1  -8.037  13.737   5.515
    8    HA   PRO   2           HA       PRO   2 -13.290  12.045   1.320
    9   1HB   PRO   2          1HB       PRO   2 -13.280  12.943  -1.253
   10   2HB   PRO   2          2HB       PRO   2 -13.939  13.932   0.091
   11   1HG   PRO   2          1HG       PRO   2 -11.156  14.074  -1.103
   12   2HG   PRO   2          2HG       PRO   2 -12.302  15.430  -0.852
   13   1HD   PRO   2          1HD       PRO   2 -10.346  14.869   0.961
   14   2HD   PRO   2          2HD       PRO   2 -11.979  15.352   1.510
   15    H    LEU   3           H        LEU   3 -13.227  10.871  -1.117
   16    HA   LEU   3           HA       LEU   3 -12.241   9.220  -2.359
   17   1HB   LEU   3          1HB       LEU   3 -10.552  10.863  -2.959
   18   2HB   LEU   3          2HB       LEU   3  -9.692  10.592  -1.424
   19    HG   LEU   3           HG       LEU   3  -9.341   8.207  -2.079
   20   1HD1  LEU   3          1HD1      LEU   3 -10.622   7.343  -3.719
   21   2HD1  LEU   3          2HD1      LEU   3 -11.270   8.957  -4.100
   22   3HD1  LEU   3          3HD1      LEU   3  -9.778   8.390  -4.887
   23   1HD2  LEU   3          1HD2      LEU   3  -7.940  10.416  -2.875
   24   2HD2  LEU   3          2HD2      LEU   3  -7.431   8.745  -3.217
   25   3HD2  LEU   3          3HD2      LEU   3  -8.310   9.678  -4.452
   26    H    SER   4           H        SER   4 -12.121   7.102  -1.868
   27    HA   SER   4           HA       SER   4 -11.924   5.211  -0.590
   28   1HB   SER   4          1HB       SER   4  -9.421   6.329  -0.869
   29   2HB   SER   4          2HB       SER   4  -9.548   6.141   0.897
   30    HG   SER   4           HG       SER   4 -10.175   3.958   0.504
   31    H    GLN   5           H        GLN   5 -13.593   5.102   0.833
   32    HA   GLN   5           HA       GLN   5 -13.046   5.845   3.596
   33   1HB   GLN   5          1HB       GLN   5 -15.160   7.261   1.941
   34   2HB   GLN   5          2HB       GLN   5 -15.228   7.173   3.718
   35   1HG   GLN   5          1HG       GLN   5 -13.036   8.401   2.003
   36   2HG   GLN   5          2HG       GLN   5 -14.124   9.240   3.130
   37   1HE2  GLN   5          1HE2      GLN   5 -14.057   7.376   5.285
   38   2HE2  GLN   5          2HE2      GLN   5 -12.456   7.413   5.992
   39    H    GLU   6           H        GLU   6 -16.331   5.741   2.364
   40    HA   GLU   6           HA       GLU   6 -16.551   2.958   3.410
   41   1HB   GLU   6          1HB       GLU   6 -18.821   3.511   4.061
   42   2HB   GLU   6          2HB       GLU   6 -17.726   4.746   4.726
   43   1HG   GLU   6          1HG       GLU   6 -18.294   5.827   2.278
   44   2HG   GLU   6          2HG       GLU   6 -19.816   4.979   2.626
   45    H    THR   7           H        THR   7 -15.696   3.421   0.758
   46    HA   THR   7           HA       THR   7 -17.759   1.974  -0.662
   47    HB   THR   7           HB       THR   7 -17.433   4.912  -1.032
   48    HG1  THR   7           1HG      THR   7 -19.597   4.579  -1.717
   49   1HG2  THR   7          1HG2      THR   7 -16.805   4.767  -3.198
   50   2HG2  THR   7          2HG2      THR   7 -16.939   2.992  -3.178
   51   3HG2  THR   7          3HG2      THR   7 -18.374   3.989  -3.517
   52    H    PHE   8           H        PHE   8 -15.628   4.227  -2.329
   53    HA   PHE   8           HA       PHE   8 -14.361   2.279  -3.877
   54   1HB   PHE   8          1HB       PHE   8 -12.477   4.247  -3.730
   55   2HB   PHE   8          2HB       PHE   8 -13.903   4.291  -4.781
