*HEADER    TOXIN                                   17-NOV-04   1WT8              
*TITLE     SOLUTION STRUCTURE OF BMP08 FROM THE VENOM OF SCORPION                
*TITLE    2 BUTHUS MARTENSII KARSCH, 20 STRUCTURES                               
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: NEUROTOXIN BMK X;                                          
*COMPND   3 CHAIN: A                                                             
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: MESOBUTHUS MARTENSII;                           
*SOURCE   3 ORGANISM_COMMON: CHINESE SCORPION;                                   
*SOURCE   4 SECRETION: VENOM                                                     
*KEYWDS    ALPHA/BETA SCAFFOLD                                                   
*EXPDTA    NMR, 20 STRUCTURES                                                    
*AUTHOR    H.WU, X.CHEN, X.TONG, Y.LI, N.ZHANG, G.WU                             
*REVDAT   1   19-APR-05 1WT8    0                                                

  2 PRO  
         HA      2 PRO  HD2     2.90  #     1  1604400.0  e   1121-D2O1204
         HA      3 TYR  HN      3.70  #     2   429200.0  e   1121-NOE1230
         QG      2 PRO  HD2     4.30  # m   1   738500.0*2e   1121-D2O1095
         QG      2 PRO  HD3     3.90  # m   1  1624700.0*2e   1121-D2O1098
  3 TYR  
         HN      3 TYR  HB2     4.40 >#     2   136500.0  e   1121-NOE 578
         HN      3 TYR  HB3     3.10 <#     2  1141000.0  e   1121-NOE 577
         HA      3 TYR  HB2     3.10  #     2  1160600.0  e   1121-D2O1062
         HA      3 TYR  HB3     3.10  #     2  1203300.0  e   1121-D2O1061
         HB2     3 TYR  QD      5.60  # r   1   493000.0*2e   1121-NOE 627
         HB2     5 VAL  QG1     4.30  #     5M  514080.0  e   1121-D2O1212
         HB3     3 TYR  QD      5.30  # r   1   864000.0*2e   1121-NOE 626
         HB3     5 VAL  QG1     4.30  #     5M  489020.0  e   1121-D2O1213
         QE      3 TYR  QD      7.20  # rr  1   998725.0*4e   1121-D2O1158
  4 PRO  
         QG      4 PRO  HD2     5.00  # m   1   240730.0*2e   1121-D2O1210
         QG      4 PRO  HD3     5.00  # m   1   248605.0*2e   1121-D2O1211
  5 VAL  
         HN      5 VAL  HA      3.90  #     2   267000.0  e   1121-NOE 451
         HN      5 VAL  HB      3.10  #     2  1280000.0  e   1121-NOE 449
         HN      5 VAL  QG1     3.50  #   s 1M 1177000.0  e   1121-NOE 450
         HN      6 ASN  HN      4.10  #     2   223500.0  e   1121-NOE 452
         HA      5 VAL  HB      3.00  #     2  1486100.0  e   1121-D2O1040
         HA      5 VAL  QG1     3.50  #   s 1M  987400.0  e   1121-NOE1041
         HA      6 ASN  HN      3.10  #     2  1167000.0  e   1121-NOE 456
         HB      5 VAL  QG1     3.50  #   s 1M 1199000.0  e   1121-NOE1043
         HB      6 ASN  HN      4.40  #     2   145600.0  e   1121-NOE1228
         HB     27 CYSS HN      3.50  #     5    80380.0  e   1121-NOE1229
         QG1     6 ASN  HN      3.60  #     5M 1587000.0  e   1121-NOE 455
         QG1    30 CYSS HB2     3.50  #   s 5M 2018800.0  e   1121-D2O1196
  6 ASN  
         HN      6 ASN  HA      3.50  #     2   600600.0  e   1121-NOE 333
         HN      6 ASN  HB2     3.70 >#     2   419700.0  e   1121-NOE 454
         HN      6 ASN  HB3     2.80 <#     2  2290000.0  e   1121-NOE 453
         HA      6 ASN  HB2     3.30  #     2   749700.0  e   1121-D2O1036
         HA      6 ASN  HB3     3.20  #     2  1033200.0  e   1121-D2O1037
         HB2     7 CYSS HN      3.30  #     2   760100.0  e   1121-NOE 458
         HB3     7 CYSS HN      3.20  #     2   892200.0  e   1121-NOE 459
  7 CYSS 
         HN      7 CYSS HB3     3.60  #     2   434300.0  e   1121-NOE 651
         HN     26 TYR  HA      3.60  #     4   275300.0  e   1121-NOE1183
         HA      7 CYSS HB2     3.00  #     2  1329300.0  e   1121-D2O1017
         HA      7 CYSS HB3     3.20  #     2   965300.0  e   1121-D2O1018
         HB2     8 LYS  HN      4.60  #     2   104200.0  e   1121-NOE 464
         HB2     9 THR  HN      3.10  #     3   460400.0  e   1121-NOE 469
         HB2    12 ASP  HN      3.70  #     5    55710.0  e   1121-NOE1205
         HB2    22 CYSS HB3     2.90  #     5   224560.0  e   1121-D2O1027
  8 LYS  
         HN      8 LYS  QB      3.50  # i   2  1612000.0*2e   1121-NOE 462
         HN      8 LYS  HG2     4.20  #     1   189200.0  e   1121-NOE 339
         HN      8 LYS  QE      4.50  # m   1   512500.0*2e   1121-NOE1179
         HN      9 THR  HN      2.60  #     2  3215000.0  e   1121-NOE 465
         HN     12 ASP  HB3     3.80  #     3   130500.0  e   1121-NOE 463
         HA      8 LYS  QB      4.00  # m   2  1303400.0*2e   1121-D2O1003
         HA      8 LYS  HG2     3.10  #     1  1243200.0  e   1121-D2O1005
         HA      8 LYS  HG3     2.80  #     1  2145500.0  e   1121-D2O1006
         HA      8 LYS  QD      4.80  # m   1   311850.0*2e   1121-D2O1002
         QB      8 LYS  HG2     3.80  # m   1  2110500.0*2e   1121-NOE1010
         QB      8 LYS  HG3     3.80  # m   1  2159000.0*2e   1121-NOE1011
         QB      8 LYS  QE      5.80  # mm  1   312375.0*4e   1121-D2O1109
         QB      9 THR  HN      4.30  # m   2   761500.0*2e   1121-NOE 467
         QB     11 ARG  QD      5.70  # mm  5    49800.0*4e   1121-NOE1112
         HG3     8 LYS  QD      3.60  # m   1  3142000.0*2e   1121-NOE1016
         QD      8 LYS  QE      5.80  # mm  1   359100.0*4e   1121-D2O1110
         QE      9 THR  HN      5.50  # m   5    16385.0*2e   1121-NOE 660
  9 THR  
         HN      9 THR  HB      3.70  #     2   371200.0  e   1121-NOE 802
         HN      9 THR  QG2     3.50  #   s 1M  555800.0  e   1121-NOE 461
         HN     12 ASP  HB3     3.00  #     3   600300.0  e   1121-NOE 468
         HB      9 THR  QG2     3.50  #   s 1M 1148000.0  e   1121-NOE 998
 10 ASP  
         HN     10 ASP  HA      3.60  #     2   468800.0  e   1121-NOE 474
         HN     10 ASP  HB2     3.20  #     2   937600.0  e   1121-NOE 472
         HN     10 ASP  HB3     3.50  #     2   532200.0  e   1121-NOE 473
         HN     11 ARG  HN      3.00  #     2  1412000.0  e   1121-NOE 475
         HA     10 ASP  HB2     3.30  #     2   740600.0  e   1121-D2O 966
         HA     10 ASP  HB3     3.00  #     2  1440000.0  e   1121-NOE 989
         HA     11 ARG  HN      3.90  #     2   266800.0  e   1121-NOE 485
         HA     12 ASP  HN      4.00  #     3   101300.0  e   1121-NOE1208
         HA     13 CYSS HN      3.30  #     3   318300.0  e   1121-NOE1177
         HB2    11 ARG  HN      4.30 >#     2   169700.0  e   1121-NOE 482
         HB3    11 ARG  HN      3.10 <#     2  1187000.0  e   1121-NOE 481
 11 ARG  
         HN     11 ARG  HA      3.00  #     2  1566000.0  e   1121-NOE 484
         HN     11 ARG  QB      3.50  # i   2  1754500.0*2e   1121-NOE 479
         HN     11 ARG  QG      4.40  # m   1   685500.0*2e   1121-NOE 480
         HN     11 ARG  QD      5.70  # m   1    94850.0*2e   1121-NOE 483
         HN     12 ASP  HN      2.90  #     2  1814000.0  e   1121-NOE 486
         HA     11 ARG  QB      3.40  # i   2  1955800.0*2e   1121-D2O 979
         HA     11 ARG  QG      3.70  # i   1  1082900.0*2e   1121-D2O 980
         HA     11 ARG  QD      4.90  # m   1   289240.0*2e   1121-D2O 977
         HA     12 ASP  HN      3.70  #     2   419000.0  e   1121-NOE 492
         HA     13 CYSS HN      3.50  #     3   212800.0  e   1121-NOE1210
         HA     14 VAL  HN      3.20  #     3   370800.0  e   1121-NOE 506
         HA     14 VAL  HB      3.20  #     3   430850.0  e   1121-D2O 953
         HA     14 VAL  QG1     3.50  #   s 5M 2413000.0  e   1121-NOE 955
         QB     11 ARG  QD      5.00  # mm  1  1377425.0*4e   1121-D2O 983
         QB     12 ASP  HN      4.20  # m   2  1015000.0*2e   1121-NOE 493
         QG     11 ARG  QD      4.60  # mm  1  3204250.0*4e   1121-D2O 984
         QG     12 ASP  HN      4.80  # m   5    44360.0*2e   1121-NOE 494
         QD     11 ARG  HE      4.50  # m   1   557000.0*2e   1121-NOE 619
 12 ASP  
         HN     12 ASP  HA      3.00  #     2  1545000.0  e   1121-NOE 688
         HN     12 ASP  HB3     2.50  #   s 2  6742000.0  e   1121-NOE 490
         HN     13 CYSS HN      2.50  #   s 2  5027000.0  e   1121-NOE 501
         HA     12 ASP  HB2     2.80  #     2  2086000.0  e   1121-D2O1126
         HA     14 VAL  HN      4.10  #     3    82530.0  e   1121-NOE1236
         HB3    13 CYSS HN      3.60  #     2   441700.0  e   1121-NOE 497
 13 CYSS 
         HN     13 CYSS HA      2.90  #     2  1824000.0  e   1121-NOE 873
         HN     13 CYSS HB2     4.00  #     2   262100.0  e   1121-NOE 498
         HN     13 CYSS HB3     3.60  #     2   464500.0  e   1121-NOE 496
         HN     14 VAL  HN      2.80  #     2  2227000.0  e   1121-NOE 500
         HA     13 CYSS HB2     3.00  #     2  1468600.0  e   1121-D2O 964
         HA     13 CYSS HB3     3.10  #     2  1271200.0  e   1121-D2O 965
         HA     14 VAL  HN      4.10  #     2   213300.0  e   1121-NOE1211
         HA     15 MET  HN      3.10  #     3   451800.0  e   1121-NOE1213
         HA     16 CYSS HN      3.20  #     3   369400.0  e   1121-NOE1181
         HB2    14 VAL  HN      3.30  #     2   770600.0  e   1121-NOE 807
         HB2    14 VAL  QG1     4.30  #     5M  491190.0  e   1121-D2O1202
         HB2    20 ILE  HB      3.50  #     5    79110.0  e   1121-NOE1217
         HB2    20 ILE  QG2     4.60  #     5M  347620.0  e   1121-D2O1191
         HB2    27 CYSS HB2     3.20  #     5   116550.0  e   1121-D2O 960
         HB3    20 ILE  HB      3.30  #     5    99890.0  e   1121-D2O1197
         HB3    20 ILE  QG2     4.20  #     5M  591220.0  e   1121-D2O1190
 14 VAL  
         HN     14 VAL  HA      2.90  #     2  1649000.0  e   1121-NOE 505
         HN     14 VAL  HB      2.60  #     2  3048000.0  e   1121-NOE 504
         HN     14 VAL  QG1     3.50  #   s 1M 1149000.0  e   1121-NOE 503
         HN     15 MET  HN      3.00  #     2  1559000.0  e   1121-NOE 514
         HA     14 VAL  HB      3.10  #     2  1214000.0  e   1121-NOE 947
         HA     14 VAL  QG1     3.50  #   s 1M 1081000.0  e   1121-NOE 948
         HA     15 MET  HN      4.40  #     2   145200.0  e   1121-NOE 512
         HA     16 CYSS HN      3.70  #     3   171300.0  e   1121-NOE1212
         HA     17 GLY  HN      4.60  #     3    44870.0  e   1121-NOE 534
         HA     20 ILE  QG2     5.90  #     5M   74620.0  e   1121-D2O1216
         HB     14 VAL  QG1     3.50  #   s 1M 1172000.0  e   1121-NOE 951
         HB     15 MET  HN      3.50  #     2   598200.0  e   1121-NOE 509
         QG1    15 MET  HN      3.70  #     5M 1239000.0  e   1121-NOE 513
 15 MET  
         HN     15 MET  HA      2.90  #     2  1593000.0  e   1121-NOE 719
         HN     15 MET  QB      3.60  # i   2  1409000.0*2e   1121-NOE 508
         HN     15 MET  HG2     4.90 >#     1    74520.0  e   1121-NOE 511
         HN     15 MET  HG3     3.30 <#     1   812900.0  e   1121-NOE 510
         HN     16 CYSS HN      2.70  #     2  2979000.0  e   1121-NOE 515
         HA     15 MET  QB      4.20  # m   2   912100.0*2e   1121-D2O 909
         HA     15 MET  HG2     3.80  #     1   351820.0  e   1121-D2O 908
         HA     15 MET  HG3     3.70  #     1   386820.0  e   1121-D2O 907
         HA     16 CYSS HN      3.60  #     2   499100.0  e   1121-NOE 725
         QB     15 MET  HG2     3.80  # m   1  1989400.0*2e   1121-D2O 911
         QB     15 MET  HG3     4.00  # m   1  1410150.0*2e   1121-D2O 910
         HG2    16 CYSS HN      2.90  #     5   220200.0  e   1121-NOE 520
         HG3    16 CYSS HN      3.30  #     5   113000.0  e   1121-NOE 519
 16 CYSS 
         HN     16 CYSS HB2     3.00 <#     2  1307000.0  e   1121-NOE 517
         HN     16 CYSS HB3     3.60 >#     2   500100.0  e   1121-NOE 518
         HN     17 GLY  HN      3.10  #     2  1182000.0  e   1121-NOE 522
         HA     16 CYSS HB2     3.20  #     2   937300.0  e   1121-D2O 877
         HA     16 CYSS HB3     2.90  #     2  1787100.0  e   1121-D2O 876
         HB2    17 GLY  HN      3.60  #     2   509800.0  e   1121-NOE 533
         HB2    20 ILE  HB      2.60  #     5   426160.0  e   1121-D2O1195
         HB2    20 ILE  QG2     4.00  #     5M  823900.0  e   1121-D2O1136
         HB2    20 ILE  HG12    3.80  #     5    47432.0  e   1121-D2O1184
         HB2    20 ILE  HG13    2.50  #   s 5   613550.0  e   1121-D2O1138
         HB2    20 ILE  QD1     5.00  #     5M  202930.0  e   1121-D2O1182
         HB2    30 CYSS HA      3.50 >#     5    70210.0  e   1121-D2O 875
         HB3    20 ILE  QG2     4.50  #     5M  409220.0  e   1121-D2O1137
         HB3    20 ILE  HG12    4.20  #     5    23191.0  e   1121-D2O1185
         HB3    20 ILE  HG13    2.50  #   s 5   692160.0  e   1121-D2O1139
         HB3    20 ILE  QD1     5.30  #     5M  152740.0  e   1121-D2O1183
         HB3    30 CYSS HN      4.20  #     5    24570.0  e   1121-NOE1231
         HB3    30 CYSS HA      2.60 <#     5   428890.0  e   1121-D2O 874
         HB3    30 CYSS HB2     3.00  #     5   173320.0  e   1121-D2O1034
 17 GLY  
         HN     17 GLY  HA1     3.40  #     2   645900.0  e   1121-NOE 737
         HN     17 GLY  HA2     3.30  #     2   796400.0  e   1121-NOE 532
         HN     18 LEU  HN      4.80  #     2    86800.0  e   1121-NOE 529
         HA1    18 LEU  HN      3.50 >#     2   552300.0  e   1121-NOE 740
         HA2    18 LEU  HN      3.00 <#     2  1462000.0  e   1121-NOE 526
 18 LEU  
         HN     18 LEU  HA      3.50  #     2   578400.0  e   1121-NOE 735
         HN     18 LEU  QB      4.00  # i   2   673500.0*2e   1121-NOE 477
         HN     18 LEU  HG      4.20  #     1   187400.0  e   1121-NOE 478
         HN     19 GLY  HN      3.70  #     2   425800.0  e   1121-NOE1214
         HA     18 LEU  QB      3.90  # m   2  1788150.0*2e   1121-D2O 895
         HA     18 LEU  HG      3.00  #     1  1453200.0  e   1121-D2O 896
         HA     18 LEU  QD2     3.50  #   s 1M  925400.0  e   1121-D2O 901
         HA     19 GLY  HN      3.60  #     2   503000.0  e   1121-NOE1190
         QB     18 LEU  QD1     4.50  # m s 1M  622000.0*2e   1121-NOE 903
         QB     18 LEU  QD2     4.60  # m   1M  338600.0*2e   1121-NOE1164
         HG     18 LEU  QD1     3.50  #   s 1M  778400.0  e   1121-D2O1104
         HG     19 GLY  HN      2.70  #     5   349300.0  e   1121-NOE 539
         QD2    19 GLY  HN      3.90  #     5M  871700.0  e   1121-NOE 540
 19 GLY  
         HN     19 GLY  HA1     3.10  #     2  1223000.0  e   1121-NOE 537
         HN     19 GLY  HA2     2.80  #     2  2229000.0  e   1121-NOE 536
         HN     20 ILE  HN      2.90  #     2  1927000.0  e   1121-NOE 541
         HA1    20 ILE  HN      4.00  #     2   249900.0  e   1121-NOE 552
         HA2    20 ILE  HN      3.80  #     2   325200.0  e   1121-NOE 551
 20 ILE  
         HN     20 ILE  HA      4.10  #     2   219400.0  e   1121-NOE 553
         HN     20 ILE  HB      3.90  #     2   297300.0  e   1121-NOE 550
         HN     20 ILE  QG2     4.70  #     1M   63760.0  e   1121-NOE 751
         HN     20 ILE  HG12    3.30 <#     1   814600.0  e   1121-NOE 546
         HN     20 ILE  HG13    4.20 >#     1   185500.0  e   1121-NOE 547
         HN     20 ILE  QD1     3.50  #   s 1M  532600.0  e   1121-NOE 549
         HN     21 SER  HN      4.80  #     2    81680.0  e   1121-NOE1216
         HA     20 ILE  HB      3.10  #     2  1285200.0  e   1121-D2O 917
         HA     20 ILE  QG2     3.50  #   s 1M 1350300.0  e   1121-D2O 920
         HA     20 ILE  HG12    3.70  #     1   412790.0  e   1121-D2O 918
         HA     20 ILE  HG13    4.10  #     1   224210.0  e   1121-D2O 919
         HA     20 ILE  QD1     3.50  #   s 1M  468800.0  e   1121-NOE 921
         HA     21 SER  HN      2.80  #     2  2340000.0  e   1121-NOE 558
         HB     20 ILE  QG2     3.50  #   s 1M 1378000.0  e   1121-NOE 929
         HB     20 ILE  HG12    2.70  #     1  2890000.0  e   1121-NOE 927
         HB     20 ILE  HG13    3.00  #     1  1296000.0  e   1121-NOE 928
         HB     20 ILE  QD1     3.80  #     1M  235600.0  e   1121-NOE 930
         QG2    20 ILE  HG12    3.80 >#     1M  241100.0  e   1121-NOE1156
         QG2    20 ILE  HG13    3.50 <#   s 1M 1140300.0  e   1121-D2O 941
         QG2    20 ILE  QD1     4.80  # m   1M  235000.0  e   1121-NOE1151
         QG2    21 SER  HN      4.70  #     5M  319800.0  e   1121-NOE 555
         QG2    27 CYSS HB2     5.00  #     5M  204960.0  e   1121-D2O1192
         QG2    30 CYSS HA      4.40  #     5M  465570.0  e   1121-D2O1194
         HG12   20 ILE  QD1     3.50  #   s 1M 1106000.0  e   1121-NOE1153
         HG13   20 ILE  QD1     3.50  #   s 1M 1146600.0  e   1121-D2O 943
         HG13   30 CYSS HA      2.70  #     5   334250.0  e   1121-D2O1209
         QD1    21 SER  HN      6.00  #   w 5M   53730.0  e   1121-NOE 559
         QD1    30 CYSS HA      4.90  #     5M  246610.0  e   1121-D2O1208
 21 SER  
         HN     21 SER  HA      3.10  #     2  1237000.0  e   1121-NOE 768
         HN     21 SER  HB2     3.40  #     2   630500.0  e   1121-NOE 557
         HN     21 SER  HB3     3.30  #     2   792100.0  e   1121-NOE 556
         HA     22 CYSS HN      4.40  #     2   144300.0  e   1121-NOE 565
         HB2    22 CYSS HN      4.00  #     2   241500.0  e   1121-NOE 779
         HB3    22 CYSS HN      4.00  #     2   259200.0  e   1121-NOE 778
 22 CYSS 
         HN     22 CYSS HB2     3.30  #     2   840800.0  e   1121-NOE 561
         HN     22 CYSS HB3     3.20  #     2  1001000.0  e   1121-NOE 571
         HA     22 CYSS HB2     3.00  #     2  1517600.0  e   1121-D2O1046
         HA     22 CYSS HB3     3.40  #     2   634200.0  e   1121-D2O1045
         HA     23 LYS  HN      3.70  #     2   416000.0  e   1121-NOE1234
         HB2    23 LYS  HN      5.00  #   w 2    38950.0  e   1121-NOE 570
 23 LYS  
         HN     23 LYS  QB      4.50  # i   2   294150.0*2e   1121-NOE 569
         HN     23 LYS  QD      5.20  # m   1   171750.0*2e   1121-NOE 568
         HN     23 LYS  QE      5.20  # m   1   172650.0*2e   1121-NOE 783
         HN     26 TYR  HN      3.30  #     3   330200.0  e   1121-NOE 567
         HN     26 TYR  HB3     4.90  #     3    30030.0  e   1121-NOE1237
         HN     28 GLN  QG      4.20  # m   5   125550.0*2e   1121-NOE1224
         HA     23 LYS  QB      3.70  # m   2  2612400.0*2e   1121-D2O1049
         HA     23 LYS  HG2     3.60  #     1   479150.0  e   1121-D2O1051
         HA     23 LYS  HG3     3.10  #     1  1115800.0  e   1121-D2O1052
         HA     23 LYS  QD      3.90  # m   1  1734950.0*2e   1121-D2O1050
         HA     24 ASN  HN      3.90  #     2   302300.0  e   1121-NOE1235
         QB     23 LYS  HG2     3.80  # m   1  2345350.0*2e   1121-D2O1057
         QB     23 LYS  HG3     3.80  # m   1  2283050.0*2e   1121-D2O1058
         QB     28 GLN  QG      5.30  # mm  5   105875.0*4e   1121-D2O1217
         HG2    23 LYS  QE      5.20  # m   1   175070.0*2e   1121-D2O1168
         HG3    23 LYS  QD      3.80  # m   1  2184700.0*2e   1121-D2O1059
         HG3    23 LYS  QE      4.80  # m   1   336735.0*2e   1121-D2O1167
         QD     28 GLN  QG      5.20  # mm  5   132895.0*4e   1121-D2O1218
 24 ASN  
         HN     24 ASN  HA      3.10  #     2  1207000.0  e   1121-NOE 580
         HN     24 ASN  HB3     5.00  #     2    62450.0  e   1121-NOE 581
         HN     25 GLY  HN      3.70  #     2   381800.0  e   1121-NOE 583
         HA     24 ASN  HB2     2.50 <#   s 2  3874500.0  e   1121-D2O1065
         HA     24 ASN  HB3     3.40 >#     2   702800.0  e   1121-D2O1066
         HA     25 GLY  HN      3.60  #     2   467800.0  e   1121-NOE 521
 25 GLY  
         HN     25 GLY  HA1     3.00  #     2  1445000.0  e   1121-NOE 573
         HN     25 GLY  HA2     2.70  #     2  2818000.0  e   1121-NOE 572
         HN     26 TYR  HN      2.80  #     2  1956000.0  e   1121-NOE1194
         HA2    26 TYR  HN      3.50  #     2   575100.0  e   1121-NOE1200
 26 TYR  
         HN     26 TYR  HA      3.70  #     2   402200.0  e   1121-NOE1184
         HN     26 TYR  HB2     3.70  #     2   427900.0  e   1121-NOE 820
         HN     26 TYR  HB3     3.40  #     2   664800.0  e   1121-NOE 602
         HN     26 TYR  QD      6.50  # r   1   118755.0*2e   1121-D2O1148
         HA     26 TYR  HB2     3.20  #     2  1005900.0  e   1121-D2O1089
         HA     26 TYR  HB3     2.80  #     2  1956500.0  e   1121-D2O1088
         HA     26 TYR  QD      5.30  # m   1   161900.0*2e   1121-NOE1198
         HA     27 CYSS HN      3.00  #     2  1571000.0  e   1121-NOE1172
         HB2    26 TYR  QD      4.90  # r   1  1906500.0*2e   1121-NOE 623
         HB3    26 TYR  QE      7.00  # r w 1    33725.0*2e   1121-NOE1199
         HB3    26 TYR  QD      5.00  # r   1  1509500.0*2e   1121-NOE 622
         QE     26 TYR  QD      6.80  # rr  1  1949500.0*4e   1121-D2O1150
 27 CYSS 
         HN     27 CYSS HA      3.70  #     2   418100.0  e   1121-NOE1226
         HN     27 CYSS HB2     3.40  #     2   704000.0  e   1121-NOE 560
         HN     27 CYSS HB3     3.70  #     2   382800.0  e   1121-NOE1196
         HA     27 CYSS HB2     3.20  #     2   914900.0  e   1121-D2O1206
         HA     27 CYSS HB3     3.20  #     2   913500.0  e   1121-D2O1205
         HA     28 GLN  HN      4.90  #     2    68760.0  e   1121-NOE1233
 28 GLN  
         HN     28 GLN  HA      4.40  #     2   130100.0  e   1121-NOE 596
         HN     28 GLN  HB2     3.80  #     2   316000.0  e   1121-NOE 594