   56    HD1  PHE   8           1HD      PHE   8 -13.863   4.694  -1.074
   57    HD2  PHE   8           2HD      PHE   8 -14.311   6.619  -4.888
   58    HE1  PHE   8           1HE      PHE   8 -14.637   6.760   0.059
   59    HE2  PHE   8           2HE      PHE   8 -15.085   8.685  -3.754
   60    HZ   PHE   8           HZ       PHE   8 -15.248   8.755  -1.281
   61    H    SER   9           H        SER   9 -13.923   3.049  -0.535
   62    HA   SER   9           HA       SER   9 -11.181   2.105  -0.358
   63   1HB   SER   9          1HB       SER   9 -13.211   3.299   1.383
   64   2HB   SER   9          2HB       SER   9 -12.322   1.982   2.185
   65    HG   SER   9           HG       SER   9 -11.289   4.046   2.349
   66    H    ASP  10           H        ASP  10 -14.389   0.710  -0.341
   67    HA   ASP  10           HA       ASP  10 -13.792  -1.681   1.100
   68   1HB   ASP  10          1HB       ASP  10 -16.043  -0.529   0.107
   69   2HB   ASP  10          2HB       ASP  10 -15.765  -1.781  -1.122
   70    H    LEU  11           H        LEU  11 -13.072  -0.564  -2.140
   71    HA   LEU  11           HA       LEU  11 -12.497  -3.269  -3.121
   72   1HB   LEU  11          1HB       LEU  11 -11.470  -1.419  -4.936
   73   2HB   LEU  11          2HB       LEU  11 -13.080  -2.176  -5.005
   74    HG   LEU  11           HG       LEU  11 -13.660   0.080  -5.033
   75   1HD1  LEU  11          1HD1      LEU  11 -14.803   0.408  -3.055
   76   2HD1  LEU  11          2HD1      LEU  11 -14.330  -1.291  -2.815
   77   3HD1  LEU  11          3HD1      LEU  11 -13.389   0.011  -2.049
   78   1HD2  LEU  11          1HD2      LEU  11 -12.434   1.841  -3.882
   79   2HD2  LEU  11          2HD2      LEU  11 -11.452   0.640  -3.009
   80   3HD2  LEU  11          3HD2      LEU  11 -11.271   0.829  -4.770
   81    H    TRP  12           H        TRP  12 -10.341  -0.694  -4.036
   82    HA   TRP  12           HA       TRP  12  -7.970  -1.281  -4.113
   83   1HB   TRP  12          1HB       TRP  12  -8.221  -0.024  -1.410
   84   2HB   TRP  12          2HB       TRP  12  -7.148   0.388  -2.755
   85    HD1  TRP  12           HD       TRP  12  -9.513   2.094  -0.940
   86    HE1  TRP  12           1HE      TRP  12 -10.941   3.740  -2.257
   87    HE3  TRP  12           3HE      TRP  12  -8.685   0.287  -5.656
   88    HZ2  TRP  12           2HZ      TRP  12 -11.647   4.223  -5.022
   89    HZ3  TRP  12           3HZ      TRP  12  -9.751   1.364  -7.604
   90    HH2  TRP  12           HH       TRP  12 -11.231   3.328  -7.305
   91    H    LYS  13           H        LYS  13  -9.767  -2.370  -1.246
   92    HA   LYS  13           HA       LYS  13  -7.708  -3.603   0.187
   93   1HB   LYS  13          1HB       LYS  13  -9.756  -3.576   1.283
   94   2HB   LYS  13          2HB       LYS  13 -10.656  -4.098  -0.161
   95   1HG   LYS  13          1HG       LYS  13  -9.821  -6.353   0.038
   96   2HG   LYS  13          2HG       LYS  13  -8.662  -5.873   1.301
   97   1HD   LYS  13          1HD       LYS  13 -10.299  -5.715   2.935
   98   2HD   LYS  13          2HD       LYS  13 -11.578  -5.312   1.765
   99   1HE   LYS  13          1HE       LYS  13 -11.798  -7.617   2.746
  100   2HE   LYS  13          2HE       LYS  13 -11.661  -7.603   0.974
  101   1HZ   LYS  13          1HZ       LYS  13  -9.252  -7.867   2.564
  102   2HZ   LYS  13          2HZ       LYS  13 -10.237  -9.180   2.403
  103   3HZ   LYS  13          3HZ       LYS  13  -9.596  -8.461   1.064
  104    H    LEU  14           H        LEU  14  -8.671  -4.217  -2.998
  105    HA   LEU  14           HA       LEU  14  -8.106  -7.088  -2.960
  106   1HB   LEU  14          1HB       LEU  14  -8.231  -6.596  -5.545
  107   2HB   LEU  14          2HB       LEU  14  -9.714  -6.555  -4.560
  108    HG   LEU  14           HG       LEU  14  -9.219  -4.560  -6.187
  109   1HD1  LEU  14          1HD1      LEU  14 -10.126  -4.507  -3.319
  110   2HD1  LEU  14          2HD1      LEU  14  -9.969  -2.962  -4.190
  111   3HD1  LEU  14          3HD1      LEU  14 -11.059  -4.226  -4.809
  112   1HD2  LEU  14          1HD2      LEU  14  -6.826  -4.462  -5.034
  113   2HD2  LEU  14          2HD2      LEU  14  -7.652  -2.967  -5.533
  114   3HD2  LEU  14          3HD2      LEU  14  -7.690  -3.477  -3.829
  115    H    LEU  15           H        LEU  15  -6.549  -4.046  -4.042
  116    HA   LEU  15           HA       LEU  15  -4.277  -5.281  -5.237
  117   1HB   LEU  15          1HB       LEU  15  -5.078  -2.560  -4.314
  118   2HB   LEU  15          2HB       LEU  15  -3.332  -2.864  -4.475
  119    HG   LEU  15           HG       LEU  15  -4.895  -2.089  -6.554
  120   1HD1  LEU  15          1HD1      LEU  15  -3.088  -3.756  -7.825
  121   2HD1  LEU  15          2HD1      LEU  15  -2.720  -2.126  -7.211
  122   3HD1  LEU  15          3HD1      LEU  15  -2.352  -3.556  -6.217
  123   1HD2  LEU  15          1HD2      LEU  15  -5.825  -4.671  -6.031
  124   2HD2  LEU  15          2HD2      LEU  15  -6.044  -3.769  -7.549
  125   3HD2  LEU  15          3HD2      LEU  15  -4.681  -4.901  -7.376
  126    H    LYS  16           H        LYS  16  -5.260  -4.864  -1.942
  127    HA   LYS  16           HA       LYS  16  -2.897  -4.571  -0.538
  128   1HB   LYS  16          1HB       LYS  16  -4.679  -4.712   0.890
  129   2HB   LYS  16          2HB       LYS  16  -5.496  -5.960  -0.081
  130   1HG   LYS  16          1HG       LYS  16  -2.908  -6.683   1.264
  131   2HG   LYS  16          2HG       LYS  16  -4.367  -6.545   2.274
  132   1HD   LYS  16          1HD       LYS  16  -3.830  -8.416  -0.046
  133   2HD   LYS  16          2HD       LYS  16  -4.393  -8.805   1.598
  134   1HE   LYS  16          1HE       LYS  16  -6.436  -7.252   0.903
  135   2HE   LYS  16          2HE       LYS  16  -5.925  -7.692  -0.741
  136   1HZ   LYS  16          1HZ       LYS  16  -5.914 -10.038   0.380
  137   2HZ   LYS  16          2HZ       LYS  16  -7.062  -9.335   1.333
  138   3HZ   LYS  16          3HZ       LYS  16  -7.271  -9.394  -0.302
  139    H    LYS  17           H        LYS  17  -4.358  -7.771  -1.369
  140    HA   LYS  17           HA       LYS  17  -2.220  -9.371  -0.631
  141   1HB   LYS  17          1HB       LYS  17  -4.221 -10.450  -1.257
  142   2HB   LYS  17          2HB       LYS  17  -4.299  -9.599  -2.818
  143   1HG   LYS  17          1HG       LYS  17  -3.468 -11.629  -3.549
  144   2HG   LYS  17          2HG       LYS  17  -1.932 -10.817  -3.163
  145   1HD   LYS  17          1HD       LYS  17  -3.305 -12.241  -0.919
  146   2HD   LYS  17          2HD       LYS  17  -2.576 -13.255  -2.187
  147   1HE   LYS  17          1HE       LYS  17  -0.457 -11.885  -1.924
  148   2HE   LYS  17          2HE       LYS  17  -1.206 -11.126  -0.502
  149   1HZ   LYS  17          1HZ       LYS  17   0.043 -12.885   0.283
  150   2HZ   LYS  17          2HZ       LYS  17  -1.507 -13.446   0.316
  151   3HZ   LYS  17          3HZ       LYS  17  -0.480 -13.933  -0.878
  152    H    TRP  18           H        TRP  18  -2.512  -7.205  -3.382