         HN     28 GLN  HB3     4.10  #     2   217100.0  e   1121-NOE 595
         HN     28 GLN  QG      4.70  # m   1   372200.0*2e   1121-NOE 593
         HA     28 GLN  HB2     3.20  #     2   970200.0  e   1121-D2O1074
         HA     28 GLN  HB3     2.80  #     2  2156000.0  e   1121-D2O1073
         HA     28 GLN  QG      3.70  # i   1  1160600.0*2e   1121-D2O1075
         HB2    28 GLN  QG      3.70  # m   1  2820300.0*2e   1121-D2O1079
         HB3    28 GLN  QG      3.60  # m   1  3437700.0*2e   1121-D2O1080
         QG     28 GLN  HE21    4.20 <# m   1   879000.0*2e   1121-NOE 631
         QG     28 GLN  HE22    4.90 ># m   1   294900.0*2e   1121-NOE 628
 29 GLY  
         HN     29 GLY  HA1     3.10  #     2  1102000.0  e   1121-NOE 590
         HN     29 GLY  HA2     3.30  #     2   776600.0  e   1121-NOE 589
         HN     30 CYSS HN      3.10  #     2  1118000.0  e   1121-NOE 591
         HA1    30 CYSS HN      5.00 >#     2    67310.0  e   1121-NOE 812
         HA2    30 CYSS HN      3.40 <#     2   646100.0  e   1121-NOE1185
 30 CYSS 
         HN     30 CYSS HA      3.30  #     2   826100.0  e   1121-NOE 799
         HN     30 CYSS HB2     3.60  #     2   436500.0  e   1121-NOE 598
         HN     30 CYSS HB3     4.10  #     2   200000.0  e   1121-NOE 597
         HN     31 THR  HN      3.80  #     2   335600.0  e   1121-NOE1192
         HA     30 CYSS HB2     3.00  #     2  1385300.0  e   1121-D2O1083
         HA     30 CYSS HB3     3.00  #     2  1301300.0  e   1121-D2O1084
         HA     31 THR  HN      5.00  #   w 2    26990.0  e   1121-NOE1232
 31 THR  
         HN     31 THR  HA      3.20  #     2   947700.0  e   1121-NOE 792
         HN     31 THR  HB      3.50  #     2   557400.0  e   1121-NOE 791
         HN     31 THR  QG2     3.80  #     1M  229200.0  e   1121-NOE 811
         HA     31 THR  QG2     3.80  #     1M  233520.0  e   1121-D2O1166
         HB     31 THR  QG2     3.50  #   s 1M 1107400.0  e   1121-D2O1165

   9 THR  O       12 ASP  HN      2.20
   9 THR  O       12 ASP   N      3.20
  10 ASP  O       13 CYSS HN      2.20
  10 ASP  O       13 CYSS  N      3.20
  11 ARG  O       14 VAL  HN      2.20
  11 ARG  O       14 VAL   N      3.20
  13 CYSS O       16 CYSS HN      2.20 
  13 CYSS O       16 CYSS  N      3.20
  23 LYS  O       26 TYR  HN      2.20 
  23 LYS  O       26 TYR   N      3.20
  26 TYR  O       23 LYS  HN      2.20
  26 TYR  O       23 LYS   N      3.20
  25 GLY  O        7 CYSS HN      2.20
  25 GLY  O        7 CYSS  N      3.20

  5  VAL   PHI     -170   -70
  6  ASN   PHI     -90    -40
  8  LYS   PHI     -170   -70
 11  ARG   PHI     -90    -40
 12  ASP   PHI     -90    -40
 15  MET   PHI     -90    -40
 18  LEU   PHI     -90    -40
 24  ASN   PHI     -90    -40
 26  TYR   PHI     -170   -70
 30  CYSS  PHI     -90    -40

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H    THR   1           H        THR   1   8.178  -3.168 -12.468
    2    HA   THR   1           HA       THR   1   7.813  -4.429 -10.669
    3    HB   THR   1           HB       THR   1  10.811  -4.951 -10.696
    4    HG1  THR   1           HG1      THR   1  10.186  -6.672 -11.993
    5   1HG2  THR   1          1HG2      THR   1   8.495  -6.540  -9.511
    6   2HG2  THR   1          2HG2      THR   1  10.178  -7.088  -9.624
    7   3HG2  THR   1          3HG2      THR   1   9.767  -5.718  -8.584
    8    HA   PRO   2           HA       PRO   2  10.314  -2.684  -7.222
    9   1HB   PRO   2          HB1       PRO   2  12.156  -0.538  -8.064
   10   2HB   PRO   2          HB2       PRO   2  12.435  -1.878  -6.963
   11   1HG   PRO   2          HG1       PRO   2  13.327  -1.998  -9.530
   12   2HG   PRO   2          HG2       PRO   2  12.574  -3.482  -8.789
   13   1HD   PRO   2          HD1       PRO   2  11.207  -1.250 -10.328
   14   2HD   PRO   2          HD2       PRO   2  11.290  -2.819 -10.928
   15    H    TYR   3           H        TYR   3   7.789  -1.460  -8.054
   16    HA   TYR   3           HA       TYR   3   7.777   1.311  -7.691
   17   1HB   TYR   3          HB1       TYR   3   5.484  -0.589  -7.194
   18   2HB   TYR   3          HB2       TYR   3   5.544   1.040  -7.915
   19    HD1  TYR   3           HD1      TYR   3   5.133  -2.374  -8.679
   20    HD2  TYR   3           HD2      TYR   3   6.980   1.239 -10.145
   21    HE1  TYR   3           HE1      TYR   3   5.353  -3.391 -10.924
   22    HE2  TYR   3           HE2      TYR   3   7.208   0.212 -12.381
   23    HH   TYR   3           HH       TYR   3   6.838  -1.666 -13.673
   24    HA   PRO   4           HA       PRO   4   8.329   0.703  -3.216
   25   1HB   PRO   4          HB1       PRO   4   8.748   3.231  -2.408
   26   2HB   PRO   4          HB2       PRO   4   9.901   2.404  -3.513
   27   1HG   PRO   4          HG1       PRO   4   7.647   4.281  -4.290
   28   2HG   PRO   4          HG2       PRO   4   9.377   4.410  -4.752
   29   1HD   PRO   4          HD1       PRO   4   7.523   3.195  -6.366
   30   2HD   PRO   4          HD2       PRO   4   9.195   2.577  -6.229
   31    H    VAL   5           H        VAL   5   5.615   0.281  -3.985
   32    HA   VAL   5           HA       VAL   5   3.989   2.256  -2.901
   33    HB   VAL   5           HB       VAL   5   2.516  -0.084  -2.969
   34   1HG1  VAL   5          1HG1      VAL   5   2.119   2.228  -3.730
   35   2HG1  VAL   5          2HG1      VAL   5   3.136   1.845  -5.181
   36   3HG1  VAL   5          3HG1      VAL   5   1.554   1.019  -4.939
   37   1HG2  VAL   5          1HG2      VAL   5   4.311  -1.411  -4.014
   38   2HG2  VAL   5          2HG2      VAL   5   2.855  -1.251  -5.012
   39   3HG2  VAL   5          3HG2      VAL   5   4.280  -0.276  -5.390
   40    H    ASN   6           H        ASN   6   3.927   2.699  -0.963
   41    HA   ASN   6           HA       ASN   6   4.449   0.750   1.158
   42   1HB   ASN   6          HB1       ASN   6   5.310   3.475   0.266
   43   2HB   ASN   6          HB2       ASN   6   5.222   3.161   1.962
   44   1HD2  ASN   6          1HD2      ASN   6   7.678   3.785   1.470
   45   2HD2  ASN   6          2HD2      ASN   6   8.726   2.424   1.105
   46    H    CYS   7           H        CYS   7   4.002   1.808   3.185
   47    HA   CYS   7           HA       CYS   7   1.745   3.447   3.771
   48   1HB   CYS   7          HB1       CYS   7   0.147   1.616   4.388
   49   2HB   CYS   7          HB2       CYS   7   0.359   1.909   2.651
   50    H    LYS   8           H        LYS   8   1.493   3.749   5.897
   51    HA   LYS   8           HA       LYS   8   2.898   2.195   7.924
   52   1HB   LYS   8          HB1       LYS   8   0.714   4.302   8.038
   53   2HB   LYS   8          HB2       LYS   8   1.450   3.551   9.479
   54   1HG   LYS   8          HG1       LYS   8   3.649   4.318   8.830
   55   2HG   LYS   8          HG2       LYS   8   3.066   4.953   7.304
   56   1HD   LYS   8          HD1       LYS   8   2.323   5.923  10.108
   57   2HD   LYS   8          HD2       LYS   8   3.467   6.727   9.021
   58   1HE   LYS   8          HE1       LYS   8   0.466   6.390   8.609
   59   2HE   LYS   8          HE2       LYS   8   1.295   7.894   9.046
   60   1HZ   LYS   8          HZ1       LYS   8   0.658   7.515   6.639
   61   2HZ   LYS   8          HZ2       LYS   8   2.249   7.981   6.870
   62   3HZ   LYS   8          HZ3       LYS   8   1.777   6.427   6.526
   63    H    THR   9           H        THR   9  -0.419   2.205   6.508
   64    HA   THR   9           HA       THR   9  -0.912  -0.484   7.243
   65    HB   THR   9           HB       THR   9  -1.239   0.465   9.514
   66    HG1  THR   9           HG1      THR   9  -2.497  -1.241   9.139
   67   1HG2  THR   9          1HG2      THR   9  -3.086   1.974   9.996
   68   2HG2  THR   9          2HG2      THR   9  -1.948   2.765   8.890
   69   3HG2  THR   9          3HG2      THR   9  -3.484   2.112   8.277
   70    H    ASP  10           H        ASP  10  -3.668  -0.509   7.102
   71    HA   ASP  10           HA       ASP  10  -4.145  -0.278   4.261
   72   1HB   ASP  10          HB1       ASP  10  -5.323  -1.897   5.768
   73   2HB   ASP  10          HB2       ASP  10  -6.028  -0.517   6.657
   74    H    ARG  11           H        ARG  11  -5.295   1.849   6.883
   75    HA   ARG  11           HA       ARG  11  -6.535   3.697   5.194
   76   1HB   ARG  11          HB1       ARG  11  -6.567   3.913   7.677
   77   2HB   ARG  11          HB2       ARG  11  -4.811   4.081   7.742
   78   1HG   ARG  11          HG1       ARG  11  -6.376   6.056   6.117
   79   2HG   ARG  11          HG2       ARG  11  -6.440   6.159   7.897
   80   1HD   ARG  11          HD1       ARG  11  -4.176   6.724   8.075
   81   2HD   ARG  11          HD2       ARG  11  -3.744   6.085   6.499
   82    HE   ARG  11           HE       ARG  11  -5.610   8.368   6.692
   83   1HH1  ARG  11          2HH2      ARG  11  -2.175   7.449   5.734
   84   2HH1  ARG  11          1HH2      ARG  11  -2.156   8.690   4.572
   85   1HH2  ARG  11          1HH1      ARG  11  -5.372   9.999   5.160
   86   2HH2  ARG  11          2HH1      ARG  11  -3.878  10.212   4.311
   87    H    ASP  12           H        ASP  12  -3.033   3.137   5.533
   88    HA   ASP  12           HA       ASP  12  -2.572   5.774   4.479
   89   1HB   ASP  12          HB1       ASP  12  -1.354   4.125   6.211
   90   2HB   ASP  12          HB2       ASP  12  -0.569   3.566   4.763
   91    H    CYS  13           H        CYS  13  -3.624   2.960   3.067
   92    HA   CYS  13           HA       CYS  13  -2.931   4.078   0.360
   93   1HB   CYS  13          HB1       CYS  13  -2.208   1.545   1.580
   94   2HB   CYS  13          HB2       CYS  13  -3.194   1.236   0.140
   95    H    VAL  14           H        VAL  14  -5.329   3.490   2.338
   96    HA   VAL  14           HA       VAL  14  -7.391   2.555   0.856
   97    HB   VAL  14           HB       VAL  14  -7.422   3.832   2.975
   98   1HG1  VAL  14          1HG1      VAL  14  -5.750   5.428   1.972
   99   2HG1  VAL  14          2HG1      VAL  14  -7.171   6.364   1.428
  100   3HG1  VAL  14          3HG1      VAL  14  -6.939   6.048   3.163
  101   1HG2  VAL  14          1HG2      VAL  14  -9.670   3.707   2.059
  102   2HG2  VAL  14          2HG2      VAL  14  -9.431   5.325   2.725
  103   3HG2  VAL  14          3HG2      VAL  14  -9.358   5.078   0.969
  104    H    MET  15           H        MET  15  -5.748   5.454   0.131
  105    HA   MET  15           HA       MET  15  -7.325   6.561  -1.926
  106   1HB   MET  15          HB1       MET  15  -5.327   7.828  -2.551
  107   2HB   MET  15          HB2       MET  15  -5.565   7.799  -0.791
  108   1HG   MET  15          HG1       MET  15  -3.882   6.003  -0.603
  109   2HG   MET  15          HG2       MET  15  -3.643   6.045  -2.357
  110   1HE   MET  15          HE1       MET  15  -1.052   6.210  -2.003
  111   2HE   MET  15          HE2       MET  15  -0.270   7.444  -0.986
  112   3HE   MET  15          HE3       MET  15  -1.284   6.190  -0.237
  113    H    CYS  16           H        CYS  16  -5.205   3.853  -2.010
  114    HA   CYS  16           HA       CYS  16  -4.779   3.789  -4.898
  115   1HB   CYS  16          HB1       CYS  16  -4.222   1.917  -2.626
  116   2HB   CYS  16          HB2       CYS  16  -4.116   1.356  -4.340
  117    H    GLY  17           H        GLY  17  -7.518   2.922  -2.892
  118   1HA   GLY  17          HA1       GLY  17  -9.097   2.455  -5.044
  119   2HA   GLY  17          HA2       GLY  17  -8.600   0.965  -4.597
  120    H    LEU  18           H        LEU  18  -9.241   0.014  -2.616
  121    HA   LEU  18           HA       LEU  18 -11.732   1.138  -1.453
  122   1HB   LEU  18          HB1       LEU  18 -11.933  -0.864  -2.458
  123   2HB   LEU  18          HB2       LEU  18 -10.683  -1.589  -1.460
  124    HG   LEU  18           HG       LEU  18 -11.936  -1.315   0.483
  125   1HD1  LEU  18          1HD1      LEU  18 -12.754   0.993   0.547
  126   2HD1  LEU  18          2HD1      LEU  18 -13.861   0.661  -0.810
  127   3HD1  LEU  18          3HD1      LEU  18 -14.097  -0.118   0.762
  128   1HD2  LEU  18          1HD2      LEU  18 -12.771  -2.857  -1.242
  129   2HD2  LEU  18          2HD2      LEU  18 -14.138  -2.305  -0.212
  130   3HD2  LEU  18          3HD2      LEU  18 -13.833  -1.511  -1.802
  131    H    GLY  19           H        GLY  19  -9.970  -1.160   0.315
  132   1HA   GLY  19          HA1       GLY  19  -8.859   0.701   2.222
  133   2HA   GLY  19          HA2       GLY  19  -8.994  -0.915   2.418
  134    H    ILE  20           H        ILE  20  -7.882  -1.821   0.019
  135    HA   ILE  20           HA       ILE  20  -5.899  -2.650  -0.608
  136    HB   ILE  20           HB       ILE  20  -4.990   0.258  -0.568
  137   1HG1  ILE  20          1HG1      ILE  20  -6.935   0.330  -1.847
  138   2HG1  ILE  20          2HG1      ILE  20  -5.609   0.082  -3.022
  139   1HG2  ILE  20          1HG2      ILE  20  -4.056  -2.092  -2.197
  140   2HG2  ILE  20          2HG2      ILE  20  -3.490  -0.393  -2.260
  141   3HG2  ILE  20          3HG2      ILE  20  -3.193  -1.370  -0.826
  142   1HD1  ILE  20          1HD1      ILE  20  -6.140  -2.331  -3.085
  143   2HD1  ILE  20          2HD1      ILE  20  -7.585  -1.999  -2.100
  144   3HD1  ILE  20          3HD1      ILE  20  -7.420  -1.271  -3.704
  145    H    SER  21           H        SER  21  -6.196  -3.571   1.584
  146    HA   SER  21           HA       SER  21  -4.848  -2.790   3.781
  147   1HB   SER  21          HB1       SER  21  -5.398  -5.666   2.974
  148   2HB   SER  21          HB2       SER  21  -5.507  -4.923   4.587
  149    HG   SER  21           HG       SER  21  -7.146  -3.500   3.615
  150    H    CYS  22           H        CYS  22  -3.012  -3.500   4.879
  151    HA   CYS  22           HA       CYS  22  -0.837  -3.368   2.875
  152   1HB   CYS  22          HB1       CYS  22  -2.264  -1.469   4.471
  153   2HB   CYS  22          HB2       CYS  22  -0.586  -1.389   5.006
  154    H    LYS  23           H        LYS  23   1.160  -4.087   3.365
  155    HA   LYS  23           HA       LYS  23   1.441  -5.781   5.743
  156   1HB   LYS  23          HB1       LYS  23   2.282  -6.320   3.408
  157   2HB   LYS  23          HB2       LYS  23   3.520  -5.089   3.632
  158   1HG   LYS  23          HG1       LYS  23   4.689  -6.400   5.170
  159   2HG   LYS  23          HG2       LYS  23   3.200  -7.191   5.784
  160   1HD   LYS  23          HD1       LYS  23   4.458  -8.843   4.608
  161   2HD   LYS  23          HD2       LYS  23   2.978  -8.443   3.709
  162   1HE   LYS  23          HE1       LYS  23   4.444  -6.875   2.297
  163   2HE   LYS  23          HE2       LYS  23   5.856  -7.560   3.120
  164   1HZ   LYS  23          HZ1       LYS  23   3.894  -8.994   1.452
  165   2HZ   LYS  23          HZ2       LYS  23   5.450  -8.670   1.049
  166   3HZ   LYS  23          HZ3       LYS  23   5.130  -9.742   2.258
  167    H    ASN  24           H        ASN  24   3.508  -5.341   7.035
  168    HA   ASN  24           HA       ASN  24   3.391  -2.757   8.255
  169   1HB   ASN  24          HB1       ASN  24   5.308  -3.630   9.618
  170   2HB   ASN  24          HB2       ASN  24   3.810  -4.582   9.674
  171   1HD2  ASN  24          1HD2      ASN  24   3.763  -6.703   8.751
  172   2HD2  ASN  24          2HD2      ASN  24   5.258  -7.503   8.295
  173    H    GLY  25           H        GLY  25   3.768  -1.686   6.130
  174   1HA   GLY  25          HA1       GLY  25   5.588   0.016   5.833
  175   2HA   GLY  25          HA2       GLY  25   6.486  -1.278   5.400
  176    H    TYR  26           H        TYR  26   4.058  -2.611   4.124
  177    HA   TYR  26           HA       TYR  26   4.769  -1.313   1.536
  178   1HB   TYR  26          HB1       TYR  26   5.980  -3.487   2.502
  179   2HB   TYR  26          HB2       TYR  26   4.682  -4.204   1.540
  180    HD1  TYR  26           HD1      TYR  26   7.774  -2.218   1.473
  181    HD2  TYR  26           HD2      TYR  26   4.490  -3.639  -0.928
  182    HE1  TYR  26           HE1      TYR  26   8.990  -1.572  -0.584
  183    HE2  TYR  26           HE2      TYR  26   5.726  -3.020  -2.983
  184    HH   TYR  26           HH       TYR  26   7.548  -1.687  -3.802
  185    H    CYS  27           H        CYS  27   3.158  -0.847   0.261
  186    HA   CYS  27           HA       CYS  27   0.441  -1.956   0.710
  187   1HB   CYS  27          HB1       CYS  27   0.628   0.397   0.768
  188   2HB   CYS  27          HB2       CYS  27   1.517   0.489  -0.744
  189    H    GLN  28           H        GLN  28   1.692  -3.902   0.032
  190    HA   GLN  28           HA       GLN  28   2.082  -4.409  -2.788
  191   1HB   GLN  28          HB1       GLN  28   2.216  -6.785  -2.029
  192   2HB   GLN  28          HB2       GLN  28   3.357  -5.680  -1.234
  193   1HG   GLN  28          HG1       GLN  28   2.460  -6.032   0.803
  194   2HG   GLN  28          HG2       GLN  28   0.787  -5.927   0.214
  195   1HE2  GLN  28          1HE2      GLN  28   0.064  -7.806  -1.170
  196   2HE2  GLN  28          2HE2      GLN  28   0.472  -9.415  -0.570
  197    H    GLY  29           H        GLY  29  -0.109  -3.344  -3.232
  198   1HA   GLY  29          HA1       GLY  29  -1.978  -5.365  -3.966
  199   2HA   GLY  29          HA2       GLY  29  -2.554  -4.370  -2.806
  200    H    CYS  30           H        CYS  30  -1.710  -1.965  -3.370
  201    HA   CYS  30           HA       CYS  30  -3.407  -0.590  -4.576
  202   1HB   CYS  30          HB1       CYS  30  -1.249   0.275  -3.793
  203   2HB   CYS  30          HB2       CYS  30  -0.478  -0.223  -5.304
  204    H    THR  31           H        THR  31  -0.896  -1.920  -6.728
  205    HA   THR  31           HA       THR  31  -1.770  -1.511  -9.315
  206    HB   THR  31           HB       THR  31  -0.940  -4.057  -9.388
  207    HG1  THR  31           HG1      THR  31  -1.304  -4.121  -6.983
  208   1HG2  THR  31          1HG2      THR  31   0.454  -2.134 -10.075
  209   2HG2  THR  31          2HG2      THR  31   0.848  -1.795  -8.375
  210   3HG2  THR  31          3HG2      THR  31   1.399  -3.302  -9.131
  Start of MODEL    2
    1   1H    THR   1           H        THR   1  12.005   3.251  -6.624
    2    HA   THR   1           HA       THR   1  11.483   2.987  -8.842
    3    HB   THR   1           HB       THR   1  13.552   0.765  -9.069
    4    HG1  THR   1           HG1      THR   1  14.295   2.894  -8.382
    5   1HG2  THR   1          1HG2      THR   1  11.895   0.810 -10.913
    6   2HG2  THR   1          2HG2      THR   1  12.210   2.544 -11.148
    7   3HG2  THR   1          3HG2      THR   1  13.492   1.356 -11.455
    8    HA   PRO   2           HA       PRO   2   9.907  -1.414  -8.324
    9   1HB   PRO   2          HB1       PRO   2  10.760  -2.506  -5.720
   10   2HB   PRO   2          HB2       PRO   2  10.673  -3.298  -7.289
   11   1HG   PRO   2          HG1       PRO   2  13.061  -2.433  -6.303
   12   2HG   PRO   2          HG2       PRO   2  12.692  -2.207  -8.074
   13   1HD   PRO   2          HD1       PRO   2  12.110  -0.304  -5.778
   14   2HD   PRO   2          HD2       PRO   2  13.208   0.070  -7.002
   15    H    TYR   3           H        TYR   3   8.339   0.492  -7.983
   16    HA   TYR   3           HA       TYR   3   6.971   1.792  -6.693
   17   1HB   TYR   3          HB1       TYR   3   5.005  -0.298  -6.722
   18   2HB   TYR   3          HB2       TYR   3   5.202   1.195  -7.678
   19    HD1  TYR   3           HD1      TYR   3   6.321   1.160  -9.871
   20    HD2  TYR   3           HD2      TYR   3   5.907  -2.438  -7.534
   21    HE1  TYR   3           HE1      TYR   3   7.131  -0.183 -11.790
   22    HE2  TYR   3           HE2      TYR   3   6.710  -3.778  -9.454
   23    HH   TYR   3           HH       TYR   3   7.484  -3.736 -11.629
   24    HA   PRO   4           HA       PRO   4   7.185   0.266  -2.350
   25   1HB   PRO   4          HB1       PRO   4   8.217   2.476  -1.196
   26   2HB   PRO   4          HB2       PRO   4   9.255   1.281  -2.048
   27   1HG   PRO   4          HG1       PRO   4   8.141   3.873  -3.151
   28   2HG   PRO   4          HG2       PRO   4   9.842   3.309  -3.196
   29   1HD   PRO   4          HD1       PRO   4   8.114   2.947  -5.300
   30   2HD   PRO   4          HD2       PRO   4   9.341   1.714  -4.877
   31    H    VAL   5           H        VAL   5   4.784   0.445  -3.315
   32    HA   VAL   5           HA       VAL   5   3.494   2.831  -2.744
   33    HB   VAL   5           HB       VAL   5   1.590   0.779  -2.638
   34   1HG1  VAL   5          1HG1      VAL   5   1.053   1.734  -4.814
   35   2HG1  VAL   5          2HG1      VAL   5   1.719   2.997  -3.704
   36   3HG1  VAL   5          3HG1      VAL   5   2.774   2.261  -4.977
   37   1HG2  VAL   5          1HG2      VAL   5   1.893  -0.719  -4.433
   38   2HG2  VAL   5          2HG2      VAL   5   3.474  -0.052  -4.839
   39   3HG2  VAL   5          3HG2      VAL   5   3.242  -0.957  -3.312
   40    H    ASN   6           H        ASN   6   3.611   3.581  -0.928
   41    HA   ASN   6           HA       ASN   6   4.465   1.763   1.173
   42   1HB   ASN   6          HB1       ASN   6   5.687   3.830   0.705
   43   2HB   ASN   6          HB2       ASN   6   4.356   4.753   1.404
   44   1HD2  ASN   6          1HD2      ASN   6   4.072   4.787   3.735
   45   2HD2  ASN   6          2HD2      ASN   6   5.374   4.207   4.763
   46    H    CYS   7           H        CYS   7   4.015   1.991   3.286
   47    HA   CYS   7           HA       CYS   7   1.371   2.991   4.120
   48   1HB   CYS   7          HB1       CYS   7   0.438   0.950   4.956
   49   2HB   CYS   7          HB2       CYS   7   0.949   0.821   3.206
   50    H    LYS   8           H        LYS   8   1.611   4.091   5.887
   51    HA   LYS   8           HA       LYS   8   3.048   3.069   8.235
   52   1HB   LYS   8          HB1       LYS   8   0.848   5.128   7.847
   53   2HB   LYS   8          HB2       LYS   8   1.553   4.704   9.431
   54   1HG   LYS   8          HG1       LYS   8   3.769   5.323   8.671
   55   2HG   LYS   8          HG2       LYS   8   3.207   5.630   7.038
   56   1HD   LYS   8          HD1       LYS   8   2.437   7.156   9.573
   57   2HD   LYS   8          HD2       LYS   8   3.595   7.717   8.354
   58   1HE   LYS   8          HE1       LYS   8   0.596   7.308   7.997
   59   2HE   LYS   8          HE2       LYS   8   1.431   8.867   8.103
   60   1HZ   LYS   8          HZ1       LYS   8   1.906   6.881   5.962
   61   2HZ   LYS   8          HZ2       LYS   8   0.804   7.983   5.837
   62   3HZ   LYS   8          HZ3       LYS   8   2.403   8.469   5.964
   63    H    THR   9           H        THR   9  -0.101   2.554   6.628
   64    HA   THR   9           HA       THR   9  -0.638   0.132   7.962
   65    HB   THR   9           HB       THR   9  -1.216   1.479   9.921
   66    HG1  THR   9           HG1      THR   9  -2.608  -0.166   9.678
   67   1HG2  THR   9          1HG2      THR   9  -1.584   3.672   8.941
   68   2HG2  THR   9          2HG2      THR   9  -2.981   3.076   8.024
   69   3HG2  THR   9          3HG2      THR   9  -3.048   3.167   9.797
   70    H    ASP  10           H        ASP  10  -3.209  -0.310   7.392
   71    HA   ASP  10           HA       ASP  10  -3.475  -0.282   4.525
   72   1HB   ASP  10          HB1       ASP  10  -5.435  -0.510   6.917
   73   2HB   ASP  10          HB2       ASP  10  -5.955  -0.761   5.244
   74    H    ARG  11           H        ARG  11  -4.984   1.724   6.951
   75    HA   ARG  11           HA       ARG  11  -6.412   3.380   5.192
   76   1HB   ARG  11          HB1       ARG  11  -6.842   3.628   7.484
   77   2HB   ARG  11          HB2       ARG  11  -5.157   3.667   7.956
   78   1HG   ARG  11          HG1       ARG  11  -6.203   5.952   6.312
   79   2HG   ARG  11          HG2       ARG  11  -6.735   5.733   8.033
   80   1HD   ARG  11          HD1       ARG  11  -4.991   7.120   8.389
   81   2HD   ARG  11          HD2       ARG  11  -4.139   5.576   8.494
   82    HE   ARG  11           HE       ARG  11  -2.904   6.142   6.646
   83   1HH1  ARG  11          2HH2      ARG  11  -5.784   8.133   6.634
   84   2HH1  ARG  11          1HH2      ARG  11  -5.157   9.358   5.570
   85   1HH2  ARG  11          1HH1      ARG  11  -1.966   7.757   5.267
   86   2HH2  ARG  11          2HH1      ARG  11  -2.941   9.088   4.721
   87    H    ASP  12           H        ASP  12  -2.838   3.177   5.549
   88    HA   ASP  12           HA       ASP  12  -2.622   5.894   4.574
   89   1HB   ASP  12          HB1       ASP  12  -1.140   4.441   6.193
   90   2HB   ASP  12          HB2       ASP  12  -0.513   3.768   4.695
   91    H    CYS  13           H        CYS  13  -3.461   2.969   3.131
   92    HA   CYS  13           HA       CYS  13  -2.744   4.028   0.415
   93   1HB   CYS  13          HB1       CYS  13  -3.281   1.265   1.459
   94   2HB   CYS  13          HB2       CYS  13  -2.561   1.563  -0.073
   95    H    VAL  14           H        VAL  14  -5.326   3.605   2.420
   96    HA   VAL  14           HA       VAL  14  -7.328   2.481   0.853
   97    HB   VAL  14           HB       VAL  14  -7.464   3.575   3.015
   98   1HG1  VAL  14          1HG1      VAL  14  -7.426   6.211   1.638
   99   2HG1  VAL  14          2HG1      VAL  14  -7.220   5.815   3.374
  100   3HG1  VAL  14          3HG1      VAL  14  -5.960   5.374   2.193
  101   1HG2  VAL  14          1HG2      VAL  14  -9.438   4.830   1.037
  102   2HG2  VAL  14          2HG2      VAL  14  -9.632   3.257   1.839
  103   3HG2  VAL  14          3HG2      VAL  14  -9.654   4.748   2.798
  104    H    MET  15           H        MET  15  -5.629   5.379   0.354
  105    HA   MET  15           HA       MET  15  -7.152   6.671  -1.662
  106   1HB   MET  15          HB1       MET  15  -5.141   7.964  -2.135
  107   2HB   MET  15          HB2       MET  15  -5.419   7.809  -0.388
  108   1HG   MET  15          HG1       MET  15  -3.771   5.967  -0.315
  109   2HG   MET  15          HG2       MET  15  -3.462   6.170  -2.036
  110   1HE   MET  15          HE1       MET  15  -1.649   9.652  -2.158
  111   2HE   MET  15          HE2       MET  15  -2.299   8.295  -3.107
  112   3HE   MET  15          HE3       MET  15  -3.403   9.439  -2.299
  113    H    CYS  16           H        CYS  16  -5.085   3.916  -1.878
  114    HA   CYS  16           HA       CYS  16  -4.530   4.000  -4.726
  115   1HB   CYS  16          HB1       CYS  16  -4.449   1.880  -2.603
  116   2HB   CYS  16          HB2       CYS  16  -4.184   1.454  -4.321
  117    H    GLY  17           H        GLY  17  -7.419   3.139  -2.868
  118   1HA   GLY  17          HA1       GLY  17  -9.041   3.210  -4.997
  119   2HA   GLY  17          HA2       GLY  17  -8.635   1.630  -4.931
  120    H    LEU  18           H        LEU  18  -9.138   0.340  -3.073
  121    HA   LEU  18           HA       LEU  18 -11.567   1.284  -1.599
  122   1HB   LEU  18          HB1       LEU  18 -12.064  -0.168  -3.233
  123   2HB   LEU  18          HB2       LEU  18 -10.930  -1.369  -2.634
  124    HG   LEU  18           HG       LEU  18 -12.112  -1.645  -0.649
  125   1HD1  LEU  18          1HD1      LEU  18 -12.608   0.576   0.268
  126   2HD1  LEU  18          2HD1      LEU  18 -13.749   0.895  -1.064
  127   3HD1  LEU  18          3HD1      LEU  18 -14.093  -0.353   0.144
  128   1HD2  LEU  18          1HD2      LEU  18 -13.163  -2.349  -2.759
  129   2HD2  LEU  18          2HD2      LEU  18 -14.437  -2.027  -1.530
  130   3HD2  LEU  18          3HD2      LEU  18 -14.027  -0.764  -2.752
  131    H    GLY  19           H        GLY  19 -10.133  -1.717  -0.877
  132   1HA   GLY  19          HA1       GLY  19  -9.315  -0.992   1.730
  133   2HA   GLY  19          HA2       GLY  19  -9.180  -2.474   1.057
  134    H    ILE  20           H        ILE  20  -7.458  -2.781  -0.619
  135    HA   ILE  20           HA       ILE  20  -5.249  -3.015  -0.950
  136    HB   ILE  20           HB       ILE  20  -5.351   0.029  -0.947
  137   1HG1  ILE  20          1HG1      ILE  20  -7.050  -0.584  -2.414
  138   2HG1  ILE  20          2HG1      ILE  20  -5.632  -0.254  -3.440
  139   1HG2  ILE  20          1HG2      ILE  20  -3.534  -0.324  -2.723
  140   2HG2  ILE  20          2HG2      ILE  20  -3.094  -0.554  -1.040
  141   3HG2  ILE  20          3HG2      ILE  20  -3.388  -1.967  -2.080
  142   1HD1  ILE  20          1HD1      ILE  20  -6.637  -2.209  -4.318
  143   2HD1  ILE  20          2HD1      ILE  20  -5.190  -2.747  -3.437
  144   3HD1  ILE  20          3HD1      ILE  20  -6.800  -2.954  -2.717
  145    H    SER  21           H        SER  21  -5.014  -4.070   1.159
  146    HA   SER  21           HA       SER  21  -4.427  -2.471   3.450
  147   1HB   SER  21          HB1       SER  21  -4.271  -4.919   4.374
  148   2HB   SER  21          HB2       SER  21  -5.839  -4.311   3.755
  149    HG   SER  21           HG       SER  21  -5.301  -6.385   2.925
  150    H    CYS  22           H        CYS  22  -2.654  -3.013   4.949
  151    HA   CYS  22           HA       CYS  22  -0.090  -2.709   3.518
  152   1HB   CYS  22          HB1       CYS  22  -0.679  -0.846   4.669
  153   2HB   CYS  22          HB2       CYS  22  -1.157  -1.637   6.142
  154    H    LYS  23           H        LYS  23   1.447  -4.192   3.566
  155    HA   LYS  23           HA       LYS  23   1.856  -5.967   5.935
  156   1HB   LYS  23          HB1       LYS  23   3.167  -5.883   3.233
  157   2HB   LYS  23          HB2       LYS  23   3.566  -6.946   4.613
  158   1HG   LYS  23          HG1       LYS  23   1.074  -7.623   4.617
  159   2HG   LYS  23          HG2       LYS  23   0.939  -6.763   3.065
  160   1HD   LYS  23          HD1       LYS  23   2.842  -8.188   2.196
  161   2HD   LYS  23          HD2       LYS  23   2.833  -9.008   3.786
  162   1HE   LYS  23          HE1       LYS  23   0.829 -10.131   3.292
  163   2HE   LYS  23          HE2       LYS  23   0.240  -8.789   2.274
  164   1HZ   LYS  23          HZ1       LYS  23   0.752 -10.754   0.992
  165   2HZ   LYS  23          HZ2       LYS  23   1.686  -9.472   0.559
  166   3HZ   LYS  23          HZ3       LYS  23   2.331 -10.699   1.464
  167    H    ASN  24           H        ASN  24   3.560  -5.218   7.253
  168    HA   ASN  24           HA       ASN  24   4.224  -2.778   7.834
  169   1HB   ASN  24          HB1       ASN  24   6.092  -4.988   8.126
  170   2HB   ASN  24          HB2       ASN  24   6.141  -3.485   9.013
  171   1HD2  ASN  24          1HD2      ASN  24   5.159  -3.643  11.049
  172   2HD2  ASN  24          2HD2      ASN  24   3.871  -4.773  11.425
  173    H    GLY  25           H        GLY  25   4.338  -1.971   5.440
  174   1HA   GLY  25          HA1       GLY  25   6.473  -0.405   4.915
  175   2HA   GLY  25          HA2       GLY  25   6.838  -1.847   4.240
  176    H    TYR  26           H        TYR  26   4.492  -2.791   3.144
  177    HA   TYR  26           HA       TYR  26   4.098  -0.817   0.962
  178   1HB   TYR  26          HB1       TYR  26   5.061  -3.664   1.076
  179   2HB   TYR  26          HB2       TYR  26   3.950  -3.241  -0.236
  180    HD1  TYR  26           HD1      TYR  26   7.152  -1.913   1.289
  181    HD2  TYR  26           HD2      TYR  26   4.919  -2.858  -2.280
  182    HE1  TYR  26           HE1      TYR  26   9.176  -1.530  -0.095
  183    HE2  TYR  26           HE2      TYR  26   6.955  -2.565  -3.634
  184    HH   TYR  26           HH       TYR  26   9.084  -1.684  -3.661
  185    H    CYS  27           H        CYS  27   1.873  -0.711   0.290
  186    HA   CYS  27           HA       CYS  27   0.065  -2.728   1.447
  187   1HB   CYS  27          HB1       CYS  27  -0.623  -0.269  -0.116
  188   2HB   CYS  27          HB2       CYS  27  -1.766  -1.589   0.356
  189    H    GLN  28           H        GLN  28  -1.578  -3.694   0.052
  190    HA   GLN  28           HA       GLN  28  -0.177  -4.975  -2.275
  191   1HB   GLN  28          HB1       GLN  28  -2.181  -6.113  -0.312
  192   2HB   GLN  28          HB2       GLN  28  -1.269  -7.014  -1.525
  193   1HG   GLN  28          HG1       GLN  28   0.015  -5.501   0.795
  194   2HG   GLN  28          HG2       GLN  28  -0.476  -7.226   0.832
  195   1HE2  GLN  28          1HE2      GLN  28   1.650  -4.928  -1.077
  196   2HE2  GLN  28          2HE2      GLN  28   2.848  -6.164  -1.388
  197    H    GLY  29           H        GLY  29  -1.104  -4.549  -4.177
  198   1HA   GLY  29          HA1       GLY  29  -2.894  -5.045  -5.565
  199   2HA   GLY  29          HA2       GLY  29  -3.969  -4.709  -4.382
  200    H    CYS  30           H        CYS  30  -1.925  -2.154  -4.249
  201    HA   CYS  30           HA       CYS  30  -3.611  -0.271  -5.316
  202   1HB   CYS  30          HB1       CYS  30  -1.467   0.072  -3.980
  203   2HB   CYS  30          HB2       CYS  30  -0.585  -0.097  -5.515
  204    H    THR  31           H        THR  31  -1.281  -2.280  -6.994
  205    HA   THR  31           HA       THR  31  -2.681  -1.830  -9.491
  206    HB   THR  31           HB       THR  31  -0.836  -0.317  -9.849
  207    HG1  THR  31           HG1      THR  31   0.019  -1.390 -11.648
  208   1HG2  THR  31          1HG2      THR  31   0.751  -1.160  -8.163
  209   2HG2  THR  31          2HG2      THR  31   0.962  -2.663  -9.089
  210   3HG2  THR  31          3HG2      THR  31   1.516  -1.116  -9.762
  Start of MODEL    3
    1   1H    THR   1           H        THR   1   5.261  -7.355  -8.075
    2    HA   THR   1           HA       THR   1   5.028  -7.688  -5.873
    3    HB   THR   1           HB       THR   1   7.833  -8.866  -5.754
    4    HG1  THR   1           HG1      THR   1   6.331  -9.777  -7.306
    5   1HG2  THR   1          1HG2      THR   1   6.854  -8.357  -3.534
    6   2HG2  THR   1          2HG2      THR   1   5.373  -9.229  -3.994
    7   3HG2  THR   1          3HG2      THR   1   6.911 -10.101  -3.843
    8    HA   PRO   2           HA       PRO   2   8.372  -5.087  -4.030
    9   1HB   PRO   2          HB1       PRO   2  10.481  -4.313  -5.928
   10   2HB   PRO   2          HB2       PRO   2  10.628  -4.966  -4.303
   11   1HG   PRO   2          HG1       PRO   2  11.025  -6.548  -6.492
   12   2HG   PRO   2          HG2       PRO   2  10.140  -7.220  -5.046
   13   1HD   PRO   2          HD1       PRO   2   8.983  -5.765  -7.448
   14   2HD   PRO   2          HD2       PRO   2   8.646  -7.386  -7.152
   15    H    TYR   3           H        TYR   3   6.066  -3.886  -5.025
   16    HA   TYR   3           HA       TYR   3   6.419  -1.618  -6.595
   17   1HB   TYR   3          HB1       TYR   3   4.380  -2.370  -4.454
   18   2HB   TYR   3          HB2       TYR   3   4.192  -1.192  -5.762
   19    HD1  TYR   3           HD1      TYR   3   4.799  -2.240  -8.211
   20    HD2  TYR   3           HD2      TYR   3   3.321  -4.428  -4.802
   21    HE1  TYR   3           HE1      TYR   3   4.439  -4.215  -9.640
   22    HE2  TYR   3           HE2      TYR   3   2.909  -6.393  -6.254
   23    HH   TYR   3           HH       TYR   3   3.813  -6.437  -9.704
   24    HA   PRO   4           HA       PRO   4   8.127   0.794  -3.065
   25   1HB   PRO   4          HB1       PRO   4   8.972   2.991  -4.366
   26   2HB   PRO   4          HB2       PRO   4   9.796   1.413  -4.607
   27   1HG   PRO   4          HG1       PRO   4   7.658   2.657  -6.359
   28   2HG   PRO   4          HG2       PRO   4   9.251   2.015  -6.874
   29   1HD   PRO   4          HD1       PRO   4   6.925   0.528  -6.969
   30   2HD   PRO   4          HD2       PRO   4   8.516  -0.210  -6.624
   31    H    VAL   5           H        VAL   5   5.377   0.461  -3.103
   32    HA   VAL   5           HA       VAL   5   4.111   3.105  -3.150
   33    HB   VAL   5           HB       VAL   5   3.520   0.296  -4.052
   34   1HG1  VAL   5          1HG1      VAL   5   2.049   0.215  -2.594
   35   2HG1  VAL   5          2HG1      VAL   5   1.652   1.979  -2.557
   36   3HG1  VAL   5          3HG1      VAL   5   1.045   0.901  -3.892
   37   1HG2  VAL   5          1HG2      VAL   5   2.334   1.442  -5.904
   38   2HG2  VAL   5          2HG2      VAL   5   2.563   3.012  -5.102
   39   3HG2  VAL   5          3HG2      VAL   5   3.965   2.122  -5.738
   40    H    ASN   6           H        ASN   6   4.053   3.584  -1.053
   41    HA   ASN   6           HA       ASN   6   4.791   1.649   0.878
   42   1HB   ASN   6          HB1       ASN   6   5.072   4.667   0.780
   43   2HB   ASN   6          HB2       ASN   6   6.043   3.384   1.546
   44   1HD2  ASN   6          1HD2      ASN   6   5.677   5.334  -1.295
   45   2HD2  ASN   6          2HD2      ASN   6   6.759   4.402  -2.320
   46    H    CYS   7           H        CYS   7   4.280   2.184   3.110
   47    HA   CYS   7           HA       CYS   7   1.948   3.800   3.791
   48   1HB   CYS   7          HB1       CYS   7   0.565   1.674   4.266
   49   2HB   CYS   7          HB2       CYS   7   0.735   2.277   2.585
   50    H    LYS   8           H        LYS   8   1.675   4.039   5.889
   51    HA   LYS   8           HA       LYS   8   3.196   2.529   7.901
   52   1HB   LYS   8          HB1       LYS   8   0.996   4.629   8.033
   53   2HB   LYS   8          HB2       LYS   8   1.804   3.939   9.463
   54   1HG   LYS   8          HG1       LYS   8   3.915   4.825   8.838
   55   2HG   LYS   8          HG2       LYS   8   3.385   5.236   7.201
   56   1HD   LYS   8          HD1       LYS   8   2.226   6.551   9.696
   57   2HD   LYS   8          HD2       LYS   8   3.643   7.173   8.794
   58   1HE   LYS   8          HE1       LYS   8   2.248   7.219   6.722
   59   2HE   LYS   8          HE2       LYS   8   0.834   6.725   7.674
   60   1HZ   LYS   8          HZ1       LYS   8   1.023   8.745   8.913
   61   2HZ   LYS   8          HZ2       LYS   8   2.309   9.229   7.989
   62   3HZ   LYS   8          HZ3       LYS   8   0.830   9.002   7.296
   63    H    THR   9           H        THR   9  -0.050   2.377   6.416
   64    HA   THR   9           HA       THR   9  -0.630  -0.168   7.576
   65    HB   THR   9           HB       THR   9  -1.089   1.118   9.596
   66    HG1  THR   9           HG1      THR   9  -2.513  -0.457   9.474
   67   1HG2  THR   9          1HG2      THR   9  -1.492   3.345   8.697
   68   2HG2  THR   9          2HG2      THR   9  -2.937   2.776   7.840
   69   3HG2  THR   9          3HG2      THR   9  -2.913   2.816   9.614
   70    H    ASP  10           H        ASP  10  -3.243  -0.404   7.120
   71    HA   ASP  10           HA       ASP  10  -3.505  -0.398   4.229
   72   1HB   ASP  10          HB1       ASP  10  -4.637  -2.088   5.626
   73   2HB   ASP  10          HB2       ASP  10  -5.450  -0.790   6.550
   74    H    ARG  11           H        ARG  11  -4.933   1.713   6.724
   75    HA   ARG  11           HA       ARG  11  -6.312   3.357   4.943
   76   1HB   ARG  11          HB1       ARG  11  -6.571   3.671   7.342
   77   2HB   ARG  11          HB2       ARG  11  -4.841   3.875   7.607
   78   1HG   ARG  11          HG1       ARG  11  -6.282   5.845   5.868
   79   2HG   ARG  11          HG2       ARG  11  -6.475   5.902   7.644
   80   1HD   ARG  11          HD1       ARG  11  -4.187   6.408   7.988
   81   2HD   ARG  11          HD2       ARG  11  -3.708   5.981   6.355
   82    HE   ARG  11           HE       ARG  11  -5.617   8.193   6.866
   83   1HH1  ARG  11          2HH2      ARG  11  -2.231   7.459   5.650
   84   2HH1  ARG  11          1HH2      ARG  11  -2.327   8.738   4.536
   85   1HH2  ARG  11          1HH1      ARG  11  -5.529   9.928   5.427
   86   2HH2  ARG  11          2HH1      ARG  11  -4.095  10.244   4.510
   87    H    ASP  12           H        ASP  12  -2.779   3.115   5.348
   88    HA   ASP  12           HA       ASP  12  -2.476   5.791   4.329
   89   1HB   ASP  12          HB1       ASP  12  -1.200   4.166   6.056
   90   2HB   ASP  12          HB2       ASP  12  -0.344   3.710   4.613
   91    H    CYS  13           H        CYS  13  -3.305   2.791   2.910
   92    HA   CYS  13           HA       CYS  13  -2.527   3.822   0.209
   93   1HB   CYS  13          HB1       CYS  13  -3.340   1.080   0.674
   94   2HB   CYS  13          HB2       CYS  13  -2.109   1.565  -0.380
   95    H    VAL  14           H        VAL  14  -5.129   3.454   2.200
   96    HA   VAL  14           HA       VAL  14  -7.059   2.290   0.618
   97    HB   VAL  14           HB       VAL  14  -7.199   3.420   2.794
   98   1HG1  VAL  14          1HG1      VAL  14  -5.876   5.279   1.861
   99   2HG1  VAL  14          2HG1      VAL  14  -7.404   5.986   1.298
  100   3HG1  VAL  14          3HG1      VAL  14  -7.139   5.706   3.052
  101   1HG2  VAL  14          1HG2      VAL  14  -9.370   2.882   1.678
  102   2HG2  VAL  14          2HG2      VAL  14  -9.494   4.381   2.617
  103   3HG2  VAL  14          3HG2      VAL  14  -9.333   4.453   0.850
  104    H    MET  15           H        MET  15  -5.419   5.188   0.039
  105    HA   MET  15           HA       MET  15  -6.980   6.458  -1.969
  106   1HB   MET  15          HB1       MET  15  -4.929   7.589  -2.658
  107   2HB   MET  15          HB2       MET  15  -5.118   7.564  -0.894
  108   1HG   MET  15          HG1       MET  15  -3.512   5.708  -0.749
  109   2HG   MET  15          HG2       MET  15  -3.367   5.688  -2.520
  110   1HE   MET  15          HE1       MET  15  -3.349   8.763   0.038
  111   2HE   MET  15          HE2       MET  15  -2.401   7.455   0.798
  112   3HE   MET  15          HE3       MET  15  -1.590   8.931   0.227
  113    H    CYS  16           H        CYS  16  -4.875   3.707  -2.161
  114    HA   CYS  16           HA       CYS  16  -4.631   3.452  -5.012
  115   1HB   CYS  16          HB1       CYS  16  -4.464   1.500  -2.712
  116   2HB   CYS  16          HB2       CYS  16  -4.088   1.066  -4.420
  117    H    GLY  17           H        GLY  17  -7.317   2.698  -2.817
  118   1HA   GLY  17          HA1       GLY  17  -9.121   2.173  -4.770
  119   2HA   GLY  17          HA2       GLY  17  -8.530   0.705  -4.366
  120    H    LEU  18           H        LEU  18  -8.987  -0.278  -2.350
  121    HA   LEU  18           HA       LEU  18 -11.032   1.082  -0.643
  122   1HB   LEU  18          HB1       LEU  18 -12.063  -0.206  -2.180
  123   2HB   LEU  18          HB2       LEU  18 -11.132  -1.626  -1.731
  124    HG   LEU  18           HG       LEU  18 -12.049  -1.685   0.394
  125   1HD1  LEU  18          1HD1      LEU  18 -13.141   1.156   0.216
  126   2HD1  LEU  18          2HD1      LEU  18 -13.563  -0.019   1.468
  127   3HD1  LEU  18          3HD1      LEU  18 -11.909   0.566   1.361
  128   1HD2  LEU  18          1HD2      LEU  18 -14.017  -0.370  -1.405
  129   2HD2  LEU  18          2HD2      LEU  18 -13.516  -2.100  -1.522
  130   3HD2  LEU  18          3HD2      LEU  18 -14.501  -1.543  -0.124