  153    HA   TRP  18           HA       TRP  18   0.087  -8.239  -4.411
  154   1HB   TRP  18          1HB       TRP  18  -0.906  -6.588  -6.357
  155   2HB   TRP  18          2HB       TRP  18  -1.076  -8.348  -6.324
  156    HD1  TRP  18           HD       TRP  18  -3.049  -5.296  -6.616
  157    HE1  TRP  18           1HE      TRP  18  -5.543  -5.720  -6.319
  158    HE3  TRP  18           3HE      TRP  18  -2.836 -10.014  -4.643
  159    HZ2  TRP  18           2HZ      TRP  18  -7.249  -7.845  -5.344
  160    HZ3  TRP  18           3HZ      TRP  18  -4.912 -11.204  -4.043
  161    HH2  TRP  18           HH       TRP  18  -7.122 -10.136  -4.386
  162    H    LYS  19           H        LYS  19  -1.465  -5.710  -2.720
  163    HA   LYS  19           HA       LYS  19   0.566  -3.719  -3.556
  164   1HB   LYS  19          1HB       LYS  19  -1.934  -3.190  -3.443
  165   2HB   LYS  19          2HB       LYS  19  -1.782  -3.321  -1.675
  166   1HG   LYS  19          1HG       LYS  19   0.110  -1.631  -1.812
  167   2HG   LYS  19          2HG       LYS  19  -0.317  -1.396  -3.524
  168   1HD   LYS  19          1HD       LYS  19  -2.084  -0.094  -2.984
  169   2HD   LYS  19          2HD       LYS  19  -2.679  -1.286  -1.804
  170   1HE   LYS  19          1HE       LYS  19  -0.231   0.192  -0.996
  171   2HE   LYS  19          2HE       LYS  19  -1.700   1.182  -1.137
  172   1HZ   LYS  19          1HZ       LYS  19  -2.431  -1.102   0.160
  173   2HZ   LYS  19          2HZ       LYS  19  -0.997  -0.662   0.846
  174   3HZ   LYS  19          3HZ       LYS  19  -2.255   0.404   0.811
  175    H    MET  20           H        MET  20   0.292  -6.215  -1.395
  176    HA   MET  20           HA       MET  20   1.131  -5.002   1.054
  177   1HB   MET  20          1HB       MET  20   0.289  -7.488   0.284
  178   2HB   MET  20          2HB       MET  20   2.038  -7.765   0.471
  179   1HG   MET  20          1HG       MET  20   1.211  -8.158   2.624
  180   2HG   MET  20          2HG       MET  20   1.792  -6.487   2.708
  181   1HE   MET  20          1HE       MET  20  -0.700  -4.306   2.141
  182   2HE   MET  20          2HE       MET  20  -0.732  -4.458   3.914
  183   3HE   MET  20          3HE       MET  20   0.801  -4.655   3.031
  184    H    ARG  21           H        ARG  21   3.297  -5.431   2.077
  185    HA   ARG  21           HA       ARG  21   5.560  -5.096   2.098
  186   1HB   ARG  21          1HB       ARG  21   5.177  -7.227   0.489
  187   2HB   ARG  21          2HB       ARG  21   5.910  -6.112  -0.689
  188   1HG   ARG  21          1HG       ARG  21   7.886  -5.862   0.612
  189   2HG   ARG  21          2HG       ARG  21   7.119  -6.558   2.059
  190   1HD   ARG  21          1HD       ARG  21   8.555  -8.253   1.119
  191   2HD   ARG  21          2HD       ARG  21   6.876  -8.728   0.782
  192    HE   ARG  21           HE       ARG  21   8.107  -7.169  -1.352
  193   1HH1  ARG  21          2HH2      ARG  21   7.630 -10.381   0.048
  194   2HH1  ARG  21          1HH2      ARG  21   7.903 -11.228  -1.458
  195   1HH2  ARG  21          2HH1      ARG  21   8.468  -8.289  -3.342
  196   2HH2  ARG  21          1HH1      ARG  21   8.380 -10.035  -3.391
  197    H    ARG  22           H        ARG  22   3.493  -3.313   0.459
  198    HA   ARG  22           HA       ARG  22   5.425  -1.840  -1.214
  199   1HB   ARG  22          1HB       ARG  22   2.435  -1.536  -0.736
  200   2HB   ARG  22          2HB       ARG  22   3.394  -0.517  -1.837