  131    H    GLY  19           H        GLY  19 -10.173  -2.149  -0.091
  132   1HA   GLY  19          HA1       GLY  19  -8.749  -1.586   2.348
  133   2HA   GLY  19          HA2       GLY  19  -9.459  -3.002   1.949
  134    H    ILE  20           H        ILE  20  -7.350  -0.982   0.217
  135    HA   ILE  20           HA       ILE  20  -5.551  -3.121  -0.633
  136    HB   ILE  20           HB       ILE  20  -4.960  -0.140  -0.713
  137   1HG1  ILE  20          1HG1      ILE  20  -6.899  -0.154  -1.964
  138   2HG1  ILE  20          2HG1      ILE  20  -5.622  -0.409  -3.187
  139   1HG2  ILE  20          1HG2      ILE  20  -3.988  -2.320  -2.554
  140   2HG2  ILE  20          2HG2      ILE  20  -3.351  -0.678  -2.351
  141   3HG2  ILE  20          3HG2      ILE  20  -3.117  -1.890  -1.079
  142   1HD1  ILE  20          1HD1      ILE  20  -7.487  -2.517  -2.077
  143   2HD1  ILE  20          2HD1      ILE  20  -7.445  -1.841  -3.711
  144   3HD1  ILE  20          3HD1      ILE  20  -6.101  -2.845  -3.139
  145    H    SER  21           H        SER  21  -4.798  -4.205   1.132
  146    HA   SER  21           HA       SER  21  -4.183  -2.863   3.569
  147   1HB   SER  21          HB1       SER  21  -3.736  -5.377   4.168
  148   2HB   SER  21          HB2       SER  21  -5.388  -4.785   3.805
  149    HG   SER  21           HG       SER  21  -5.415  -5.889   2.020
  150    H    CYS  22           H        CYS  22  -2.334  -2.261   4.424
  151    HA   CYS  22           HA       CYS  22   0.088  -2.437   2.845
  152   1HB   CYS  22          HB1       CYS  22  -0.521  -0.411   3.968
  153   2HB   CYS  22          HB2       CYS  22  -0.395  -1.124   5.561
  154    H    LYS  23           H        LYS  23   1.542  -4.038   2.889
  155    HA   LYS  23           HA       LYS  23   1.670  -5.827   5.274
  156   1HB   LYS  23          HB1       LYS  23   2.648  -6.043   2.437
  157   2HB   LYS  23          HB2       LYS  23   3.282  -7.070   3.762
  158   1HG   LYS  23          HG1       LYS  23   1.473  -8.210   2.552
  159   2HG   LYS  23          HG2       LYS  23   1.036  -7.921   4.244
  160   1HD   LYS  23          HD1       LYS  23  -0.323  -6.009   3.598
  161   2HD   LYS  23          HD2       LYS  23   0.241  -6.129   1.926
  162   1HE   LYS  23          HE1       LYS  23  -0.920  -8.528   2.072
  163   2HE   LYS  23          HE2       LYS  23  -1.773  -7.795   3.452
  164   1HZ   LYS  23          HZ1       LYS  23  -1.872  -7.131   0.632
  165   2HZ   LYS  23          HZ2       LYS  23  -3.138  -7.076   1.751
  166   3HZ   LYS  23          HZ3       LYS  23  -2.049  -5.885   1.696
  167    H    ASN  24           H        ASN  24   2.436  -4.335   6.650
  168    HA   ASN  24           HA       ASN  24   3.968  -3.118   7.832
  169   1HB   ASN  24          HB1       ASN  24   5.506  -5.491   7.152
  170   2HB   ASN  24          HB2       ASN  24   5.826  -4.409   8.501
  171   1HD2  ASN  24          1HD2      ASN  24   5.564  -6.778   9.445
  172   2HD2  ASN  24          2HD2      ASN  24   3.946  -7.139  10.024
  173    H    GLY  25           H        GLY  25   4.008  -2.048   5.118
  174   1HA   GLY  25          HA1       GLY  25   6.051  -0.327   5.090
  175   2HA   GLY  25          HA2       GLY  25   6.663  -1.660   4.371
  176    H    TYR  26           H        TYR  26   4.579  -2.708   2.914
  177    HA   TYR  26           HA       TYR  26   4.413  -0.621   0.828
  178   1HB   TYR  26          HB1       TYR  26   5.057  -3.591   0.874
  179   2HB   TYR  26          HB2       TYR  26   4.785  -2.669  -0.600
  180    HD1  TYR  26           HD1      TYR  26   6.332  -0.450  -0.784
  181    HD2  TYR  26           HD2      TYR  26   7.215  -3.845   1.723
  182    HE1  TYR  26           HE1      TYR  26   8.683   0.276  -0.637
  183    HE2  TYR  26           HE2      TYR  26   9.587  -3.133   1.839
  184    HH   TYR  26           HH       TYR  26  10.777  -0.193   0.195
  185    H    CYS  27           H        CYS  27   2.629  -0.764  -0.727
  186    HA   CYS  27           HA       CYS  27   0.462  -2.660   0.121
  187   1HB   CYS  27          HB1       CYS  27   0.102   0.177  -0.481
  188   2HB   CYS  27          HB2       CYS  27  -0.989  -0.944  -1.356
  189    H    GLN  28           H        GLN  28  -0.973  -3.360  -1.599
  190    HA   GLN  28           HA       GLN  28   0.734  -4.351  -3.845
  191   1HB   GLN  28          HB1       GLN  28  -1.158  -5.891  -2.027
  192   2HB   GLN  28          HB2       GLN  28  -0.124  -6.574  -3.292
  193   1HG   GLN  28          HG1       GLN  28   1.878  -6.033  -1.976
  194   2HG   GLN  28          HG2       GLN  28   0.891  -5.248  -0.715
  195   1HE2  GLN  28          1HE2      GLN  28   2.616  -7.929  -1.005
  196   2HE2  GLN  28          2HE2      GLN  28   1.566  -9.075  -0.196
  197    H    GLY  29           H        GLY  29  -0.458  -4.695  -5.776
  198   1HA   GLY  29          HA1       GLY  29  -2.243  -4.563  -7.164
  199   2HA   GLY  29          HA2       GLY  29  -3.145  -5.160  -5.941
  200    H    CYS  30           H        CYS  30  -1.523  -2.161  -5.971
  201    HA   CYS  30           HA       CYS  30  -3.568  -0.736  -5.004
  202   1HB   CYS  30          HB1       CYS  30  -1.283  -0.149  -4.634
  203   2HB   CYS  30          HB2       CYS  30  -0.957  -0.017  -6.382
  204    H    THR  31           H        THR  31  -5.239  -1.342  -6.577
  205    HA   THR  31           HA       THR  31  -5.584  -0.694  -9.208
  206    HB   THR  31           HB       THR  31  -8.045  -0.207  -8.378
  207    HG1  THR  31           HG1      THR  31  -7.215   0.242  -6.193
  208   1HG2  THR  31          1HG2      THR  31  -7.317  -2.382  -9.303
  209   2HG2  THR  31          2HG2      THR  31  -6.649  -2.841  -7.719
  210   3HG2  THR  31          3HG2      THR  31  -8.396  -2.606  -7.914
  Start of MODEL    4
    1   1H    THR   1           H        THR   1  10.956  -6.662  -3.638
    2    HA   THR   1           HA       THR   1  12.221  -5.516  -5.575
    3    HB   THR   1           HB       THR   1  10.096  -7.545  -6.308
    4    HG1  THR   1           HG1      THR   1  11.417  -9.064  -5.198
    5   1HG2  THR   1          1HG2      THR   1  11.826  -6.899  -7.987
    6   2HG2  THR   1          2HG2      THR   1  13.096  -7.378  -6.839
    7   3HG2  THR   1          3HG2      THR   1  11.977  -8.595  -7.487
    8    HA   PRO   2           HA       PRO   2   8.330  -4.078  -7.905
    9   1HB   PRO   2          HB1       PRO   2   6.277  -3.595  -5.816
   10   2HB   PRO   2          HB2       PRO   2   6.060  -4.151  -7.470
   11   1HG   PRO   2          HG1       PRO   2   6.020  -5.925  -5.412
   12   2HG   PRO   2          HG2       PRO   2   6.897  -6.370  -6.948
   13   1HD   PRO   2          HD1       PRO   2   8.003  -4.998  -4.475
   14   2HD   PRO   2          HD2       PRO   2   8.532  -6.521  -4.993
   15    H    TYR   3           H        TYR   3   6.879  -1.654  -7.606
   16    HA   TYR   3           HA       TYR   3   8.614   0.360  -6.798
   17   1HB   TYR   3          HB1       TYR   3   5.603  -0.006  -7.130
   18   2HB   TYR   3          HB2       TYR   3   6.386   1.543  -6.804
   19    HD1  TYR   3           HD1      TYR   3   8.122   2.429  -8.471
   20    HD2  TYR   3           HD2      TYR   3   5.439  -0.828  -9.365
   21    HE1  TYR   3           HE1      TYR   3   8.584   2.704 -10.894
   22    HE2  TYR   3           HE2      TYR   3   5.912  -0.556 -11.774
   23    HH   TYR   3           HH       TYR   3   7.085   0.621 -13.377
   24    HA   PRO   4           HA       PRO   4   8.007  -0.107  -2.370
   25   1HB   PRO   4          HB1       PRO   4   8.874   2.257  -1.415
   26   2HB   PRO   4          HB2       PRO   4   9.972   1.135  -2.293
   27   1HG   PRO   4          HG1       PRO   4   8.474   3.508  -3.445
   28   2HG   PRO   4          HG2       PRO   4  10.233   3.175  -3.558
   29   1HD   PRO   4          HD1       PRO   4   8.498   2.442  -5.542
   30   2HD   PRO   4          HD2       PRO   4   9.868   1.386  -5.075
   31    H    VAL   5           H        VAL   5   5.466   0.073  -3.529
   32    HA   VAL   5           HA       VAL   5   4.071   2.287  -2.600
   33    HB   VAL   5           HB       VAL   5   2.318   0.089  -2.744
   34   1HG1  VAL   5          1HG1      VAL   5   3.281   2.042  -4.822
   35   2HG1  VAL   5          2HG1      VAL   5   1.611   1.367  -4.764
   36   3HG1  VAL   5          3HG1      VAL   5   2.185   2.460  -3.453
   37   1HG2  VAL   5          1HG2      VAL   5   4.206  -0.193  -5.101
   38   2HG2  VAL   5          2HG2      VAL   5   3.989  -1.385  -3.786
   39   3HG2  VAL   5          3HG2      VAL   5   2.646  -0.991  -4.864
   40    H    ASN   6           H        ASN   6   3.953   2.778  -0.665
   41    HA   ASN   6           HA       ASN   6   4.082   0.806   1.506
   42   1HB   ASN   6          HB1       ASN   6   5.414   3.316   0.579
   43   2HB   ASN   6          HB2       ASN   6   5.177   3.130   2.278
   44   1HD2  ASN   6          1HD2      ASN   6   7.711   3.267   2.061
   45   2HD2  ASN   6          2HD2      ASN   6   8.538   1.745   1.777
   46    H    CYS   7           H        CYS   7   3.792   1.964   3.481
   47    HA   CYS   7           HA       CYS   7   1.326   3.567   3.813
   48   1HB   CYS   7          HB1       CYS   7   0.017   1.588   4.675
   49   2HB   CYS   7          HB2       CYS   7   0.367   1.515   2.931
   50    H    LYS   8           H        LYS   8   1.023   4.126   6.003
   51    HA   LYS   8           HA       LYS   8   2.614   2.806   8.143
   52   1HB   LYS   8          HB1       LYS   8   0.921   5.230   7.909
   53   2HB   LYS   8          HB2       LYS   8   1.253   4.432   9.494
   54   1HG   LYS   8          HG1       LYS   8   2.976   5.837   9.420
   55   2HG   LYS   8          HG2       LYS   8   3.769   4.473   8.784
   56   1HD   LYS   8          HD1       LYS   8   2.538   6.699   7.084
   57   2HD   LYS   8          HD2       LYS   8   4.175   6.809   7.789
   58   1HE   LYS   8          HE1       LYS   8   3.191   5.203   5.457
   59   2HE   LYS   8          HE2       LYS   8   4.618   6.255   5.616
   60   1HZ   LYS   8          HZ1       LYS   8   4.264   3.499   6.578
   61   2HZ   LYS   8          HZ2       LYS   8   5.361   4.067   5.529
   62   3HZ   LYS   8          HZ3       LYS   8   5.501   4.467   7.121
   63    H    THR   9           H        THR   9  -0.596   2.612   6.664
   64    HA   THR   9           HA       THR   9  -1.236   0.211   7.964
   65    HB   THR   9           HB       THR   9  -1.743   1.515   9.952
   66    HG1  THR   9           HG1      THR   9  -3.811   0.834  10.199
   67   1HG2  THR   9          1HG2      THR   9  -2.074   3.752   8.978
   68   2HG2  THR   9          2HG2      THR   9  -3.536   3.181   8.144
   69   3HG2  THR   9          3HG2      THR   9  -3.499   3.279   9.919
   70    H    ASP  10           H        ASP  10  -3.848  -0.027   7.423
   71    HA   ASP  10           HA       ASP  10  -3.960  -0.024   4.524
   72   1HB   ASP  10          HB1       ASP  10  -5.922  -0.444   6.852
   73   2HB   ASP  10          HB2       ASP  10  -6.525  -0.385   5.181
   74    H    ARG  11           H        ARG  11  -5.477   2.064   6.898
   75    HA   ARG  11           HA       ARG  11  -6.757   3.778   5.088
   76   1HB   ARG  11          HB1       ARG  11  -7.294   4.285   7.261
   77   2HB   ARG  11          HB2       ARG  11  -5.707   3.943   7.912
   78   1HG   ARG  11          HG1       ARG  11  -6.125   6.408   6.217
   79   2HG   ARG  11          HG2       ARG  11  -6.693   6.302   7.935
   80   1HD   ARG  11          HD1       ARG  11  -4.711   7.033   8.554
   81   2HD   ARG  11          HD2       ARG  11  -4.054   5.459   8.097
   82    HE   ARG  11           HE       ARG  11  -2.801   6.533   6.520
   83   1HH1  ARG  11          2HH2      ARG  11  -5.690   8.461   7.019
   84   2HH1  ARG  11          1HH2      ARG  11  -5.139   9.813   6.067
   85   1HH2  ARG  11          1HH1      ARG  11  -2.017   8.213   5.353
   86   2HH2  ARG  11          2HH1      ARG  11  -2.966   9.646   5.008
   87    H    ASP  12           H        ASP  12  -3.228   3.415   5.581
   88    HA   ASP  12           HA       ASP  12  -2.813   6.069   4.501
   89   1HB   ASP  12          HB1       ASP  12  -1.557   4.508   6.276
   90   2HB   ASP  12          HB2       ASP  12  -0.792   3.875   4.835
   91    H    CYS  13           H        CYS  13  -3.772   3.163   3.127
   92    HA   CYS  13           HA       CYS  13  -2.983   4.189   0.418
   93   1HB   CYS  13          HB1       CYS  13  -2.790   1.511   1.744
   94   2HB   CYS  13          HB2       CYS  13  -3.187   1.512   0.006
   95    H    VAL  14           H        VAL  14  -5.519   3.788   2.390
   96    HA   VAL  14           HA       VAL  14  -7.518   2.760   0.823
   97    HB   VAL  14           HB       VAL  14  -7.660   3.956   2.945
   98   1HG1  VAL  14          1HG1      VAL  14  -7.484   6.528   1.452
   99   2HG1  VAL  14          2HG1      VAL  14  -7.311   6.210   3.197
  100   3HG1  VAL  14          3HG1      VAL  14  -6.058   5.647   2.054
  101   1HG2  VAL  14          1HG2      VAL  14  -9.809   5.155   2.661
  102   2HG2  VAL  14          2HG2      VAL  14  -9.552   5.234   0.906
  103   3HG2  VAL  14          3HG2      VAL  14  -9.806   3.663   1.695
  104    H    MET  15           H        MET  15  -5.786   5.634   0.231
  105    HA   MET  15           HA       MET  15  -7.273   6.841  -1.851
  106   1HB   MET  15          HB1       MET  15  -5.232   8.070  -2.393
  107   2HB   MET  15          HB2       MET  15  -5.515   8.013  -0.641
  108   1HG   MET  15          HG1       MET  15  -3.896   6.168  -0.453
  109   2HG   MET  15          HG2       MET  15  -3.595   6.233  -2.189
  110   1HE   MET  15          HE1       MET  15  -2.379   8.214  -3.429
  111   2HE   MET  15          HE2       MET  15  -3.454   9.453  -2.730
  112   3HE   MET  15          HE3       MET  15  -1.694   9.632  -2.604
  113    H    CYS  16           H        CYS  16  -5.236   4.071  -1.925
  114    HA   CYS  16           HA       CYS  16  -4.670   4.009  -4.777
  115   1HB   CYS  16          HB1       CYS  16  -4.553   1.974  -2.556
  116   2HB   CYS  16          HB2       CYS  16  -4.046   1.620  -4.248
  117    H    GLY  17           H        GLY  17  -7.518   3.244  -2.855
  118   1HA   GLY  17          HA1       GLY  17  -9.216   3.081  -4.836
  119   2HA   GLY  17          HA2       GLY  17  -8.687   1.536  -4.820
  120    H    LEU  18           H        LEU  18  -9.067   0.154  -3.038
  121    HA   LEU  18           HA       LEU  18 -11.396   0.931  -1.368
  122   1HB   LEU  18          HB1       LEU  18 -11.252  -0.980  -3.204
  123   2HB   LEU  18          HB2       LEU  18 -10.442  -1.916  -2.001
  124    HG   LEU  18           HG       LEU  18 -12.962  -0.447  -1.381
  125   1HD1  LEU  18          1HD1      LEU  18 -14.379  -2.336  -2.211
  126   2HD1  LEU  18          2HD1      LEU  18 -13.426  -1.638  -3.523
  127   3HD1  LEU  18          3HD1      LEU  18 -12.910  -3.163  -2.770
  128   1HD2  LEU  18          1HD2      LEU  18 -12.380  -1.361   0.568
  129   2HD2  LEU  18          2HD2      LEU  18 -13.646  -2.425  -0.016
  130   3HD2  LEU  18          3HD2      LEU  18 -11.961  -2.964  -0.147
  131    H    GLY  19           H        GLY  19 -10.573  -1.565  -0.071
  132   1HA   GLY  19          HA1       GLY  19  -9.003  -0.607   2.147
  133   2HA   GLY  19          HA2       GLY  19  -9.777  -2.044   2.079
  134    H    ILE  20           H        ILE  20  -7.644  -0.502  -0.032
  135    HA   ILE  20           HA       ILE  20  -5.941  -2.644  -0.791
  136    HB   ILE  20           HB       ILE  20  -5.311   0.331  -0.598
  137   1HG1  ILE  20          1HG1      ILE  20  -7.121   0.319  -1.996
  138   2HG1  ILE  20          2HG1      ILE  20  -5.764   0.186  -3.138
  139   1HG2  ILE  20          1HG2      ILE  20  -3.542   0.023  -2.095
  140   2HG2  ILE  20          2HG2      ILE  20  -3.301  -1.180  -0.845
  141   3HG2  ILE  20          3HG2      ILE  20  -3.985  -1.664  -2.415
  142   1HD1  ILE  20          1HD1      ILE  20  -6.143  -2.298  -3.187
  143   2HD1  ILE  20          2HD1      ILE  20  -7.648  -2.015  -2.281
  144   3HD1  ILE  20          3HD1      ILE  20  -7.437  -1.306  -3.889
  145    H    SER  21           H        SER  21  -5.042  -3.973   0.688
  146    HA   SER  21           HA       SER  21  -4.713  -3.211   3.329
  147   1HB   SER  21          HB1       SER  21  -3.721  -5.579   3.430
  148   2HB   SER  21          HB2       SER  21  -5.366  -5.413   2.761
  149    HG   SER  21           HG       SER  21  -3.095  -5.269   1.088
  150    H    CYS  22           H        CYS  22  -2.982  -2.830   4.633
  151    HA   CYS  22           HA       CYS  22  -0.297  -2.415   3.418
  152   1HB   CYS  22          HB1       CYS  22  -1.112  -0.418   4.187
  153   2HB   CYS  22          HB2       CYS  22  -1.685  -1.045   5.719
  154    H    LYS  23           H        LYS  23   1.054  -4.013   3.729
  155    HA   LYS  23           HA       LYS  23   1.127  -5.761   6.122
  156   1HB   LYS  23          HB1       LYS  23   2.929  -5.538   3.746
  157   2HB   LYS  23          HB2       LYS  23   3.043  -6.691   5.107
  158   1HG   LYS  23          HG1       LYS  23   0.635  -7.384   4.567
  159   2HG   LYS  23          HG2       LYS  23   0.767  -6.398   3.094
  160   1HD   LYS  23          HD1       LYS  23   2.844  -7.694   2.490
  161   2HD   LYS  23          HD2       LYS  23   2.586  -8.639   3.985
  162   1HE   LYS  23          HE1       LYS  23   0.867  -9.872   3.012
  163   2HE   LYS  23          HE2       LYS  23   0.300  -8.501   2.028
  164   1HZ   LYS  23          HZ1       LYS  23   2.107  -8.830   0.554
  165   2HZ   LYS  23          HZ2       LYS  23   2.699 -10.097   1.436
  166   3HZ   LYS  23          HZ3       LYS  23   1.240 -10.222   0.677
  167    H    ASN  24           H        ASN  24   3.355  -5.655   7.227
  168    HA   ASN  24           HA       ASN  24   4.095  -4.076   8.907
  169   1HB   ASN  24          HB1       ASN  24   5.699  -5.682   8.097
  170   2HB   ASN  24          HB2       ASN  24   6.120  -4.660   6.721
  171   1HD2  ASN  24          1HD2      ASN  24   8.072  -3.578   7.041
  172   2HD2  ASN  24          2HD2      ASN  24   8.612  -3.004   8.606
  173    H    GLY  25           H        GLY  25   5.347  -2.808   5.811
  174   1HA   GLY  25          HA1       GLY  25   4.143  -0.299   6.337
  175   2HA   GLY  25          HA2       GLY  25   5.767  -0.199   6.195
  176    H    TYR  26           H        TYR  26   3.949  -2.498   4.391
  177    HA   TYR  26           HA       TYR  26   4.687  -1.177   1.837
  178   1HB   TYR  26          HB1       TYR  26   6.138  -3.165   2.823
  179   2HB   TYR  26          HB2       TYR  26   4.848  -4.092   2.044
  180    HD1  TYR  26           HD1      TYR  26   8.058  -2.833   1.574
  181    HD2  TYR  26           HD2      TYR  26   4.272  -3.114  -0.481
  182    HE1  TYR  26           HE1      TYR  26   9.221  -2.701  -0.607
  183    HE2  TYR  26           HE2      TYR  26   5.441  -2.923  -2.649
  184    HH   TYR  26           HH       TYR  26   7.512  -2.339  -3.659
  185    H    CYS  27           H        CYS  27   2.808  -0.946   0.600
  186    HA   CYS  27           HA       CYS  27   0.412  -2.420   1.480
  187   1HB   CYS  27          HB1       CYS  27  -0.464  -0.453   1.699
  188   2HB   CYS  27          HB2       CYS  27   1.050   0.326   1.156
  189    H    GLN  28           H        GLN  28  -1.151  -3.069  -0.038
  190    HA   GLN  28           HA       GLN  28   0.346  -4.301  -2.335
  191   1HB   GLN  28          HB1       GLN  28  -1.674  -5.527  -0.456
  192   2HB   GLN  28          HB2       GLN  28  -0.673  -6.375  -1.639
  193   1HG   GLN  28          HG1       GLN  28   0.461  -4.843   0.742
  194   2HG   GLN  28          HG2       GLN  28   0.001  -6.579   0.764
  195   1HE2  GLN  28          1HE2      GLN  28   2.147  -4.283  -1.140
  196   2HE2  GLN  28          2HE2      GLN  28   3.384  -5.501  -1.351
  197    H    GLY  29           H        GLY  29  -0.546  -4.212  -4.278
  198   1HA   GLY  29          HA1       GLY  29  -2.153  -4.327  -5.853
  199   2HA   GLY  29          HA2       GLY  29  -3.251  -4.718  -4.709
  200    H    CYS  30           H        CYS  30  -1.400  -1.840  -4.971
  201    HA   CYS  30           HA       CYS  30  -3.408  -0.222  -4.403
  202   1HB   CYS  30          HB1       CYS  30  -1.167   0.379  -3.950
  203   2HB   CYS  30          HB2       CYS  30  -0.709   0.316  -5.662
  204    H    THR  31           H        THR  31  -5.005  -0.961  -5.958
  205    HA   THR  31           HA       THR  31  -5.322   1.021  -8.126
  206    HB   THR  31           HB       THR  31  -4.311  -0.712  -9.380
  207    HG1  THR  31           HG1      THR  31  -7.127  -0.825  -9.612
  208   1HG2  THR  31          1HG2      THR  31  -5.240  -3.024  -9.443
  209   2HG2  THR  31          2HG2      THR  31  -4.496  -2.606  -7.891
  210   3HG2  THR  31          3HG2      THR  31  -6.266  -2.625  -8.047
  Start of MODEL    5
    1   1H    THR   1           H        THR   1  10.992  -6.246  -8.458
    2    HA   THR   1           HA       THR   1  11.626  -4.186  -9.866
    3    HB   THR   1           HB       THR   1   9.295  -5.870 -10.821
    4    HG1  THR   1           HG1      THR   1  10.856  -7.541 -11.063
    5   1HG2  THR   1          1HG2      THR   1  10.638  -5.978 -12.873
    6   2HG2  THR   1          2HG2      THR   1  10.387  -4.284 -12.407
    7   3HG2  THR   1          3HG2      THR   1  11.950  -5.070 -12.093
    8    HA   PRO   2           HA       PRO   2   7.240  -2.349 -10.022
    9   1HB   PRO   2          HB1       PRO   2   6.028  -3.041  -7.395
   10   2HB   PRO   2          HB2       PRO   2   5.237  -2.796  -8.944
   11   1HG   PRO   2          HG1       PRO   2   5.772  -5.312  -8.073
   12   2HG   PRO   2          HG2       PRO   2   6.076  -4.903  -9.825
   13   1HD   PRO   2          HD1       PRO   2   7.996  -4.729  -7.484
   14   2HD   PRO   2          HD2       PRO   2   8.250  -5.764  -8.797
   15    H    TYR   3           H        TYR   3   6.311  -0.214  -8.736
   16    HA   TYR   3           HA       TYR   3   8.325   1.236  -7.451
   17   1HB   TYR   3          HB1       TYR   3   5.301   1.282  -7.758
   18   2HB   TYR   3          HB2       TYR   3   6.169   2.470  -6.785
   19    HD1  TYR   3           HD1      TYR   3   7.800   4.043  -7.853
   20    HD2  TYR   3           HD2      TYR   3   5.345   1.371 -10.184
   21    HE1  TYR   3           HE1      TYR   3   8.360   5.313  -9.909
   22    HE2  TYR   3           HE2      TYR   3   5.917   2.632 -12.232
   23    HH   TYR   3           HH       TYR   3   7.107   4.397 -13.125
   24    HA   PRO   4           HA       PRO   4   7.737  -0.753  -3.432
   25   1HB   PRO   4          HB1       PRO   4   9.094   0.918  -1.795
   26   2HB   PRO   4          HB2       PRO   4   9.933  -0.033  -3.068
   27   1HG   PRO   4          HG1       PRO   4   8.992   2.843  -3.252
   28   2HG   PRO   4          HG2       PRO   4  10.631   2.207  -3.610
   29   1HD   PRO   4          HD1       PRO   4   8.750   2.589  -5.569
   30   2HD   PRO   4          HD2       PRO   4   9.877   1.199  -5.620
   31    H    VAL   5           H        VAL   5   5.300   0.131  -4.160
   32    HA   VAL   5           HA       VAL   5   4.250   2.230  -2.812
   33    HB   VAL   5           HB       VAL   5   2.338   0.131  -2.880
   34   1HG1  VAL   5          1HG1      VAL   5   1.337   1.607  -4.530
   35   2HG1  VAL   5          2HG1      VAL   5   2.204   2.573  -3.289
   36   3HG1  VAL   5          3HG1      VAL   5   2.989   2.263  -4.878
   37   1HG2  VAL   5          1HG2      VAL   5   2.279  -0.712  -5.107
   38   2HG2  VAL   5          2HG2      VAL   5   3.799   0.084  -5.527
   39   3HG2  VAL   5          3HG2      VAL   5   3.776  -1.252  -4.338
   40    H    ASN   6           H        ASN   6   4.332   2.595  -0.826
   41    HA   ASN   6           HA       ASN   6   4.309   0.489   1.220
   42   1HB   ASN   6          HB1       ASN   6   5.983   2.775   0.374
   43   2HB   ASN   6          HB2       ASN   6   5.629   2.768   2.054
   44   1HD2  ASN   6          1HD2      ASN   6   7.960   2.312   2.527
   45   2HD2  ASN   6          2HD2      ASN   6   8.658   0.748   2.134
   46    H    CYS   7           H        CYS   7   4.202   1.673   3.290
   47    HA   CYS   7           HA       CYS   7   2.153   3.660   3.781
   48   1HB   CYS   7          HB1       CYS   7   0.467   1.946   4.643
   49   2HB   CYS   7          HB2       CYS   7   0.587   2.196   2.878
   50    H    LYS   8           H        LYS   8   1.522   3.865   5.922
   51    HA   LYS   8           HA       LYS   8   3.213   2.664   8.034
   52   1HB   LYS   8          HB1       LYS   8   1.090   4.829   7.901
   53   2HB   LYS   8          HB2       LYS   8   1.744   4.174   9.437
   54   1HG   LYS   8          HG1       LYS   8   3.464   5.542   9.307
   55   2HG   LYS   8          HG2       LYS   8   4.018   4.795   7.823
   56   1HD   LYS   8          HD1       LYS   8   1.852   6.921   7.715
   57   2HD   LYS   8          HD2       LYS   8   3.557   7.399   7.973
   58   1HE   LYS   8          HE1       LYS   8   4.253   6.512   5.900
   59   2HE   LYS   8          HE2       LYS   8   2.750   5.560   5.716
   60   1HZ   LYS   8          HZ1       LYS   8   3.055   8.418   5.196
   61   2HZ   LYS   8          HZ2       LYS   8   2.368   7.148   4.321
   62   3HZ   LYS   8          HZ3       LYS   8   1.576   7.703   5.545
   63    H    THR   9           H        THR   9  -0.157   2.679   6.776
   64    HA   THR   9           HA       THR   9  -0.603   0.000   7.472
   65    HB   THR   9           HB       THR   9  -0.918   0.836   9.772
   66    HG1  THR   9           HG1      THR   9  -2.237  -0.842   9.153
   67   1HG2  THR   9          1HG2      THR   9  -3.128   2.598   8.622
   68   2HG2  THR   9          2HG2      THR   9  -2.745   2.358  10.335
   69   3HG2  THR   9          3HG2      THR   9  -1.581   3.180   9.282
   70    H    ASP  10           H        ASP  10  -3.266  -0.169   7.195
   71    HA   ASP  10           HA       ASP  10  -3.713   0.095   4.443
   72   1HB   ASP  10          HB1       ASP  10  -5.594   0.056   6.903
   73   2HB   ASP  10          HB2       ASP  10  -6.188  -0.142   5.252
   74    H    ARG  11           H        ARG  11  -4.904   2.267   6.892
   75    HA   ARG  11           HA       ARG  11  -6.308   3.937   5.182
   76   1HB   ARG  11          HB1       ARG  11  -6.459   4.221   7.589
   77   2HB   ARG  11          HB2       ARG  11  -4.715   4.433   7.769
   78   1HG   ARG  11          HG1       ARG  11  -6.194   6.418   6.075
   79   2HG   ARG  11          HG2       ARG  11  -6.435   6.456   7.843
   80   1HD   ARG  11          HD1       ARG  11  -4.205   7.027   8.264
   81   2HD   ARG  11          HD2       ARG  11  -3.615   6.367   6.717
   82    HE   ARG  11           HE       ARG  11  -4.008   8.300   5.662
   83   1HH1  ARG  11          2HH2      ARG  11  -5.686   8.398   8.748
   84   2HH1  ARG  11          1HH2      ARG  11  -6.024  10.101   8.719
   85   1HH2  ARG  11          1HH1      ARG  11  -4.446  10.566   5.550
   86   2HH2  ARG  11          2HH1      ARG  11  -5.311  11.361   6.824
   87    H    ASP  12           H        ASP  12  -2.768   3.702   5.431
   88    HA   ASP  12           HA       ASP  12  -2.471   6.327   4.299
   89   1HB   ASP  12          HB1       ASP  12  -0.912   4.908   5.832
   90   2HB   ASP  12          HB2       ASP  12  -0.451   4.075   4.358
   91    H    CYS  13           H        CYS  13  -3.424   3.308   2.998
   92    HA   CYS  13           HA       CYS  13  -2.969   4.378   0.221
   93   1HB   CYS  13          HB1       CYS  13  -2.377   1.759   1.497
   94   2HB   CYS  13          HB2       CYS  13  -2.952   1.701  -0.194
   95    H    VAL  14           H        VAL  14  -5.243   3.856   2.362
   96    HA   VAL  14           HA       VAL  14  -7.299   2.600   1.032
   97    HB   VAL  14           HB       VAL  14  -7.392   3.925   3.077
   98   1HG1  VAL  14          1HG1      VAL  14  -7.432   6.415   1.443
   99   2HG1  VAL  14          2HG1      VAL  14  -7.122   6.198   3.186
  100   3HG1  VAL  14          3HG1      VAL  14  -5.922   5.643   1.985
  101   1HG2  VAL  14          1HG2      VAL  14  -9.465   5.003   1.103
  102   2HG2  VAL  14          2HG2      VAL  14  -9.594   3.472   1.992
  103   3HG2  VAL  14          3HG2      VAL  14  -9.603   5.014   2.872
  104    H    MET  15           H        MET  15  -5.870   5.564   0.139
  105    HA   MET  15           HA       MET  15  -7.571   6.474  -1.931
  106   1HB   MET  15          HB1       MET  15  -5.717   7.918  -2.580
  107   2HB   MET  15          HB2       MET  15  -5.919   7.890  -0.815
  108   1HG   MET  15          HG1       MET  15  -4.099   6.212  -0.666
  109   2HG   MET  15          HG2       MET  15  -3.865   6.313  -2.409
  110   1HE   MET  15          HE1       MET  15  -2.414   9.933  -2.852
  111   2HE   MET  15          HE2       MET  15  -2.961   8.454  -3.674
  112   3HE   MET  15          HE3       MET  15  -4.144   9.544  -2.904
  113    H    CYS  16           H        CYS  16  -5.307   3.899  -1.944
  114    HA   CYS  16           HA       CYS  16  -4.768   3.763  -4.799
  115   1HB   CYS  16          HB1       CYS  16  -4.519   1.819  -2.516
  116   2HB   CYS  16          HB2       CYS  16  -4.130   1.343  -4.197
  117    H    GLY  17           H        GLY  17  -7.533   2.941  -2.778
  118   1HA   GLY  17          HA1       GLY  17  -9.257   2.985  -4.758
  119   2HA   GLY  17          HA2       GLY  17  -8.842   1.406  -4.797
  120    H    LEU  18           H        LEU  18  -8.834   0.264  -2.671
  121    HA   LEU  18           HA       LEU  18 -11.159   1.001  -0.986
  122   1HB   LEU  18          HB1       LEU  18 -11.302  -0.766  -2.987
  123   2HB   LEU  18          HB2       LEU  18 -10.517  -1.869  -1.915
  124    HG   LEU  18           HG       LEU  18 -12.806  -0.219  -1.007
  125   1HD1  LEU  18          1HD1      LEU  18 -13.559  -1.129  -3.199
  126   2HD1  LEU  18          2HD1      LEU  18 -13.183  -2.772  -2.634
  127   3HD1  LEU  18          3HD1      LEU  18 -14.501  -1.843  -1.886
  128   1HD2  LEU  18          1HD2      LEU  18 -12.225  -1.370   0.807
  129   2HD2  LEU  18          2HD2      LEU  18 -13.632  -2.243   0.230
  130   3HD2  LEU  18          3HD2      LEU  18 -12.023  -2.932  -0.072
  131    H    GLY  19           H        GLY  19 -10.476  -1.692   0.031
  132   1HA   GLY  19          HA1       GLY  19  -8.818  -1.032   2.266
  133   2HA   GLY  19          HA2       GLY  19  -9.645  -2.425   2.061
  134    H    ILE  20           H        ILE  20  -7.461  -0.754   0.133
  135    HA   ILE  20           HA       ILE  20  -5.640  -2.873  -0.609
  136    HB   ILE  20           HB       ILE  20  -5.109   0.148  -0.485
  137   1HG1  ILE  20          1HG1      ILE  20  -6.889   0.039  -1.954
  138   2HG1  ILE  20          2HG1      ILE  20  -5.487  -0.139  -3.046
  139   1HG2  ILE  20          1HG2      ILE  20  -3.053  -1.202  -0.656
  140   2HG2  ILE  20          2HG2      ILE  20  -3.712  -1.941  -2.138
  141   3HG2  ILE  20          3HG2      ILE  20  -3.387  -0.193  -2.052
  142   1HD1  ILE  20          1HD1      ILE  20  -7.130  -1.668  -3.768
  143   2HD1  ILE  20          2HD1      ILE  20  -5.806  -2.593  -3.025
  144   3HD1  ILE  20          3HD1      ILE  20  -7.335  -2.343  -2.145
  145    H    SER  21           H        SER  21  -5.591  -3.975   1.479
  146    HA   SER  21           HA       SER  21  -4.681  -2.603   3.708
  147   1HB   SER  21          HB1       SER  21  -4.917  -4.958   4.716
  148   2HB   SER  21          HB2       SER  21  -6.352  -4.247   3.923
  149    HG   SER  21           HG       SER  21  -6.082  -6.343   3.179
  150    H    CYS  22           H        CYS  22  -2.926  -2.908   5.092
  151    HA   CYS  22           HA       CYS  22  -0.588  -2.991   3.323
  152   1HB   CYS  22          HB1       CYS  22  -1.930  -1.167   5.147
  153   2HB   CYS  22          HB2       CYS  22  -0.190  -1.106   5.401
  154    H    LYS  23           H        LYS  23   1.021  -4.216   3.668
  155    HA   LYS  23           HA       LYS  23   1.275  -5.927   6.048
  156   1HB   LYS  23          HB1       LYS  23   2.844  -5.787   3.480
  157   2HB   LYS  23          HB2       LYS  23   2.998  -7.006   4.780
  158   1HG   LYS  23          HG1       LYS  23   0.435  -7.274   4.573
  159   2HG   LYS  23          HG2       LYS  23   0.560  -6.426   3.037
  160   1HD   LYS  23          HD1       LYS  23   2.043  -8.981   3.818
  161   2HD   LYS  23          HD2       LYS  23   0.566  -8.876   2.831
  162   1HE   LYS  23          HE1       LYS  23   2.220  -7.160   1.474
  163   2HE   LYS  23          HE2       LYS  23   3.441  -8.243   2.153
  164   1HZ   LYS  23          HZ1       LYS  23   2.692  -8.991  -0.003
  165   2HZ   LYS  23          HZ2       LYS  23   2.180 -10.085   1.120
  166   3HZ   LYS  23          HZ3       LYS  23   1.122  -8.979   0.489
  167    H    ASN  24           H        ASN  24   3.913  -6.071   6.453
  168    HA   ASN  24           HA       ASN  24   4.642  -3.985   8.115
  169   1HB   ASN  24          HB1       ASN  24   6.280  -6.138   7.030
  170   2HB   ASN  24          HB2       ASN  24   6.826  -4.999   8.259
  171   1HD2  ASN  24          1HD2      ASN  24   5.532  -8.056   7.817
  172   2HD2  ASN  24          2HD2      ASN  24   4.723  -8.220   9.366
  173    H    GLY  25           H        GLY  25   4.179  -2.258   6.597
  174   1HA   GLY  25          HA1       GLY  25   5.254  -0.281   6.044
  175   2HA   GLY  25          HA2       GLY  25   6.540  -1.106   5.466
  176    H    TYR  26           H        TYR  26   3.927  -2.765   4.312
  177    HA   TYR  26           HA       TYR  26   4.589  -1.567   1.670
  178   1HB   TYR  26          HB1       TYR  26   4.982  -4.223   2.824
  179   2HB   TYR  26          HB2       TYR  26   4.216  -4.248   1.225
  180    HD1  TYR  26           HD1      TYR  26   7.252  -3.259   3.112
  181    HD2  TYR  26           HD2      TYR  26   5.345  -3.325  -0.752
  182    HE1  TYR  26           HE1      TYR  26   9.373  -2.536   2.045
  183    HE2  TYR  26           HE2      TYR  26   7.460  -2.635  -1.816
  184    HH   TYR  26           HH       TYR  26   9.645  -2.001  -1.477
  185    H    CYS  27           H        CYS  27   3.055  -1.016   0.359
  186    HA   CYS  27           HA       CYS  27   0.213  -1.685   0.928
  187   1HB   CYS  27          HB1       CYS  27   0.470   0.537   1.077
  188   2HB   CYS  27          HB2       CYS  27   1.685   0.686  -0.177
  189    H    GLN  28           H        GLN  28   0.903  -3.755   0.145
  190    HA   GLN  28           HA       GLN  28   1.288  -4.511  -2.518
  191   1HB   GLN  28          HB1       GLN  28   0.018  -6.558  -1.896
  192   2HB   GLN  28          HB2       GLN  28   1.246  -6.099  -0.691
  193   1HG   GLN  28          HG1       GLN  28  -0.519  -5.012   0.668
  194   2HG   GLN  28          HG2       GLN  28  -1.747  -5.507  -0.511
  195   1HE2  GLN  28          1HE2      GLN  28  -2.268  -6.198   1.953
  196   2HE2  GLN  28          2HE2      GLN  28  -2.036  -7.925   2.210
  197    H    GLY  29           H        GLY  29  -0.098  -4.858  -4.310
  198   1HA   GLY  29          HA1       GLY  29  -2.148  -5.251  -5.248
  199   2HA   GLY  29          HA2       GLY  29  -2.917  -4.611  -3.957
  200    H    CYS  30           H        CYS  30  -1.701  -2.149  -3.820
  201    HA   CYS  30           HA       CYS  30  -3.350  -0.473  -4.752
  202   1HB   CYS  30          HB1       CYS  30  -1.297   0.217  -3.628
  203   2HB   CYS  30          HB2       CYS  30  -0.377   0.015  -5.129
  204    H    THR  31           H        THR  31  -0.662  -1.253  -6.949
  205    HA   THR  31           HA       THR  31  -1.547  -0.078  -9.343
  206    HB   THR  31           HB       THR  31   0.652  -1.073  -9.034
  207    HG1  THR  31           HG1      THR  31   0.726  -2.084 -11.060
  208   1HG2  THR  31          1HG2      THR  31  -0.788  -3.755  -9.165
  209   2HG2  THR  31          2HG2      THR  31   0.968  -3.511  -9.139
  210   3HG2  THR  31          3HG2      THR  31  -0.006  -3.087  -7.721
  Start of MODEL    6
    1   1H    THR   1           H        THR   1   7.894  -5.901  -7.580
    2    HA   THR   1           HA       THR   1  10.652  -5.771  -7.787
    3    HB   THR   1           HB       THR   1  10.093  -4.737 -10.011
    4    HG1  THR   1           HG1      THR   1  12.016  -4.132  -9.174
    5   1HG2  THR   1          1HG2      THR   1   9.199  -2.476 -10.138
    6   2HG2  THR   1          2HG2      THR   1   8.011  -3.552  -9.384
    7   3HG2  THR   1          3HG2      THR   1   8.952  -2.419  -8.386
    8    HA   PRO   2           HA       PRO   2   9.847  -3.740  -4.064
    9   1HB   PRO   2          HB1       PRO   2  12.069  -1.792  -4.316
   10   2HB   PRO   2          HB2       PRO   2  11.664  -2.855  -2.975
   11   1HG   PRO   2          HG1       PRO   2  13.580  -3.594  -4.746
   12   2HG   PRO   2          HG2       PRO   2  12.369  -4.841  -4.197
   13   1HD   PRO   2          HD1       PRO   2  12.218  -2.988  -6.599
   14   2HD   PRO   2          HD2       PRO   2  12.277  -4.674  -6.746
   15    H    TYR   3           H        TYR   3   7.702  -2.813  -5.058
   16    HA   TYR   3           HA       TYR   3   7.314  -0.431  -6.149
   17   1HB   TYR   3          HB1       TYR   3   5.585  -1.547  -3.917
   18   2HB   TYR   3          HB2       TYR   3   5.128  -0.676  -5.399
   19    HD1  TYR   3           HD1      TYR   3   5.709  -1.826  -7.677
   20    HD2  TYR   3           HD2      TYR   3   5.338  -3.882  -3.905
   21    HE1  TYR   3           HE1      TYR   3   5.635  -3.992  -8.866
   22    HE2  TYR   3           HE2      TYR   3   5.301  -6.053  -5.099
   23    HH   TYR   3           HH       TYR   3   5.788  -6.281  -8.630
   24    HA   PRO   4           HA       PRO   4   8.518   2.241  -2.579
   25   1HB   PRO   4          HB1       PRO   4   8.452   4.666  -3.778
   26   2HB   PRO   4          HB2       PRO   4   9.750   3.478  -4.136
   27   1HG   PRO   4          HG1       PRO   4   7.218   3.972  -5.725
   28   2HG   PRO   4          HG2       PRO   4   8.902   3.933  -6.344
   29   1HD   PRO   4          HD1       PRO   4   7.236   1.746  -6.439
   30   2HD   PRO   4          HD2       PRO   4   8.991   1.569  -6.147
   31    H    VAL   5           H        VAL   5   5.691   1.131  -3.109
   32    HA   VAL   5           HA       VAL   5   3.852   3.335  -2.775
   33    HB   VAL   5           HB       VAL   5   3.947   0.441  -3.682
   34   1HG1  VAL   5          1HG1      VAL   5   1.722   1.948  -2.604
   35   2HG1  VAL   5          2HG1      VAL   5   1.414   0.729  -3.939
   36   3HG1  VAL   5          3HG1      VAL   5   2.369   0.273  -2.483
   37   1HG2  VAL   5          1HG2      VAL   5   4.389   2.185  -5.480
   38   2HG2  VAL   5          2HG2      VAL   5   2.879   1.310  -5.776
   39   3HG2  VAL   5          3HG2      VAL   5   2.833   2.945  -5.082
   40    H    ASN   6           H        ASN   6   3.625   3.569  -0.520
   41    HA   ASN   6           HA       ASN   6   4.700   1.490   1.239
   42   1HB   ASN   6          HB1       ASN   6   4.941   4.413   0.714
   43   2HB   ASN   6          HB2       ASN   6   4.879   3.936   2.377
   44   1HD2  ASN   6          1HD2      ASN   6   6.715   3.832  -0.675
   45   2HD2  ASN   6          2HD2      ASN   6   8.206   3.257   0.053
   46    H    CYS   7           H        CYS   7   4.073   2.170   3.410
   47    HA   CYS   7           HA       CYS   7   1.723   3.539   4.125
   48   1HB   CYS   7          HB1       CYS   7   0.289   1.554   4.775
   49   2HB   CYS   7          HB2       CYS   7   0.391   1.971   3.044
   50    H    LYS   8           H        LYS   8   1.349   3.682   6.223
   51    HA   LYS   8           HA       LYS   8   3.034   2.348   8.248
   52   1HB   LYS   8          HB1       LYS   8   0.818   4.424   8.271
   53   2HB   LYS   8          HB2       LYS   8   1.483   3.674   9.755
   54   1HG   LYS   8          HG1       LYS   8   3.159   5.104   9.768
   55   2HG   LYS   8          HG2       LYS   8   3.727   4.559   8.201
   56   1HD   LYS   8          HD1       LYS   8   1.460   6.573   8.373
   57   2HD   LYS   8          HD2       LYS   8   3.153   7.097   8.621
   58   1HE   LYS   8          HE1       LYS   8   3.807   6.441   6.450
   59   2HE   LYS   8          HE2       LYS   8   2.329   5.468   6.209
   60   1HZ   LYS   8          HZ1       LYS   8   1.060   7.516   6.195
   61   2HZ   LYS   8          HZ2       LYS   8   2.492   8.392   6.080
   62   3HZ   LYS   8          HZ3       LYS   8   1.991   7.231   4.969
   63    H    THR   9           H        THR   9  -0.295   2.333   6.893
   64    HA   THR   9           HA       THR   9  -0.664  -0.404   7.354
   65    HB   THR   9           HB       THR   9  -1.068   0.237   9.713
   66    HG1  THR   9           HG1      THR   9  -2.319  -1.426   8.952
   67   1HG2  THR   9          1HG2      THR   9  -2.948   1.657  10.344
   68   2HG2  THR   9          2HG2      THR   9  -1.794   2.594   9.381
   69   3HG2  THR   9          3HG2      THR   9  -3.307   2.013   8.647
   70    H    ASP  10           H        ASP  10  -3.288  -0.656   6.990
   71    HA   ASP  10           HA       ASP  10  -3.842  -0.205   4.307
   72   1HB   ASP  10          HB1       ASP  10  -5.633  -0.340   6.825
   73   2HB   ASP  10          HB2       ASP  10  -6.275  -0.478   5.186
   74    H    ARG  11           H        ARG  11  -4.919   1.877   6.883
   75    HA   ARG  11           HA       ARG  11  -6.374   3.667   5.349
   76   1HB   ARG  11          HB1       ARG  11  -6.177   3.903   7.814
   77   2HB   ARG  11          HB2       ARG  11  -4.423   4.106   7.718
   78   1HG   ARG  11          HG1       ARG  11  -6.140   6.091   6.274
   79   2HG   ARG  11          HG2       ARG  11  -6.105   6.130   8.061
   80   1HD   ARG  11          HD1       ARG  11  -3.772   6.603   8.106
   81   2HD   ARG  11          HD2       ARG  11  -3.545   6.218   6.405
   82    HE   ARG  11           HE       ARG  11  -5.361   8.419   7.169
   83   1HH1  ARG  11          2HH2      ARG  11  -2.052   7.691   5.752
   84   2HH1  ARG  11          1HH2      ARG  11  -2.142   9.078   4.768
   85   1HH2  ARG  11          1HH1      ARG  11  -5.245  10.298   5.920
   86   2HH2  ARG  11          2HH1      ARG  11  -3.845  10.641   4.958
   87    H    ASP  12           H        ASP  12  -2.836   3.415   5.426
   88    HA   ASP  12           HA       ASP  12  -2.665   6.027   4.236
   89   1HB   ASP  12          HB1       ASP  12  -1.129   4.571   5.863
   90   2HB   ASP  12          HB2       ASP  12  -0.496   3.948   4.369