  201   1HG   ARG  22          1HG       ARG  22   3.471  -3.533  -2.072
  202   2HG   ARG  22          2HG       ARG  22   2.151  -2.601  -2.819
  203   1HD   ARG  22          1HD       ARG  22   3.646  -2.548  -4.569
  204   2HD   ARG  22          2HD       ARG  22   4.216  -1.118  -3.682
  205    HE   ARG  22           HE       ARG  22   5.516  -3.545  -2.789
  206   1HH1  ARG  22          2HH2      ARG  22   5.463  -1.054  -5.298
  207   2HH1  ARG  22          1HH2      ARG  22   7.151  -1.246  -5.716
  208   1HH2  ARG  22          2HH1      ARG  22   7.746  -3.798  -3.342
  209   2HH2  ARG  22          1HH1      ARG  22   8.452  -2.811  -4.601
  210    H    ASN  23           H        ASN  23   6.590  -1.471   0.995
  211    HA   ASN  23           HA       ASN  23   5.408   0.934   2.299
  212   1HB   ASN  23          1HB       ASN  23   5.766  -1.025   3.775
  213   2HB   ASN  23          2HB       ASN  23   7.487  -1.031   3.332
  214   1HD2  ASN  23          1HD2      ASN  23   7.807  -0.787   5.708
  215   2HD2  ASN  23          2HD2      ASN  23   7.749   0.823   6.394
  216    H    GLN  24           H        GLN  24   8.664   0.302   3.068
  217    HA   GLN  24           HA       GLN  24   9.918   1.650   0.853
  218   1HB   GLN  24          1HB       GLN  24   8.882   3.233   3.140
  219   2HB   GLN  24          2HB       GLN  24  10.577   3.552   2.698
  220   1HG   GLN  24          1HG       GLN  24   9.959   4.643   0.826
  221   2HG   GLN  24          2HG       GLN  24   8.908   3.301   0.324
  222   1HE2  GLN  24          1HE2      GLN  24   8.989   6.536   1.293
  223   2HE2  GLN  24          2HE2      GLN  24   7.306   6.732   1.734
  224    H    PHE  25           H        PHE  25   9.857   0.313   4.091
  225    HA   PHE  25           HA       PHE  25  12.334   0.511   5.121
  226   1HB   PHE  25          1HB       PHE  25  12.136  -2.064   5.525
  227   2HB   PHE  25          2HB       PHE  25  10.944  -0.964   6.238
  228    HD1  PHE  25           1HD      PHE  25  10.189  -0.869   2.881
  229    HD2  PHE  25           2HD      PHE  25  10.000  -3.564   6.221
  230    HE1  PHE  25           1HE      PHE  25   8.361  -2.122   1.767
  231    HE2  PHE  25           2HE      PHE  25   8.173  -4.817   5.106
  232    HZ   PHE  25           HZ       PHE  25   7.354  -4.096   2.879
  233    H    TRP  26           H        TRP  26  11.516  -1.062   2.059
  234    HA   TRP  26           HA       TRP  26  14.292  -2.027   1.760
  235   1HB   TRP  26          1HB       TRP  26  13.197  -2.779  -0.509
  236   2HB   TRP  26          2HB       TRP  26  12.888  -3.668   0.989
  237    HD1  TRP  26           HD       TRP  26  10.497  -4.431   0.998
  238    HE1  TRP  26           1HE      TRP  26   8.211  -3.473   0.412
  239    HE3  TRP  26           3HE      TRP  26  11.968   0.139  -0.776
  240    HZ2  TRP  26           2HZ      TRP  26   7.139  -1.022  -0.693
  241    HZ3  TRP  26           3HZ      TRP  26  10.289   1.756  -1.586
  242    HH2  TRP  26           HH       TRP  26   7.877   1.192  -1.552
  243    H    VAL  27           H        VAL  27  13.988   0.792   1.938
  244    HA   VAL  27           HA       VAL  27  14.387   1.644  -0.887
  245    HB   VAL  27           HB       VAL  27  13.996   3.941   0.035
  246   1HG1  VAL  27          1HG1      VAL  27  12.042   1.700   0.008
  247   2HG1  VAL  27          2HG1      VAL  27  11.506   3.163   0.868
  248   3HG1  VAL  27          3HG1      VAL  27  11.996   3.265  -0.840
  249   1HG2  VAL  27          1HG2      VAL  27  12.661   3.288   2.449