   91    H    CYS  13           H        CYS  13  -3.577   3.062   2.996
   92    HA   CYS  13           HA       CYS  13  -3.084   4.077   0.201
   93   1HB   CYS  13          HB1       CYS  13  -2.327   1.574   1.554
   94   2HB   CYS  13          HB2       CYS  13  -3.184   1.273   0.024
   95    H    VAL  14           H        VAL  14  -5.374   3.462   2.331
   96    HA   VAL  14           HA       VAL  14  -7.431   2.307   0.940
   97    HB   VAL  14           HB       VAL  14  -7.465   3.554   3.068
   98   1HG1  VAL  14          1HG1      VAL  14  -7.206   5.809   3.256
   99   2HG1  VAL  14          2HG1      VAL  14  -6.027   5.306   2.006
  100   3HG1  VAL  14          3HG1      VAL  14  -7.552   6.102   1.533
  101   1HG2  VAL  14          1HG2      VAL  14  -9.603   4.617   1.157
  102   2HG2  VAL  14          2HG2      VAL  14  -9.724   3.181   2.199
  103   3HG2  VAL  14          3HG2      VAL  14  -9.643   4.792   2.924
  104    H    MET  15           H        MET  15  -5.996   5.313   0.184
  105    HA   MET  15           HA       MET  15  -7.741   6.366  -1.771
  106   1HB   MET  15          HB1       MET  15  -5.863   7.769  -2.449
  107   2HB   MET  15          HB2       MET  15  -5.985   7.675  -0.681
  108   1HG   MET  15          HG1       MET  15  -4.184   5.996  -0.644
  109   2HG   MET  15          HG2       MET  15  -4.071   6.073  -2.410
  110   1HE   MET  15          HE1       MET  15  -1.495   6.419  -2.338
  111   2HE   MET  15          HE2       MET  15  -0.697   7.657  -1.340
  112   3HE   MET  15          HE3       MET  15  -1.552   6.307  -0.563
  113    H    CYS  16           H        CYS  16  -5.480   3.779  -1.995
  114    HA   CYS  16           HA       CYS  16  -5.139   3.835  -4.892
  115   1HB   CYS  16          HB1       CYS  16  -4.389   1.879  -2.723
  116   2HB   CYS  16          HB2       CYS  16  -4.009   1.631  -4.491
  117    H    GLY  17           H        GLY  17  -7.783   2.857  -2.927
  118   1HA   GLY  17          HA1       GLY  17  -9.294   2.195  -5.051
  119   2HA   GLY  17          HA2       GLY  17  -8.711   0.749  -4.564
  120    H    LEU  18           H        LEU  18  -9.407  -0.256  -2.653
  121    HA   LEU  18           HA       LEU  18 -11.798   0.951  -1.334
  122   1HB   LEU  18          HB1       LEU  18 -12.255  -0.920  -2.488
  123   2HB   LEU  18          HB2       LEU  18 -11.024  -1.847  -1.644
  124    HG   LEU  18           HG       LEU  18 -12.120  -1.632   0.401
  125   1HD1  LEU  18          1HD1      LEU  18 -14.145  -0.279   0.917
  126   2HD1  LEU  18          2HD1      LEU  18 -12.717   0.726   0.708
  127   3HD1  LEU  18          3HD1      LEU  18 -13.927   0.611  -0.598
  128   1HD2  LEU  18          1HD2      LEU  18 -13.199  -2.938  -1.385
  129   2HD2  LEU  18          2HD2      LEU  18 -14.444  -2.359  -0.223
  130   3HD2  LEU  18          3HD2      LEU  18 -14.159  -1.459  -1.760
  131    H    GLY  19           H        GLY  19 -10.152  -1.660   0.104
  132   1HA   GLY  19          HA1       GLY  19  -9.064  -0.141   2.259
  133   2HA   GLY  19          HA2       GLY  19  -9.026  -1.767   2.105
  134    H    ILE  20           H        ILE  20  -7.795  -2.120  -0.303
  135    HA   ILE  20           HA       ILE  20  -5.730  -2.769  -0.885
  136    HB   ILE  20           HB       ILE  20  -5.006   0.189  -0.621
  137   1HG1  ILE  20          1HG1      ILE  20  -6.941   0.235  -1.898
  138   2HG1  ILE  20          2HG1      ILE  20  -5.608   0.182  -3.082
  139   1HG2  ILE  20          1HG2      ILE  20  -3.428  -0.263  -2.310
  140   2HG2  ILE  20          2HG2      ILE  20  -3.103  -1.303  -0.934
  141   3HG2  ILE  20          3HG2      ILE  20  -3.888  -1.988  -2.373
  142   1HD1  ILE  20          1HD1      ILE  20  -5.979  -2.264  -3.325
  143   2HD1  ILE  20          2HD1      ILE  20  -7.463  -2.086  -2.361
  144   3HD1  ILE  20          3HD1      ILE  20  -7.301  -1.222  -3.894
  145    H    SER  21           H        SER  21  -5.945  -3.952   1.182
  146    HA   SER  21           HA       SER  21  -4.958  -2.878   3.518
  147   1HB   SER  21          HB1       SER  21  -5.143  -5.423   4.185
  148   2HB   SER  21          HB2       SER  21  -6.612  -4.548   3.677
  149    HG   SER  21           HG       SER  21  -4.928  -6.005   1.903
  150    H    CYS  22           H        CYS  22  -3.080  -3.179   4.721
  151    HA   CYS  22           HA       CYS  22  -0.963  -3.205   2.700
  152   1HB   CYS  22          HB1       CYS  22  -2.000  -1.406   4.625
  153   2HB   CYS  22          HB2       CYS  22  -0.305  -1.571   5.052
  154    H    LYS  23           H        LYS  23   1.372  -3.247   3.472
  155    HA   LYS  23           HA       LYS  23   1.750  -5.717   5.083
  156   1HB   LYS  23          HB1       LYS  23   2.968  -4.990   2.503
  157   2HB   LYS  23          HB2       LYS  23   3.671  -6.172   3.629
  158   1HG   LYS  23          HG1       LYS  23   0.715  -6.241   2.915
  159   2HG   LYS  23          HG2       LYS  23   2.012  -6.983   1.930
  160   1HD   LYS  23          HD1       LYS  23   2.090  -8.795   3.188
  161   2HD   LYS  23          HD2       LYS  23   2.257  -7.833   4.671
  162   1HE   LYS  23          HE1       LYS  23   0.294  -9.219   4.857
  163   2HE   LYS  23          HE2       LYS  23  -0.222  -7.532   4.725
  164   1HZ   LYS  23          HZ1       LYS  23  -0.250  -9.536   2.556
  165   2HZ   LYS  23          HZ2       LYS  23  -1.557  -8.943   3.356
  166   3HZ   LYS  23          HZ3       LYS  23  -0.695  -7.975   2.360
  167    H    ASN  24           H        ASN  24   4.134  -5.632   5.867
  168    HA   ASN  24           HA       ASN  24   4.403  -3.632   7.723
  169   1HB   ASN  24          HB1       ASN  24   6.445  -5.557   6.957
  170   2HB   ASN  24          HB2       ASN  24   6.374  -4.658   8.450
  171   1HD2  ASN  24          1HD2      ASN  24   5.169  -5.631  10.151
  172   2HD2  ASN  24          2HD2      ASN  24   4.110  -7.007   9.906
  173    H    GLY  25           H        GLY  25   4.270  -1.826   6.057
  174   1HA   GLY  25          HA1       GLY  25   5.588   0.174   5.965
  175   2HA   GLY  25          HA2       GLY  25   6.838  -0.721   5.413
  176    H    TYR  26           H        TYR  26   4.578  -2.286   3.832
  177    HA   TYR  26           HA       TYR  26   5.156  -0.650   1.395
  178   1HB   TYR  26          HB1       TYR  26   5.827  -3.430   2.188
  179   2HB   TYR  26          HB2       TYR  26   5.073  -3.275   0.591
  180    HD1  TYR  26           HD1      TYR  26   6.509  -3.071  -1.229
  181    HD2  TYR  26           HD2      TYR  26   7.759  -1.530   2.603
  182    HE1  TYR  26           HE1      TYR  26   8.704  -2.460  -2.182
  183    HE2  TYR  26           HE2      TYR  26   9.925  -0.856   1.623
  184    HH   TYR  26           HH       TYR  26  11.230  -0.805  -0.279
  185    H    CYS  27           H        CYS  27   3.483  -0.647  -0.213
  186    HA   CYS  27           HA       CYS  27   0.892  -1.778   0.789
  187   1HB   CYS  27          HB1       CYS  27   0.668   0.493   0.980
  188   2HB   CYS  27          HB2       CYS  27   1.593   0.872  -0.462
  189    H    GLN  28           H        GLN  28  -0.495  -2.611  -0.803
  190    HA   GLN  28           HA       GLN  28   1.098  -3.967  -2.928
  191   1HB   GLN  28          HB1       GLN  28   0.225  -6.107  -1.967
  192   2HB   GLN  28          HB2       GLN  28   1.528  -5.257  -1.083
  193   1HG   GLN  28          HG1       GLN  28   0.327  -5.289   0.767
  194   2HG   GLN  28          HG2       GLN  28  -0.975  -4.369   0.010
  195   1HE2  GLN  28          1HE2      GLN  28  -2.436  -5.716  -1.492
  196   2HE2  GLN  28          2HE2      GLN  28  -2.939  -7.279  -0.850
  197    H    GLY  29           H        GLY  29   0.029  -3.726  -4.753
  198   1HA   GLY  29          HA1       GLY  29  -1.643  -4.071  -6.231
  199   2HA   GLY  29          HA2       GLY  29  -2.526  -4.821  -5.079
  200    H    CYS  30           H        CYS  30  -1.344  -1.615  -5.491
  201    HA   CYS  30           HA       CYS  30  -3.678  -0.339  -4.591
  202   1HB   CYS  30          HB1       CYS  30  -1.102   0.430  -5.863
  203   2HB   CYS  30          HB2       CYS  30  -2.298   1.686  -6.006
  204    H    THR  31           H        THR  31  -5.096  -1.716  -6.046
  205    HA   THR  31           HA       THR  31  -5.265  -1.126  -8.844
  206    HB   THR  31           HB       THR  31  -6.084  -3.206  -7.977
  207    HG1  THR  31           HG1      THR  31  -8.056  -1.519  -9.092
  208   1HG2  THR  31          1HG2      THR  31  -6.925  -2.589  -5.799
  209   2HG2  THR  31          2HG2      THR  31  -8.167  -1.538  -6.519
  210   3HG2  THR  31          3HG2      THR  31  -8.242  -3.299  -6.741
  Start of MODEL    7
    1   1H    THR   1           H        THR   1  11.808   0.883 -12.689
    2    HA   THR   1           HA       THR   1   9.479  -0.173 -12.334
    3    HB   THR   1           HB       THR   1  11.900  -1.909 -11.787
    4    HG1  THR   1           HG1      THR   1  12.353  -1.647 -14.021
    5   1HG2  THR   1          1HG2      THR   1  10.793  -3.381 -13.404
    6   2HG2  THR   1          2HG2      THR   1   9.670  -2.974 -12.092
    7   3HG2  THR   1          3HG2      THR   1   9.518  -2.174 -13.672
    8    HA   PRO   2           HA       PRO   2  10.249  -1.820  -8.008
    9   1HB   PRO   2          HB1       PRO   2  12.430  -0.332  -6.696
   10   2HB   PRO   2          HB2       PRO   2  12.077  -2.054  -6.663
   11   1HG   PRO   2          HG1       PRO   2  14.053  -1.072  -8.266
   12   2HG   PRO   2          HG2       PRO   2  12.963  -2.392  -8.894
   13   1HD   PRO   2          HD1       PRO   2  12.586   0.615  -9.103
   14   2HD   PRO   2          HD2       PRO   2  12.836  -0.358 -10.459
   15    H    TYR   3           H        TYR   3   8.231  -0.171  -8.419
   16    HA   TYR   3           HA       TYR   3   8.089   2.293  -7.325
   17   1HB   TYR   3          HB1       TYR   3   5.843   0.272  -7.233
   18   2HB   TYR   3          HB2       TYR   3   5.834   2.022  -7.562
   19    HD1  TYR   3           HD1      TYR   3   7.447   2.661  -9.694
   20    HD2  TYR   3           HD2      TYR   3   5.287  -1.026  -9.094
   21    HE1  TYR   3           HE1      TYR   3   7.651   2.148 -12.101
   22    HE2  TYR   3           HE2      TYR   3   5.465  -1.517 -11.515
   23    HH   TYR   3           HH       TYR   3   7.221   0.623 -13.773
   24    HA   PRO   4           HA       PRO   4   8.490   0.880  -3.015
   25   1HB   PRO   4          HB1       PRO   4   8.961   3.224  -1.762
   26   2HB   PRO   4          HB2       PRO   4  10.147   2.530  -2.923
   27   1HG   PRO   4          HG1       PRO   4   8.038   4.637  -3.487
   28   2HG   PRO   4          HG2       PRO   4   9.794   4.729  -3.848
   29   1HD   PRO   4          HD1       PRO   4   7.942   3.913  -5.710
   30   2HD   PRO   4          HD2       PRO   4   9.581   3.200  -5.635
   31    H    VAL   5           H        VAL   5   5.902   0.544  -3.819
   32    HA   VAL   5           HA       VAL   5   4.162   2.357  -2.711
   33    HB   VAL   5           HB       VAL   5   2.901  -0.162  -2.780
   34   1HG1  VAL   5          1HG1      VAL   5   2.244   2.162  -3.398
   35   2HG1  VAL   5          2HG1      VAL   5   3.207   1.915  -4.911
   36   3HG1  VAL   5          3HG1      VAL   5   1.705   0.944  -4.605
   37   1HG2  VAL   5          1HG2      VAL   5   4.590  -0.006  -5.274
   38   2HG2  VAL   5          2HG2      VAL   5   4.781  -1.215  -3.973
   39   3HG2  VAL   5          3HG2      VAL   5   3.284  -1.140  -4.915
   40    H    ASN   6           H        ASN   6   4.169   2.858  -0.770
   41    HA   ASN   6           HA       ASN   6   4.744   0.975   1.405
   42   1HB   ASN   6          HB1       ASN   6   5.433   3.742   0.472
   43   2HB   ASN   6          HB2       ASN   6   5.395   3.410   2.169
   44   1HD2  ASN   6          1HD2      ASN   6   7.776   4.127   1.848
   45   2HD2  ASN   6          2HD2      ASN   6   8.913   2.865   1.403
   46    H    CYS   7           H        CYS   7   4.174   2.029   3.397
   47    HA   CYS   7           HA       CYS   7   1.952   3.749   3.888
   48   1HB   CYS   7          HB1       CYS   7   0.403   1.837   4.670
   49   2HB   CYS   7          HB2       CYS   7   0.504   2.248   2.924
   50    H    LYS   8           H        LYS   8   1.190   3.651   6.111
   51    HA   LYS   8           HA       LYS   8   2.933   2.276   8.087
   52   1HB   LYS   8          HB1       LYS   8   0.801   4.447   8.202
   53   2HB   LYS   8          HB2       LYS   8   1.447   3.614   9.653
   54   1HG   LYS   8          HG1       LYS   8   3.204   4.942   9.690
   55   2HG   LYS   8          HG2       LYS   8   3.705   4.473   8.080
   56   1HD   LYS   8          HD1       LYS   8   1.536   6.575   8.461
   57   2HD   LYS   8          HD2       LYS   8   3.262   7.000   8.663
   58   1HE   LYS   8          HE1       LYS   8   3.795   6.412   6.434
   59   2HE   LYS   8          HE2       LYS   8   2.250   5.544   6.213
   60   1HZ   LYS   8          HZ1       LYS   8   1.105   7.638   6.312
   61   2HZ   LYS   8          HZ2       LYS   8   2.571   8.464   6.254
   62   3HZ   LYS   8          HZ3       LYS   8   2.025   7.404   5.066
   63    H    THR   9           H        THR   9  -0.440   2.541   6.840
   64    HA   THR   9           HA       THR   9  -0.830  -0.236   7.143
   65    HB   THR   9           HB       THR   9  -1.305   0.413   9.507
   66    HG1  THR   9           HG1      THR   9  -2.363  -1.344   8.793
   67   1HG2  THR   9          1HG2      THR   9  -3.680   1.958   8.373
   68   2HG2  THR   9          2HG2      THR   9  -3.288   1.685  10.074
   69   3HG2  THR   9          3HG2      THR   9  -2.228   2.706   9.084
   70    H    ASP  10           H        ASP  10  -3.606  -0.262   6.824
   71    HA   ASP  10           HA       ASP  10  -3.775   0.100   4.020
   72   1HB   ASP  10          HB1       ASP  10  -5.829  -1.000   4.419
   73   2HB   ASP  10          HB2       ASP  10  -5.112  -1.263   6.033
   74    H    ARG  11           H        ARG  11  -5.132   1.997   6.534
   75    HA   ARG  11           HA       ARG  11  -6.377   3.958   5.073
   76   1HB   ARG  11          HB1       ARG  11  -6.299   4.020   7.557
   77   2HB   ARG  11          HB2       ARG  11  -4.544   4.207   7.564
   78   1HG   ARG  11          HG1       ARG  11  -6.181   6.299   6.177
   79   2HG   ARG  11          HG2       ARG  11  -6.208   6.227   7.960
   80   1HD   ARG  11          HD1       ARG  11  -3.893   6.710   8.125
   81   2HD   ARG  11          HD2       ARG  11  -3.575   6.357   6.432
   82    HE   ARG  11           HE       ARG  11  -5.407   8.559   7.147
   83   1HH1  ARG  11          2HH2      ARG  11  -2.038   7.828   5.855
   84   2HH1  ARG  11          1HH2      ARG  11  -2.080   9.239   4.906
   85   1HH2  ARG  11          1HH1      ARG  11  -5.233  10.443   5.921
   86   2HH2  ARG  11          2HH1      ARG  11  -3.790  10.799   5.033
   87    H    ASP  12           H        ASP  12  -2.860   3.595   5.297
   88    HA   ASP  12           HA       ASP  12  -2.577   6.279   4.260
   89   1HB   ASP  12          HB1       ASP  12  -1.112   4.729   5.838
   90   2HB   ASP  12          HB2       ASP  12  -0.461   4.151   4.332
   91    H    CYS  13           H        CYS  13  -3.480   3.386   2.853
   92    HA   CYS  13           HA       CYS  13  -2.943   4.451   0.099
   93   1HB   CYS  13          HB1       CYS  13  -2.235   1.917   1.419
   94   2HB   CYS  13          HB2       CYS  13  -2.980   1.686  -0.181
   95    H    VAL  14           H        VAL  14  -5.272   3.859   2.204
   96    HA   VAL  14           HA       VAL  14  -7.302   2.712   0.857
   97    HB   VAL  14           HB       VAL  14  -7.407   4.031   2.866
   98   1HG1  VAL  14          1HG1      VAL  14  -7.040   6.262   3.026
   99   2HG1  VAL  14          2HG1      VAL  14  -5.833   5.712   1.829
  100   3HG1  VAL  14          3HG1      VAL  14  -7.306   6.549   1.282
  101   1HG2  VAL  14          1HG2      VAL  14  -9.602   3.687   1.732
  102   2HG2  VAL  14          2HG2      VAL  14  -9.561   5.215   2.637
  103   3HG2  VAL  14          3HG2      VAL  14  -9.391   5.226   0.869
  104    H    MET  15           H        MET  15  -5.827   5.653  -0.053
  105    HA   MET  15           HA       MET  15  -7.454   6.587  -2.162
  106   1HB   MET  15          HB1       MET  15  -5.514   7.897  -2.863
  107   2HB   MET  15          HB2       MET  15  -5.737   7.938  -1.104
  108   1HG   MET  15          HG1       MET  15  -3.980   6.216  -0.857
  109   2HG   MET  15          HG2       MET  15  -3.773   6.184  -2.618
  110   1HE   MET  15          HE1       MET  15  -4.110   9.240  -0.059
  111   2HE   MET  15          HE2       MET  15  -3.047   8.028   0.707
  112   3HE   MET  15          HE3       MET  15  -2.380   9.584   0.159
  113    H    CYS  16           H        CYS  16  -5.267   3.940  -2.115
  114    HA   CYS  16           HA       CYS  16  -4.792   3.691  -4.969
  115   1HB   CYS  16          HB1       CYS  16  -4.382   1.887  -2.602
  116   2HB   CYS  16          HB2       CYS  16  -4.106   1.311  -4.286
  117    H    GLY  17           H        GLY  17  -7.555   2.845  -2.908
  118   1HA   GLY  17          HA1       GLY  17  -9.182   2.436  -5.005
  119   2HA   GLY  17          HA2       GLY  17  -8.622   0.931  -4.707
  120    H    LEU  18           H        LEU  18  -9.242  -0.250  -2.862
  121    HA   LEU  18           HA       LEU  18 -11.479   0.871  -1.279
  122   1HB   LEU  18          HB1       LEU  18 -11.339  -1.472  -2.546
  123   2HB   LEU  18          HB2       LEU  18 -10.406  -2.004  -1.191
  124    HG   LEU  18           HG       LEU  18 -12.970  -0.519  -0.807
  125   1HD1  LEU  18          1HD1      LEU  18 -13.486  -2.272  -2.509
  126   2HD1  LEU  18          2HD1      LEU  18 -12.832  -3.510  -1.410
  127   3HD1  LEU  18          3HD1      LEU  18 -14.312  -2.624  -0.987
  128   1HD2  LEU  18          1HD2      LEU  18 -12.203  -0.841   1.265
  129   2HD2  LEU  18          2HD2      LEU  18 -13.442  -2.072   1.090
  130   3HD2  LEU  18          3HD2      LEU  18 -11.740  -2.561   0.975
  131    H    GLY  19           H        GLY  19 -10.470  -1.092   0.632
  132   1HA   GLY  19          HA1       GLY  19  -8.987   0.474   2.404
  133   2HA   GLY  19          HA2       GLY  19  -9.069  -1.154   2.502
  134    H    ILE  20           H        ILE  20  -7.872  -1.826   0.046
  135    HA   ILE  20           HA       ILE  20  -5.858  -2.642  -0.496
  136    HB   ILE  20           HB       ILE  20  -5.024   0.304  -0.451
  137   1HG1  ILE  20          1HG1      ILE  20  -6.896   0.262  -1.824
  138   2HG1  ILE  20          2HG1      ILE  20  -5.528   0.003  -2.946
  139   1HG2  ILE  20          1HG2      ILE  20  -3.444  -0.383  -2.140
  140   2HG2  ILE  20          2HG2      ILE  20  -3.112  -1.166  -0.600
  141   3HG2  ILE  20          3HG2      ILE  20  -3.910  -2.089  -1.896
  142   1HD1  ILE  20          1HD1      ILE  20  -5.979  -2.420  -2.912
  143   2HD1  ILE  20          2HD1      ILE  20  -7.485  -2.080  -2.024
  144   3HD1  ILE  20          3HD1      ILE  20  -7.245  -1.417  -3.647
  145    H    SER  21           H        SER  21  -6.192  -3.683   1.580
  146    HA   SER  21           HA       SER  21  -5.118  -3.150   3.954
  147   1HB   SER  21          HB1       SER  21  -4.918  -5.925   2.840
  148   2HB   SER  21          HB2       SER  21  -5.582  -5.362   4.388
  149    HG   SER  21           HG       SER  21  -7.263  -5.952   2.949
  150    H    CYS  22           H        CYS  22  -3.138  -2.774   4.687
  151    HA   CYS  22           HA       CYS  22  -0.950  -3.005   2.785
  152   1HB   CYS  22          HB1       CYS  22  -1.966  -1.151   4.714
  153   2HB   CYS  22          HB2       CYS  22  -0.251  -1.294   5.027
  154    H    LYS  23           H        LYS  23   0.804  -4.174   2.970
  155    HA   LYS  23           HA       LYS  23   1.141  -6.143   5.101
  156   1HB   LYS  23          HB1       LYS  23   2.452  -5.579   2.508
  157   2HB   LYS  23          HB2       LYS  23   3.237  -6.637   3.689
  158   1HG   LYS  23          HG1       LYS  23   0.412  -7.267   3.607
  159   2HG   LYS  23          HG2       LYS  23   1.141  -7.222   1.975
  160   1HD   LYS  23          HD1       LYS  23   1.378  -9.474   2.740
  161   2HD   LYS  23          HD2       LYS  23   2.961  -8.697   2.828
  162   1HE   LYS  23          HE1       LYS  23   1.860  -8.196   5.351
  163   2HE   LYS  23          HE2       LYS  23   1.166  -9.782   4.960
  164   1HZ   LYS  23          HZ1       LYS  23   3.532 -10.468   4.517
  165   2HZ   LYS  23          HZ2       LYS  23   4.004  -9.035   5.215
  166   3HZ   LYS  23          HZ3       LYS  23   3.170 -10.131   6.087
  167    H    ASN  24           H        ASN  24   3.792  -6.170   5.466
  168    HA   ASN  24           HA       ASN  24   4.789  -4.682   7.412
  169   1HB   ASN  24          HB1       ASN  24   6.348  -5.745   5.195
  170   2HB   ASN  24          HB2       ASN  24   6.956  -5.344   6.779
  171   1HD2  ASN  24          1HD2      ASN  24   6.844  -6.997   8.348
  172   2HD2  ASN  24          2HD2      ASN  24   5.967  -8.491   8.136
  173    H    GLY  25           H        GLY  25   3.696  -2.592   6.665
  174   1HA   GLY  25          HA1       GLY  25   3.756  -0.479   6.081
  175   2HA   GLY  25          HA2       GLY  25   5.389  -0.481   6.102
  176    H    TYR  26           H        TYR  26   3.430  -2.509   4.107
  177    HA   TYR  26           HA       TYR  26   4.509  -1.170   1.683
  178   1HB   TYR  26          HB1       TYR  26   5.296  -3.711   2.724
  179   2HB   TYR  26          HB2       TYR  26   4.446  -3.959   1.190
  180    HD1  TYR  26           HD1      TYR  26   5.364  -3.175  -0.919
  181    HD2  TYR  26           HD2      TYR  26   7.277  -2.154   2.806
  182    HE1  TYR  26           HE1      TYR  26   7.193  -2.057  -2.161
  183    HE2  TYR  26           HE2      TYR  26   9.105  -1.054   1.563
  184    HH   TYR  26           HH       TYR  26   9.795  -0.292  -0.492
  185    H    CYS  27           H        CYS  27   3.099  -0.696   0.231
  186    HA   CYS  27           HA       CYS  27   0.282  -1.531   0.615
  187   1HB   CYS  27          HB1       CYS  27   0.598   0.727   0.765
  188   2HB   CYS  27          HB2       CYS  27   1.675   0.843  -0.616
  189    H    GLN  28           H        GLN  28   1.034  -3.605  -0.083
  190    HA   GLN  28           HA       GLN  28   1.308  -4.376  -2.784
  191   1HB   GLN  28          HB1       GLN  28   0.034  -6.431  -2.061
  192   2HB   GLN  28          HB2       GLN  28   1.458  -6.052  -1.075
  193   1HG   GLN  28          HG1       GLN  28   0.158  -5.273   0.726
  194   2HG   GLN  28          HG2       GLN  28  -1.295  -5.067  -0.272
  195   1HE2  GLN  28          1HE2      GLN  28  -2.322  -6.241   1.535
  196   2HE2  GLN  28          2HE2      GLN  28  -2.293  -8.007   1.482
  197    H    GLY  29           H        GLY  29  -0.289  -4.996  -4.381
  198   1HA   GLY  29          HA1       GLY  29  -2.390  -5.323  -5.161
  199   2HA   GLY  29          HA2       GLY  29  -3.036  -4.720  -3.788
  200    H    CYS  30           H        CYS  30  -1.672  -2.186  -3.934
  201    HA   CYS  30           HA       CYS  30  -3.452  -0.542  -4.694
  202   1HB   CYS  30          HB1       CYS  30  -1.259   0.172  -3.873
  203   2HB   CYS  30          HB2       CYS  30  -0.537  -0.153  -5.465
  204    H    THR  31           H        THR  31  -1.102  -1.604  -7.217
  205    HA   THR  31           HA       THR  31  -2.465  -0.380  -9.446
  206    HB   THR  31           HB       THR  31  -1.023  -2.090 -10.681
  207    HG1  THR  31           HG1      THR  31  -1.062  -3.604  -8.976
  208   1HG2  THR  31          1HG2      THR  31  -0.132   0.170 -10.145
  209   2HG2  THR  31          2HG2      THR  31   0.438  -0.426  -8.570
  210   3HG2  THR  31          3HG2      THR  31   1.130  -1.075 -10.067
  Start of MODEL    8
    1   1H    THR   1           H        THR   1  12.611  -1.461  -4.055
    2    HA   THR   1           HA       THR   1  13.490  -1.726  -6.417
    3    HB   THR   1           HB       THR   1  13.833  -4.619  -5.536
    4    HG1  THR   1           HG1      THR   1  15.337  -2.960  -4.708
    5   1HG2  THR   1          1HG2      THR   1  13.315  -4.324  -7.950
    6   2HG2  THR   1          2HG2      THR   1  14.628  -3.131  -8.076
    7   3HG2  THR   1          3HG2      THR   1  15.001  -4.823  -7.697
    8    HA   PRO   2           HA       PRO   2   9.357  -4.087  -6.215
    9   1HB   PRO   2          HB1       PRO   2   8.637  -4.097  -3.343
   10   2HB   PRO   2          HB2       PRO   2   8.310  -5.319  -4.565
   11   1HG   PRO   2          HG1       PRO   2  10.322  -5.653  -2.750
   12   2HG   PRO   2          HG2       PRO   2  10.570  -6.173  -4.482
   13   1HD   PRO   2          HD1       PRO   2  11.187  -3.485  -3.216
   14   2HD   PRO   2          HD2       PRO   2  12.389  -4.488  -3.853
   15    H    TYR   3           H        TYR   3   7.037  -2.876  -5.660
   16    HA   TYR   3           HA       TYR   3   7.163  -0.241  -6.093
   17   1HB   TYR   3          HB1       TYR   3   5.086  -1.647  -4.379
   18   2HB   TYR   3          HB2       TYR   3   4.906  -0.309  -5.545
   19    HD1  TYR   3           HD1      TYR   3   4.220  -3.692  -5.102
   20    HD2  TYR   3           HD2      TYR   3   5.606  -0.853  -8.040
   21    HE1  TYR   3           HE1      TYR   3   3.487  -5.206  -6.921
   22    HE2  TYR   3           HE2      TYR   3   4.835  -2.352  -9.849
   23    HH   TYR   3           HH       TYR   3   3.801  -4.348 -10.372
   24    HA   PRO   4           HA       PRO   4   8.452   1.004  -1.816
   25   1HB   PRO   4          HB1       PRO   4   9.145   3.571  -2.272
   26   2HB   PRO   4          HB2       PRO   4  10.142   2.216  -2.903
   27   1HG   PRO   4          HG1       PRO   4   8.016   3.783  -4.392
   28   2HG   PRO   4          HG2       PRO   4   9.703   3.466  -4.915
   29   1HD   PRO   4          HD1       PRO   4   7.577   1.913  -5.717
   30   2HD   PRO   4          HD2       PRO   4   9.194   1.211  -5.424
   31    H    VAL   5           H        VAL   5   5.676   0.592  -2.407
   32    HA   VAL   5           HA       VAL   5   4.222   3.095  -2.349
   33    HB   VAL   5           HB       VAL   5   3.915   0.183  -3.152
   34   1HG1  VAL   5          1HG1      VAL   5   2.185   0.285  -2.123
   35   2HG1  VAL   5          2HG1      VAL   5   1.898   2.070  -2.310
   36   3HG1  VAL   5          3HG1      VAL   5   1.569   0.903  -3.682
   37   1HG2  VAL   5          1HG2      VAL   5   3.221   1.257  -5.343
   38   2HG2  VAL   5          2HG2      VAL   5   3.317   2.859  -4.593
   39   3HG2  VAL   5          3HG2      VAL   5   4.799   1.925  -4.864
   40    H    ASN   6           H        ASN   6   3.985   3.591  -0.320
   41    HA   ASN   6           HA       ASN   6   4.196   1.500   1.759
   42   1HB   ASN   6          HB1       ASN   6   5.440   3.153   3.062
   43   2HB   ASN   6          HB2       ASN   6   6.127   2.755   1.479
   44   1HD2  ASN   6          1HD2      ASN   6   6.153   4.461  -0.198
   45   2HD2  ASN   6          2HD2      ASN   6   5.772   6.116   0.230
   46    H    CYS   7           H        CYS   7   3.699   2.071   3.781
   47    HA   CYS   7           HA       CYS   7   1.151   3.627   4.045
   48   1HB   CYS   7          HB1       CYS   7  -0.120   1.786   4.662
   49   2HB   CYS   7          HB2       CYS   7   0.885   1.210   3.297
   50    H    LYS   8           H        LYS   8   1.219   4.853   5.853
   51    HA   LYS   8           HA       LYS   8   2.876   4.208   8.200
   52   1HB   LYS   8          HB1       LYS   8   0.681   6.147   7.691
   53   2HB   LYS   8          HB2       LYS   8   1.315   5.755   9.338
   54   1HG   LYS   8          HG1       LYS   8   2.683   7.464   8.813
   55   2HG   LYS   8          HG2       LYS   8   3.696   6.169   8.270
   56   1HD   LYS   8          HD1       LYS   8   1.822   7.441   6.273
   57   2HD   LYS   8          HD2       LYS   8   3.222   8.394   6.849
   58   1HE   LYS   8          HE1       LYS   8   4.759   7.062   5.803
   59   2HE   LYS   8          HE2       LYS   8   3.769   5.598   5.892
   60   1HZ   LYS   8          HZ1       LYS   8   2.370   6.490   4.193
   61   2HZ   LYS   8          HZ2       LYS   8   3.300   7.830   4.037
   62   3HZ   LYS   8          HZ3       LYS   8   3.917   6.348   3.648
   63    H    THR   9           H        THR   9  -0.363   3.417   7.012
   64    HA   THR   9           HA       THR   9  -0.368   0.878   8.068
   65    HB   THR   9           HB       THR   9  -0.921   1.728  10.264
   66    HG1  THR   9           HG1      THR   9  -2.184  -0.084   9.511
   67   1HG2  THR   9          1HG2      THR   9  -3.234   3.230   8.986
   68   2HG2  THR   9          2HG2      THR   9  -2.880   3.122  10.718
   69   3HG2  THR   9          3HG2      THR   9  -1.765   3.993   9.654
   70    H    ASP  10           H        ASP  10  -2.958   0.137   7.629
   71    HA   ASP  10           HA       ASP  10  -3.116   0.150   4.856
   72   1HB   ASP  10          HB1       ASP  10  -5.314  -0.096   7.020
   73   2HB   ASP  10          HB2       ASP  10  -5.449  -0.761   5.410
   74    H    ARG  11           H        ARG  11  -5.164   2.075   6.907
   75    HA   ARG  11           HA       ARG  11  -6.515   3.336   4.769
   76   1HB   ARG  11          HB1       ARG  11  -6.918   5.299   6.228
   77   2HB   ARG  11          HB2       ARG  11  -7.467   3.700   6.813
   78   1HG   ARG  11          HG1       ARG  11  -6.592   4.999   8.627
   79   2HG   ARG  11          HG2       ARG  11  -5.606   3.562   8.293
   80   1HD   ARG  11          HD1       ARG  11  -4.380   5.726   8.935
   81   2HD   ARG  11          HD2       ARG  11  -3.813   4.884   7.481
   82    HE   ARG  11           HE       ARG  11  -5.791   6.919   6.881
   83   1HH1  ARG  11          2HH2      ARG  11  -2.397   6.586   7.793
   84   2HH1  ARG  11          1HH2      ARG  11  -1.807   7.531   6.445
   85   1HH2  ARG  11          1HH1      ARG  11  -4.992   8.462   5.285
   86   2HH2  ARG  11          2HH1      ARG  11  -3.288   8.816   5.247
   87    H    ASP  12           H        ASP  12  -3.195   3.740   5.494
   88    HA   ASP  12           HA       ASP  12  -2.967   6.400   4.376
   89   1HB   ASP  12          HB1       ASP  12  -1.464   5.016   6.010
   90   2HB   ASP  12          HB2       ASP  12  -0.867   4.263   4.539
   91    H    CYS  13           H        CYS  13  -3.366   3.184   3.045
   92    HA   CYS  13           HA       CYS  13  -2.858   4.280   0.296
   93   1HB   CYS  13          HB1       CYS  13  -2.888   1.519   1.495
   94   2HB   CYS  13          HB2       CYS  13  -2.678   1.835  -0.242
   95    H    VAL  14           H        VAL  14  -5.442   3.863   2.254
   96    HA   VAL  14           HA       VAL  14  -7.390   2.590   0.662
   97    HB   VAL  14           HB       VAL  14  -7.586   3.691   2.810
   98   1HG1  VAL  14          1HG1      VAL  14  -7.533   5.927   3.128
   99   2HG1  VAL  14          2HG1      VAL  14  -6.233   5.574   1.949
  100   3HG1  VAL  14          3HG1      VAL  14  -7.757   6.293   1.379
  101   1HG2  VAL  14          1HG2      VAL  14  -9.871   4.648   2.554
  102   2HG2  VAL  14          2HG2      VAL  14  -9.640   4.737   0.794
  103   3HG2  VAL  14          3HG2      VAL  14  -9.696   3.159   1.608
  104    H    MET  15           H        MET  15  -5.736   5.536   0.155
  105    HA   MET  15           HA       MET  15  -7.229   6.747  -1.930
  106   1HB   MET  15          HB1       MET  15  -5.191   7.939  -2.542
  107   2HB   MET  15          HB2       MET  15  -5.436   7.925  -0.784
  108   1HG   MET  15          HG1       MET  15  -3.788   6.136  -0.548
  109   2HG   MET  15          HG2       MET  15  -3.578   6.066  -2.306
  110   1HE   MET  15          HE1       MET  15  -0.985   6.185  -2.092
  111   2HE   MET  15          HE2       MET  15  -0.131   7.433  -1.154
  112   3HE   MET  15          HE3       MET  15  -1.140   6.232  -0.319
  113    H    CYS  16           H        CYS  16  -5.120   3.999  -2.015
  114    HA   CYS  16           HA       CYS  16  -4.727   3.869  -4.894
  115   1HB   CYS  16          HB1       CYS  16  -4.407   1.865  -2.660
  116   2HB   CYS  16          HB2       CYS  16  -4.007   1.513  -4.364
  117    H    GLY  17           H        GLY  17  -7.287   2.781  -2.646
  118   1HA   GLY  17          HA1       GLY  17  -9.222   2.333  -4.400
  119   2HA   GLY  17          HA2       GLY  17  -8.416   0.913  -4.440
  120    H    LEU  18           H        LEU  18 -10.939   0.713  -3.611
  121    HA   LEU  18           HA       LEU  18 -12.367   0.977  -1.614
  122   1HB   LEU  18          HB1       LEU  18 -12.626  -0.605  -3.115
  123   2HB   LEU  18          HB2       LEU  18 -11.354  -1.610  -2.430
  124    HG   LEU  18           HG       LEU  18 -12.504  -1.851  -0.417
  125   1HD1  LEU  18          1HD1      LEU  18 -13.507   0.311   0.209
  126   2HD1  LEU  18          2HD1      LEU  18 -14.566   0.259  -1.221
  127   3HD1  LEU  18          3HD1      LEU  18 -14.785  -0.892   0.107
  128   1HD2  LEU  18          1HD2      LEU  18 -13.223  -2.980  -2.444
  129   2HD2  LEU  18          2HD2      LEU  18 -14.643  -2.808  -1.345
  130   3HD2  LEU  18          3HD2      LEU  18 -14.394  -1.625  -2.688
  131    H    GLY  19           H        GLY  19 -10.303  -1.654  -0.807
  132   1HA   GLY  19          HA1       GLY  19  -9.701  -0.672   1.845
  133   2HA   GLY  19          HA2       GLY  19  -9.486  -2.204   1.321
  134    H    ILE  20           H        ILE  20  -7.876  -2.343  -0.611
  135    HA   ILE  20           HA       ILE  20  -5.696  -2.832  -0.692
  136    HB   ILE  20           HB       ILE  20  -5.328   0.183  -0.816
  137   1HG1  ILE  20          1HG1      ILE  20  -7.020  -0.381  -2.389
  138   2HG1  ILE  20          2HG1      ILE  20  -5.500  -0.120  -3.270
  139   1HG2  ILE  20          1HG2      ILE  20  -3.446  -0.509  -2.323
  140   2HG2  ILE  20          2HG2      ILE  20  -3.187  -0.884  -0.628
  141   3HG2  ILE  20          3HG2      ILE  20  -3.667  -2.179  -1.728
  142   1HD1  ILE  20          1HD1      ILE  20  -5.183  -2.592  -3.371
  143   2HD1  ILE  20          2HD1      ILE  20  -6.800  -2.785  -2.650
  144   3HD1  ILE  20          3HD1      ILE  20  -6.620  -2.001  -4.228
  145    H    SER  21           H        SER  21  -6.247  -3.600   1.571
  146    HA   SER  21           HA       SER  21  -5.113  -2.480   3.804
  147   1HB   SER  21          HB1       SER  21  -5.029  -5.451   3.353
  148   2HB   SER  21          HB2       SER  21  -5.644  -4.516   4.736
  149    HG   SER  21           HG       SER  21  -7.393  -5.370   3.583
  150    H    CYS  22           H        CYS  22  -3.041  -2.856   4.817
  151    HA   CYS  22           HA       CYS  22  -0.968  -2.964   2.681
  152   1HB   CYS  22          HB1       CYS  22  -1.210  -0.795   3.522
  153   2HB   CYS  22          HB2       CYS  22  -1.016  -1.252   5.212
  154    H    LYS  23           H        LYS  23   0.982  -4.021   2.867
  155    HA   LYS  23           HA       LYS  23   1.140  -6.210   4.805
  156   1HB   LYS  23          HB1       LYS  23   2.602  -5.676   2.302
  157   2HB   LYS  23          HB2       LYS  23   3.005  -6.988   3.434
  158   1HG   LYS  23          HG1       LYS  23   0.103  -6.612   2.824
  159   2HG   LYS  23          HG2       LYS  23   1.188  -7.234   1.558
  160   1HD   LYS  23          HD1       LYS  23   1.796  -9.143   2.863
  161   2HD   LYS  23          HD2       LYS  23   1.024  -8.458   4.313
  162   1HE   LYS  23          HE1       LYS  23  -1.183  -8.557   3.165
  163   2HE   LYS  23          HE2       LYS  23  -0.409  -9.244   1.724
  164   1HZ   LYS  23          HZ1       LYS  23  -0.523 -10.492   4.398
  165   2HZ   LYS  23          HZ2       LYS  23  -1.420 -10.922   3.091
  166   3HZ   LYS  23          HZ3       LYS  23   0.207 -11.149   3.073
  167    H    ASN  24           H        ASN  24   4.093  -6.193   4.871
  168    HA   ASN  24           HA       ASN  24   4.551  -4.693   7.162
  169   1HB   ASN  24          HB1       ASN  24   5.727  -6.761   6.593
  170   2HB   ASN  24          HB2       ASN  24   6.566  -5.941   5.263
  171   1HD2  ASN  24          1HD2      ASN  24   8.611  -6.559   6.380
  172   2HD2  ASN  24          2HD2      ASN  24   9.137  -5.590   7.747
  173    H    GLY  25           H        GLY  25   3.800  -2.680   6.396
  174   1HA   GLY  25          HA1       GLY  25   4.201  -0.471   6.246
  175   2HA   GLY  25          HA2       GLY  25   5.786  -0.722   5.944
  176    H    TYR  26           H        TYR  26   3.776  -2.545   3.899
  177    HA   TYR  26           HA       TYR  26   4.421  -0.735   1.611
  178   1HB   TYR  26          HB1       TYR  26   5.476  -3.400   2.405
  179   2HB   TYR  26          HB2       TYR  26   4.986  -3.236   0.716
  180    HD1  TYR  26           HD1      TYR  26   7.085  -1.478   3.325
  181    HD2  TYR  26           HD2      TYR  26   6.590  -2.518  -0.833
  182    HE1  TYR  26           HE1      TYR  26   9.272  -0.451   2.803
  183    HE2  TYR  26           HE2      TYR  26   8.817  -1.583  -1.327
  184    HH   TYR  26           HH       TYR  26  10.653  -0.479  -0.495
  185    H    CYS  27           H        CYS  27   2.485  -0.607   0.167
  186    HA   CYS  27           HA       CYS  27   0.378  -2.446   1.106
  187   1HB   CYS  27          HB1       CYS  27  -1.138  -0.839   0.509
  188   2HB   CYS  27          HB2       CYS  27   0.092  -0.207   1.639
  189    H    GLN  28           H        GLN  28   1.539  -3.976  -0.008
  190    HA   GLN  28           HA       GLN  28   1.684  -4.338  -2.808
  191   1HB   GLN  28          HB1       GLN  28   1.326  -6.430  -0.630
  192   2HB   GLN  28          HB2       GLN  28   1.971  -6.711  -2.258
  193   1HG   GLN  28          HG1       GLN  28   3.246  -5.048  -0.051
  194   2HG   GLN  28          HG2       GLN  28   3.773  -6.649  -0.608
  195   1HE2  GLN  28          1HE2      GLN  28   4.339  -6.755  -3.056
  196   2HE2  GLN  28          2HE2      GLN  28   5.187  -5.359  -3.694
  197    H    GLY  29           H        GLY  29  -0.372  -3.367  -3.330
  198   1HA   GLY  29          HA1       GLY  29  -2.350  -5.198  -4.156
  199   2HA   GLY  29          HA2       GLY  29  -2.867  -4.348  -2.860
  200    H    CYS  30           H        CYS  30  -1.673  -1.880  -3.238
  201    HA   CYS  30           HA       CYS  30  -3.261  -0.395  -4.803
  202   1HB   CYS  30          HB1       CYS  30  -1.470   0.329  -3.220
  203   2HB   CYS  30          HB2       CYS  30  -0.264  -0.072  -4.465
  204    H    THR  31           H        THR  31  -0.244  -1.968  -5.912
  205    HA   THR  31           HA       THR  31  -1.250  -2.421  -8.519
  206    HB   THR  31           HB       THR  31  -0.650  -0.118  -8.908
  207    HG1  THR  31           HG1      THR  31   0.695  -0.535 -10.640
  208   1HG2  THR  31          1HG2      THR  31   2.144  -0.882  -7.967
  209   2HG2  THR  31          2HG2      THR  31   1.680   0.668  -8.706
  210   3HG2  THR  31          3HG2      THR  31   1.017   0.207  -7.127
  Start of MODEL    9
    1   1H    THR   1           H        THR   1   9.899  -2.644  -3.324
    2    HA   THR   1           HA       THR   1  10.031  -5.373  -3.554
    3    HB   THR   1           HB       THR   1   7.773  -6.120  -3.631
    4    HG1  THR   1           HG1      THR   1   6.970  -3.396  -3.378
    5   1HG2  THR   1          1HG2      THR   1   6.937  -5.849  -1.405
    6   2HG2  THR   1          2HG2      THR   1   8.704  -5.899  -1.349
    7   3HG2  THR   1          3HG2      THR   1   7.852  -4.356  -1.170
    8    HA   PRO   2           HA       PRO   2   9.592  -4.269  -7.805
    9   1HB   PRO   2          HB1       PRO   2   6.923  -5.593  -8.102
   10   2HB   PRO   2          HB2       PRO   2   8.225  -5.473  -9.284
   11   1HG   PRO   2          HG1       PRO   2   8.129  -7.642  -7.683
   12   2HG   PRO   2          HG2       PRO   2   9.739  -6.813  -7.900
   13   1HD   PRO   2          HD1       PRO   2   7.650  -6.399  -5.741
   14   2HD   PRO   2          HD2       PRO   2   9.249  -6.862  -5.407
   15    H    TYR   3           H        TYR   3   6.510  -3.798  -5.937
   16    HA   TYR   3           HA       TYR   3   5.941  -1.242  -7.126
   17   1HB   TYR   3          HB1       TYR   3   4.526  -2.561  -4.833
   18   2HB   TYR   3          HB2       TYR   3   3.960  -1.611  -6.239
   19    HD1  TYR   3           HD1      TYR   3   3.487  -4.666  -4.863
   20    HD2  TYR   3           HD2      TYR   3   4.628  -2.859  -8.608
   21    HE1  TYR   3           HE1      TYR   3   2.696  -6.675  -6.079
   22    HE2  TYR   3           HE2      TYR   3   3.797  -4.843  -9.820
   23    HH   TYR   3           HH       TYR   3   2.775  -6.902  -9.641
   24    HA   PRO   4           HA       PRO   4   8.225   0.266  -3.327
   25   1HB   PRO   4          HB1       PRO   4   8.978   2.679  -4.226
   26   2HB   PRO   4          HB2       PRO   4   9.830   1.187  -4.745
   27   1HG   PRO   4          HG1       PRO   4   7.640   2.666  -6.228
   28   2HG   PRO   4          HG2       PRO   4   9.237   2.154  -6.867
   29   1HD   PRO   4          HD1       PRO   4   6.965   0.647  -7.213
   30   2HD   PRO   4          HD2       PRO   4   8.569  -0.107  -6.938
   31    H    VAL   5           H        VAL   5   5.526  -0.090  -3.071
   32    HA   VAL   5           HA       VAL   5   4.137   2.470  -3.182
   33    HB   VAL   5           HB       VAL   5   3.674  -0.478  -3.686
   34   1HG1  VAL   5          1HG1      VAL   5   2.018  -0.158  -2.586
   35   2HG1  VAL   5          2HG1      VAL   5   1.831   1.611  -2.934
   36   3HG1  VAL   5          3HG1      VAL   5   1.286   0.349  -4.133
   37   1HG2  VAL   5          1HG2      VAL   5   4.514   0.894  -5.679
   38   2HG2  VAL   5          2HG2      VAL   5   2.830   0.397  -5.939
   39   3HG2  VAL   5          3HG2      VAL   5   3.195   2.048  -5.409
   40    H    ASN   6           H        ASN   6   4.015   3.139  -1.070
   41    HA   ASN   6           HA       ASN   6   4.286   1.229   1.071
   42   1HB   ASN   6          HB1       ASN   6   5.339   3.906   0.177
   43   2HB   ASN   6          HB2       ASN   6   5.467   3.355   1.822
   44   1HD2  ASN   6          1HD2      ASN   6   6.458   0.958   1.977
   45   2HD2  ASN   6          2HD2      ASN   6   7.857   0.715   0.946
   46    H    CYS   7           H        CYS   7   4.016   2.276   3.081
   47    HA   CYS   7           HA       CYS   7   1.918   4.189   3.646
   48   1HB   CYS   7          HB1       CYS   7   0.443   2.316   4.634
   49   2HB   CYS   7          HB2       CYS   7   0.359   2.664   2.880