  250   2HG2  VAL  27          2HG2      VAL  27  14.233   2.456   2.521
  251   3HG2  VAL  27          3HG2      VAL  27  14.169   4.217   2.267
  252    H    LYS  28           H        LYS  28  15.617   4.160   0.382
  253    HA   LYS  28           HA       LYS  28  18.361   3.093   0.403
  254   1HB   LYS  28          1HB       LYS  28  17.171   5.885   0.277
  255   2HB   LYS  28          2HB       LYS  28  18.920   5.573   0.391
  256   1HG   LYS  28          1HG       LYS  28  18.578   4.006  -1.645
  257   2HG   LYS  28          2HG       LYS  28  17.003   4.812  -1.835
  258   1HD   LYS  28          1HD       LYS  28  18.512   6.049  -3.210
  259   2HD   LYS  28          2HD       LYS  28  18.306   7.030  -1.740
  260   1HE   LYS  28          1HE       LYS  28  20.379   5.750  -0.844
  261   2HE   LYS  28          2HE       LYS  28  20.645   5.277  -2.537
  262   1HZ   LYS  28          1HZ       LYS  28  20.199   7.924  -2.650
  263   2HZ   LYS  28          2HZ       LYS  28  21.088   7.767  -1.270
  264   3HZ   LYS  28          3HZ       LYS  28  21.675   7.190  -2.699
  265    H    VAL  29           H        VAL  29  16.806   2.335   2.649
  266    HA   VAL  29           HA       VAL  29  17.686   4.147   4.815
  267    HB   VAL  29           HB       VAL  29  16.306   2.563   6.223
  268   1HG1  VAL  29          1HG1      VAL  29  15.162   4.072   3.855
  269   2HG1  VAL  29          2HG1      VAL  29  14.100   3.271   5.037
  270   3HG1  VAL  29          3HG1      VAL  29  15.211   4.557   5.567
  271   1HG2  VAL  29          1HG2      VAL  29  15.607   0.607   5.349
  272   2HG2  VAL  29          2HG2      VAL  29  14.795   1.462   4.015
  273   3HG2  VAL  29          3HG2      VAL  29  16.503   0.987   3.858
  274    H    GLN  30           H        GLN  30  19.986   3.567   4.241
  275    HA   GLN  30           HA       GLN  30  20.782   1.250   5.890
  276   1HB   GLN  30          1HB       GLN  30  22.380   0.513   4.132
  277   2HB   GLN  30          2HB       GLN  30  20.685   0.356   3.612
  278   1HG   GLN  30          1HG       GLN  30  20.819   2.378   2.306
  279   2HG   GLN  30          2HG       GLN  30  22.407   2.784   2.991
  280   1HE2  GLN  30          1HE2      GLN  30  22.689   2.898   0.471
  281   2HE2  GLN  30          2HE2      GLN  30  23.300   1.436  -0.274
  282    H    ARG  31           H        ARG  31  23.357   1.277   5.938
  283    HA   ARG  31           HA       ARG  31  24.046   4.011   6.781
  284   1HB   ARG  31          1HB       ARG  31  26.078   2.855   7.699
  285   2HB   ARG  31          2HB       ARG  31  24.543   2.204   8.322
  286   1HG   ARG  31          1HG       ARG  31  25.484   0.921   5.825
  287   2HG   ARG  31          2HG       ARG  31  26.562   0.682   7.221
  288   1HD   ARG  31          1HD       ARG  31  23.909   0.374   8.189
  289   2HD   ARG  31          2HD       ARG  31  23.993  -0.537   6.667
  290    HE   ARG  31           HE       ARG  31  25.449  -2.049   7.660
  291   1HH1  ARG  31          2HH2      ARG  31  25.092   0.845   9.660
  292   2HH1  ARG  31          1HH2      ARG  31  25.941   0.168  11.032
  293   1HH2  ARG  31          2HH1      ARG  31  26.571  -2.943   9.472
  294   2HH2  ARG  31          1HH1      ARG  31  26.784  -1.991  10.924
  295    H    GLY  32           H        GLY  32  26.484   4.588   6.329
  296   1HA   GLY  32          1HA       GLY  32  27.803   3.682   4.018
  297   2HA   GLY  32          2HA       GLY  32  26.719   5.001   3.519