   50    H    LYS   8           H        LYS   8   1.632   4.564   5.919
   51    HA   LYS   8           HA       LYS   8   3.294   3.044   7.771
   52   1HB   LYS   8          HB1       LYS   8   2.741   5.536   7.855
   53   2HB   LYS   8          HB2       LYS   8   1.063   5.082   8.235
   54   1HG   LYS   8          HG1       LYS   8   1.683   4.083  10.278
   55   2HG   LYS   8          HG2       LYS   8   3.407   4.018   9.856
   56   1HD   LYS   8          HD1       LYS   8   2.860   5.777  11.535
   57   2HD   LYS   8          HD2       LYS   8   3.628   6.399  10.053
   58   1HE   LYS   8          HE1       LYS   8   1.428   7.144   9.223
   59   2HE   LYS   8          HE2       LYS   8   0.625   6.440  10.641
   60   1HZ   LYS   8          HZ1       LYS   8   2.581   8.648  10.685
   61   2HZ   LYS   8          HZ2       LYS   8   0.958   8.801  10.880
   62   3HZ   LYS   8          HZ3       LYS   8   1.846   8.005  12.010
   63    H    THR   9           H        THR   9  -0.171   3.521   6.887
   64    HA   THR   9           HA       THR   9  -0.923   0.841   7.876
   65    HB   THR   9           HB       THR   9  -2.913   2.025   8.924
   66    HG1  THR   9           HG1      THR   9  -2.620   4.207   9.401
   67   1HG2  THR   9          1HG2      THR   9  -1.716   2.673  10.952
   68   2HG2  THR   9          2HG2      THR   9  -0.868   1.288  10.226
   69   3HG2  THR   9          3HG2      THR   9  -0.240   2.936   9.998
   70    H    ASP  10           H        ASP  10  -3.183   0.293   7.081
   71    HA   ASP  10           HA       ASP  10  -3.626   0.389   4.386
   72   1HB   ASP  10          HB1       ASP  10  -5.594   0.568   6.771
   73   2HB   ASP  10          HB2       ASP  10  -6.086   0.093   5.147
   74    H    ARG  11           H        ARG  11  -4.922   2.716   6.571
   75    HA   ARG  11           HA       ARG  11  -6.380   4.233   4.763
   76   1HB   ARG  11          HB1       ARG  11  -6.218   6.063   6.322
   77   2HB   ARG  11          HB2       ARG  11  -5.896   4.668   7.360
   78   1HG   ARG  11          HG1       ARG  11  -3.416   5.017   6.823
   79   2HG   ARG  11          HG2       ARG  11  -3.914   6.553   6.036
   80   1HD   ARG  11          HD1       ARG  11  -4.946   7.037   8.411
   81   2HD   ARG  11          HD2       ARG  11  -3.691   5.909   8.936
   82    HE   ARG  11           HE       ARG  11  -3.349   8.606   8.041
   83   1HH1  ARG  11          2HH2      ARG  11  -1.602   5.482   7.962
   84   2HH1  ARG  11          1HH2      ARG  11  -0.294   6.150   6.997
   85   1HH2  ARG  11          1HH1      ARG  11  -1.660   9.365   6.645
   86   2HH2  ARG  11          2HH1      ARG  11  -0.580   8.204   5.965
   87    H    ASP  12           H        ASP  12  -2.898   4.025   4.894
   88    HA   ASP  12           HA       ASP  12  -2.519   6.530   3.592
   89   1HB   ASP  12          HB1       ASP  12  -1.321   4.814   5.347
   90   2HB   ASP  12          HB2       ASP  12  -0.465   4.336   3.968
   91    H    CYS  13           H        CYS  13  -3.507   3.421   2.532
   92    HA   CYS  13           HA       CYS  13  -2.917   4.212  -0.303
   93   1HB   CYS  13          HB1       CYS  13  -2.697   1.586   1.172
   94   2HB   CYS  13          HB2       CYS  13  -2.718   1.659  -0.597
   95    H    VAL  14           H        VAL  14  -5.294   3.936   1.815
   96    HA   VAL  14           HA       VAL  14  -7.238   2.357   0.599
   97    HB   VAL  14           HB       VAL  14  -7.396   3.801   2.552
   98   1HG1  VAL  14          1HG1      VAL  14  -7.718   6.129   0.724
   99   2HG1  VAL  14          2HG1      VAL  14  -7.392   6.092   2.486
  100   3HG1  VAL  14          3HG1      VAL  14  -6.145   5.563   1.327
  101   1HG2  VAL  14          1HG2      VAL  14  -9.591   4.481   0.527
  102   2HG2  VAL  14          2HG2      VAL  14  -9.549   3.026   1.544
  103   3HG2  VAL  14          3HG2      VAL  14  -9.725   4.627   2.291
  104    H    MET  15           H        MET  15  -5.880   5.282  -0.486
  105    HA   MET  15           HA       MET  15  -7.568   6.048  -2.626
  106   1HB   MET  15          HB1       MET  15  -5.685   7.363  -3.443
  107   2HB   MET  15          HB2       MET  15  -5.861   7.519  -1.683
  108   1HG   MET  15          HG1       MET  15  -4.048   5.893  -1.351
  109   2HG   MET  15          HG2       MET  15  -3.882   5.704  -3.105
  110   1HE   MET  15          HE1       MET  15  -1.302   6.096  -2.978
  111   2HE   MET  15          HE2       MET  15  -0.559   7.494  -2.164
  112   3HE   MET  15          HE3       MET  15  -1.427   6.272  -1.210
  113    H    CYS  16           H        CYS  16  -5.267   3.479  -2.437
  114    HA   CYS  16           HA       CYS  16  -4.791   3.010  -5.235
  115   1HB   CYS  16          HB1       CYS  16  -4.722   1.240  -2.794
  116   2HB   CYS  16          HB2       CYS  16  -4.277   0.643  -4.415
  117    H    GLY  17           H        GLY  17  -7.610   2.406  -3.184
  118   1HA   GLY  17          HA1       GLY  17  -9.335   2.330  -5.156
  119   2HA   GLY  17          HA2       GLY  17  -8.921   0.751  -5.105
  120    H    LEU  18           H        LEU  18  -9.009  -0.353  -2.997
  121    HA   LEU  18           HA       LEU  18 -11.440   0.438  -1.479
  122   1HB   LEU  18          HB1       LEU  18 -11.140  -1.638  -3.148
  123   2HB   LEU  18          HB2       LEU  18 -10.372  -2.420  -1.812
  124    HG   LEU  18           HG       LEU  18 -12.969  -0.986  -1.488
  125   1HD1  LEU  18          1HD1      LEU  18 -14.269  -3.006  -2.197
  126   2HD1  LEU  18          2HD1      LEU  18 -13.266  -2.401  -3.517
  127   3HD1  LEU  18          3HD1      LEU  18 -12.742  -3.824  -2.588
  128   1HD2  LEU  18          1HD2      LEU  18 -11.949  -3.338   0.038
  129   2HD2  LEU  18          2HD2      LEU  18 -12.465  -1.700   0.584
  130   3HD2  LEU  18          3HD2      LEU  18 -13.657  -2.863   0.033
  131    H    GLY  19           H        GLY  19 -10.633  -1.846   0.057
  132   1HA   GLY  19          HA1       GLY  19  -9.095  -0.669   2.197
  133   2HA   GLY  19          HA2       GLY  19  -9.936  -2.066   2.290
  134    H    ILE  20           H        ILE  20  -7.670  -0.847   0.099
  135    HA   ILE  20           HA       ILE  20  -6.026  -3.169  -0.263
  136    HB   ILE  20           HB       ILE  20  -5.243  -0.243  -0.654
  137   1HG1  ILE  20          1HG1      ILE  20  -7.058  -0.432  -2.065
  138   2HG1  ILE  20          2HG1      ILE  20  -5.681  -0.848  -3.122
  139   1HG2  ILE  20          1HG2      ILE  20  -4.071  -2.764  -1.862
  140   2HG2  ILE  20          2HG2      ILE  20  -3.607  -1.076  -2.208
  141   3HG2  ILE  20          3HG2      ILE  20  -3.299  -1.764  -0.622
  142   1HD1  ILE  20          1HD1      ILE  20  -7.463  -2.354  -3.599
  143   2HD1  ILE  20          2HD1      ILE  20  -6.180  -3.258  -2.768
  144   3HD1  ILE  20          3HD1      ILE  20  -7.658  -2.783  -1.892
  145    H    SER  21           H        SER  21  -6.018  -3.843   1.957
  146    HA   SER  21           HA       SER  21  -4.843  -2.404   3.957
  147   1HB   SER  21          HB1       SER  21  -6.365  -4.289   4.303
  148   2HB   SER  21          HB2       SER  21  -5.121  -5.437   3.794
  149    HG   SER  21           HG       SER  21  -5.100  -3.705   6.046
  150    H    CYS  22           H        CYS  22  -2.873  -2.404   5.103
  151    HA   CYS  22           HA       CYS  22  -0.702  -2.496   3.164
  152   1HB   CYS  22          HB1       CYS  22  -1.658  -0.908   5.469
  153   2HB   CYS  22          HB2       CYS  22   0.097  -0.871   5.284
  154    H    LYS  23           H        LYS  23   0.872  -3.943   3.178
  155    HA   LYS  23           HA       LYS  23   1.256  -5.757   5.481
  156   1HB   LYS  23          HB1       LYS  23   2.405  -5.630   2.683
  157   2HB   LYS  23          HB2       LYS  23   2.883  -6.816   3.936
  158   1HG   LYS  23          HG1       LYS  23   1.306  -7.862   2.473
  159   2HG   LYS  23          HG2       LYS  23   0.552  -7.638   4.056
  160   1HD   LYS  23          HD1       LYS  23  -0.757  -5.793   3.236
  161   2HD   LYS  23          HD2       LYS  23   0.148  -5.708   1.724
  162   1HE   LYS  23          HE1       LYS  23  -0.807  -7.957   1.108
  163   2HE   LYS  23          HE2       LYS  23  -1.732  -7.934   2.633
  164   1HZ   LYS  23          HZ1       LYS  23  -2.622  -5.738   1.789
  165   2HZ   LYS  23          HZ2       LYS  23  -1.991  -6.123   0.335
  166   3HZ   LYS  23          HZ3       LYS  23  -3.154  -7.086   0.980
  167    H    ASN  24           H        ASN  24   3.944  -5.979   5.532
  168    HA   ASN  24           HA       ASN  24   4.901  -4.224   7.272
  169   1HB   ASN  24          HB1       ASN  24   6.548  -5.786   5.455
  170   2HB   ASN  24          HB2       ASN  24   7.075  -5.081   6.962
  171   1HD2  ASN  24          1HD2      ASN  24   6.890  -6.462   8.765
  172   2HD2  ASN  24          2HD2      ASN  24   5.835  -7.861   8.809
  173    H    GLY  25           H        GLY  25   4.055  -2.224   6.140
  174   1HA   GLY  25          HA1       GLY  25   4.652  -0.091   5.767
  175   2HA   GLY  25          HA2       GLY  25   6.165  -0.523   5.328
  176    H    TYR  26           H        TYR  26   3.699  -2.295   3.726
  177    HA   TYR  26           HA       TYR  26   4.218  -0.824   1.202
  178   1HB   TYR  26          HB1       TYR  26   5.204  -3.432   2.220
  179   2HB   TYR  26          HB2       TYR  26   4.617  -3.405   0.555
  180    HD1  TYR  26           HD1      TYR  26   5.783  -2.081  -1.183
  181    HD2  TYR  26           HD2      TYR  26   7.229  -2.208   2.871
  182    HE1  TYR  26           HE1      TYR  26   8.043  -1.458  -1.955
  183    HE2  TYR  26           HE2      TYR  26   9.478  -1.532   2.095
  184    HH   TYR  26           HH       TYR  26  10.254  -1.174  -1.362
  185    H    CYS  27           H        CYS  27   2.330  -0.871  -0.281
  186    HA   CYS  27           HA       CYS  27   0.093  -2.433   0.874
  187   1HB   CYS  27          HB1       CYS  27  -1.318  -0.882  -0.025
  188   2HB   CYS  27          HB2       CYS  27  -0.082  -0.147   1.041
  189    H    GLN  28           H        GLN  28   1.472  -4.044  -0.198
  190    HA   GLN  28           HA       GLN  28   1.245  -4.722  -2.934
  191   1HB   GLN  28          HB1       GLN  28   1.018  -6.713  -0.654
  192   2HB   GLN  28          HB2       GLN  28   1.764  -6.944  -2.248
  193   1HG   GLN  28          HG1       GLN  28   2.816  -5.283   0.081
  194   2HG   GLN  28          HG2       GLN  28   3.507  -6.786  -0.570
  195   1HE2  GLN  28          1HE2      GLN  28   4.613  -6.722  -2.667
  196   2HE2  GLN  28          2HE2      GLN  28   5.273  -5.177  -3.198
  197    H    GLY  29           H        GLY  29  -0.624  -4.982  -4.119
  198   1HA   GLY  29          HA1       GLY  29  -2.933  -6.028  -4.006
  199   2HA   GLY  29          HA2       GLY  29  -3.124  -5.134  -2.652
  200    H    CYS  30           H        CYS  30  -1.876  -2.725  -3.245
  201    HA   CYS  30           HA       CYS  30  -3.568  -1.253  -4.851
  202   1HB   CYS  30          HB1       CYS  30  -1.708  -0.489  -3.311
  203   2HB   CYS  30          HB2       CYS  30  -0.548  -0.961  -4.571
  204    H    THR  31           H        THR  31  -0.612  -2.996  -5.620
  205    HA   THR  31           HA       THR  31  -1.636  -3.921  -8.105
  206    HB   THR  31           HB       THR  31  -0.617  -1.974  -9.026
  207    HG1  THR  31           HG1      THR  31  -0.103  -3.709 -10.263
  208   1HG2  THR  31          1HG2      THR  31   0.779  -1.165  -7.284
  209   2HG2  THR  31          2HG2      THR  31   1.755  -2.644  -7.281
  210   3HG2  THR  31          3HG2      THR  31   1.847  -1.516  -8.656
  Start of MODEL   10
    1   1H    THR   1           H        THR   1  12.781  -1.526  -4.978
    2    HA   THR   1           HA       THR   1  12.857  -3.824  -6.676
    3    HB   THR   1           HB       THR   1  10.482  -4.455  -6.358
    4    HG1  THR   1           HG1      THR   1   9.554  -2.597  -5.608
    5   1HG2  THR   1          1HG2      THR   1  12.195  -5.630  -4.986
    6   2HG2  THR   1          2HG2      THR   1  11.907  -4.470  -3.669
    7   3HG2  THR   1          3HG2      THR   1  10.603  -5.547  -4.199
    8    HA   PRO   2           HA       PRO   2  10.858  -0.715  -9.268
    9   1HB   PRO   2          HB1       PRO   2   8.834  -2.715 -10.140
   10   2HB   PRO   2          HB2       PRO   2   9.762  -1.591 -11.122
   11   1HG   PRO   2          HG1       PRO   2  10.519  -4.197 -10.937
   12   2HG   PRO   2          HG2       PRO   2  11.800  -2.900 -10.883
   13   1HD   PRO   2          HD1       PRO   2  10.305  -4.172  -8.566
   14   2HD   PRO   2          HD2       PRO   2  11.988  -4.310  -8.753
   15    H    TYR   3           H        TYR   3   8.702   0.545  -9.102
   16    HA   TYR   3           HA       TYR   3   7.589   1.624  -7.416
   17   1HB   TYR   3          HB1       TYR   3   5.348  -0.121  -7.964
   18   2HB   TYR   3          HB2       TYR   3   5.710   1.575  -8.399
   19    HD1  TYR   3           HD1      TYR   3   5.870  -1.942  -9.509
   20    HD2  TYR   3           HD2      TYR   3   6.830   2.138 -10.522
   21    HE1  TYR   3           HE1      TYR   3   6.421  -2.645 -11.816
   22    HE2  TYR   3           HE2      TYR   3   7.413   1.424 -12.825
   23    HH   TYR   3           HH       TYR   3   7.178  -1.976 -13.894
   24    HA   PRO   4           HA       PRO   4   7.697  -1.224  -3.786
   25   1HB   PRO   4          HB1       PRO   4   9.200   0.270  -2.096
   26   2HB   PRO   4          HB2       PRO   4   9.939  -0.700  -3.412
   27   1HG   PRO   4          HG1       PRO   4   9.273   2.255  -3.440
   28   2HG   PRO   4          HG2       PRO   4  10.823   1.477  -3.897
   29   1HD   PRO   4          HD1       PRO   4   8.894   2.165  -5.738
   30   2HD   PRO   4          HD2       PRO   4   9.919   0.715  -5.939
   31    H    VAL   5           H        VAL   5   5.321  -0.263  -4.320
   32    HA   VAL   5           HA       VAL   5   4.498   2.048  -3.193
   33    HB   VAL   5           HB       VAL   5   2.331   0.330  -3.113
   34   1HG1  VAL   5          1HG1      VAL   5   2.578   2.608  -4.001
   35   2HG1  VAL   5          2HG1      VAL   5   3.410   1.936  -5.444
   36   3HG1  VAL   5          3HG1      VAL   5   1.680   1.558  -5.153
   37   1HG2  VAL   5          1HG2      VAL   5   3.613  -1.532  -4.159
   38   2HG2  VAL   5          2HG2      VAL   5   2.181  -0.985  -5.045
   39   3HG2  VAL   5          3HG2      VAL   5   3.779  -0.508  -5.615
   40    H    ASN   6           H        ASN   6   4.392   2.634  -1.298
   41    HA   ASN   6           HA       ASN   6   4.813   0.803   0.961
   42   1HB   ASN   6          HB1       ASN   6   5.720   3.375  -0.063
   43   2HB   ASN   6          HB2       ASN   6   5.215   3.544   1.561
   44   1HD2  ASN   6          1HD2      ASN   6   6.268   0.933   2.603
   45   2HD2  ASN   6          2HD2      ASN   6   8.001   0.992   2.375
   46    H    CYS   7           H        CYS   7   4.197   2.126   2.952
   47    HA   CYS   7           HA       CYS   7   1.890   3.736   3.065
   48   1HB   CYS   7          HB1       CYS   7   0.507   1.917   4.351
   49   2HB   CYS   7          HB2       CYS   7   0.461   2.158   2.563
   50    H    LYS   8           H        LYS   8   1.644   4.695   5.018
   51    HA   LYS   8           HA       LYS   8   3.212   4.078   7.385
   52   1HB   LYS   8          HB1       LYS   8   0.802   5.735   6.860
   53   2HB   LYS   8          HB2       LYS   8   1.293   5.270   8.536
   54   1HG   LYS   8          HG1       LYS   8   2.427   7.257   8.207
   55   2HG   LYS   8          HG2       LYS   8   3.666   6.039   7.903
   56   1HD   LYS   8          HD1       LYS   8   3.979   7.721   6.292
   57   2HD   LYS   8          HD2       LYS   8   3.223   6.355   5.429
   58   1HE   LYS   8          HE1       LYS   8   2.100   8.176   4.566
   59   2HE   LYS   8          HE2       LYS   8   0.984   7.645   5.825
   60   1HZ   LYS   8          HZ1       LYS   8   2.878   9.876   6.024
   61   2HZ   LYS   8          HZ2       LYS   8   1.248   9.964   5.819
   62   3HZ   LYS   8          HZ3       LYS   8   1.862   9.378   7.231
   63    H    THR   9           H        THR   9  -0.104   3.267   6.354
   64    HA   THR   9           HA       THR   9   0.184   0.581   6.753
   65    HB   THR   9           HB       THR   9  -0.127   1.153   9.204
   66    HG1  THR   9           HG1      THR   9  -2.136  -0.643   8.305
   67   1HG2  THR   9          1HG2      THR   9  -1.830   2.919   8.874
   68   2HG2  THR   9          2HG2      THR   9  -3.036   1.662   8.504
   69   3HG2  THR   9          3HG2      THR   9  -2.259   1.699  10.095
   70    H    ASP  10           H        ASP  10  -2.585  -0.036   6.793
   71    HA   ASP  10           HA       ASP  10  -3.338   0.126   4.158
   72   1HB   ASP  10          HB1       ASP  10  -5.162   0.206   6.651
   73   2HB   ASP  10          HB2       ASP  10  -5.555  -0.573   5.152
   74    H    ARG  11           H        ARG  11  -4.585   2.196   6.571
   75    HA   ARG  11           HA       ARG  11  -6.212   3.805   4.993
   76   1HB   ARG  11          HB1       ARG  11  -5.780   5.653   6.626
   77   2HB   ARG  11          HB2       ARG  11  -5.906   4.102   7.487
   78   1HG   ARG  11          HG1       ARG  11  -3.355   3.964   7.332
   79   2HG   ARG  11          HG2       ARG  11  -3.374   5.644   6.747
   80   1HD   ARG  11          HD1       ARG  11  -4.352   6.415   8.832
   81   2HD   ARG  11          HD2       ARG  11  -4.542   4.734   9.390
   82    HE   ARG  11           HE       ARG  11  -1.807   5.312   8.722
   83   1HH1  ARG  11          2HH2      ARG  11  -4.214   5.971  11.203
   84   2HH1  ARG  11          1HH2      ARG  11  -3.102   5.976  12.535
   85   1HH2  ARG  11          1HH1      ARG  11  -0.280   5.251  10.476
   86   2HH2  ARG  11          2HH1      ARG  11  -0.798   5.594  12.093
   87    H    ASP  12           H        ASP  12  -2.711   3.838   4.950
   88    HA   ASP  12           HA       ASP  12  -2.622   6.387   3.636
   89   1HB   ASP  12          HB1       ASP  12  -0.950   5.137   5.202
   90   2HB   ASP  12          HB2       ASP  12  -0.494   4.209   3.776
   91    H    CYS  13           H        CYS  13  -3.481   3.285   2.582
   92    HA   CYS  13           HA       CYS  13  -3.138   4.135  -0.286
   93   1HB   CYS  13          HB1       CYS  13  -2.393   1.694   1.232
   94   2HB   CYS  13          HB2       CYS  13  -3.212   1.350  -0.317
   95    H    VAL  14           H        VAL  14  -5.350   3.642   1.986
   96    HA   VAL  14           HA       VAL  14  -7.408   2.270   0.729
   97    HB   VAL  14           HB       VAL  14  -7.444   3.579   2.806
   98   1HG1  VAL  14          1HG1      VAL  14  -6.166   5.379   1.641
   99   2HG1  VAL  14          2HG1      VAL  14  -7.753   6.062   1.196
  100   3HG1  VAL  14          3HG1      VAL  14  -7.327   5.848   2.917
  101   1HG2  VAL  14          1HG2      VAL  14  -9.707   4.649   2.691
  102   2HG2  VAL  14          2HG2      VAL  14  -9.697   4.446   0.928
  103   3HG2  VAL  14          3HG2      VAL  14  -9.695   3.025   1.996
  104    H    MET  15           H        MET  15  -6.116   5.293  -0.170
  105    HA   MET  15           HA       MET  15  -7.972   6.206  -2.113
  106   1HB   MET  15          HB1       MET  15  -6.207   7.747  -2.791
  107   2HB   MET  15          HB2       MET  15  -6.311   7.643  -1.020
  108   1HG   MET  15          HG1       MET  15  -4.423   6.037  -1.037
  109   2HG   MET  15          HG2       MET  15  -4.290   6.215  -2.789
  110   1HE   MET  15          HE1       MET  15  -3.533   8.422  -4.018
  111   2HE   MET  15          HE2       MET  15  -4.712   9.439  -3.152
  112   3HE   MET  15          HE3       MET  15  -2.997   9.894  -3.177
  113    H    CYS  16           H        CYS  16  -5.617   3.722  -2.311
  114    HA   CYS  16           HA       CYS  16  -5.182   3.848  -5.187
  115   1HB   CYS  16          HB1       CYS  16  -4.348   1.932  -3.014
  116   2HB   CYS  16          HB2       CYS  16  -3.993   1.634  -4.763
  117    H    GLY  17           H        GLY  17  -7.804   2.720  -3.279
  118   1HA   GLY  17          HA1       GLY  17  -9.194   2.257  -5.581
  119   2HA   GLY  17          HA2       GLY  17  -8.806   0.771  -5.023
  120    H    LEU  18           H        LEU  18  -9.639  -0.049  -3.089
  121    HA   LEU  18           HA       LEU  18 -12.224   1.160  -2.193
  122   1HB   LEU  18          HB1       LEU  18 -12.429  -0.825  -3.116
  123   2HB   LEU  18          HB2       LEU  18 -11.210  -1.560  -2.085
  124    HG   LEU  18           HG       LEU  18 -12.500  -1.148  -0.122
  125   1HD1  LEU  18          1HD1      LEU  18 -14.434   0.609  -1.707
  126   2HD1  LEU  18          2HD1      LEU  18 -14.755  -0.053  -0.097
  127   3HD1  LEU  18          3HD1      LEU  18 -13.454   1.110  -0.307
  128   1HD2  LEU  18          1HD2      LEU  18 -14.587  -2.330  -0.855
  129   2HD2  LEU  18          2HD2      LEU  18 -14.234  -1.634  -2.485
  130   3HD2  LEU  18          3HD2      LEU  18 -13.118  -2.855  -1.759
  131    H    GLY  19           H        GLY  19 -10.238  -1.094  -0.521
  132   1HA   GLY  19          HA1       GLY  19  -9.141   0.734   1.433
  133   2HA   GLY  19          HA2       GLY  19 -10.005  -0.557   1.937
  134    H    ILE  20           H        ILE  20  -7.558   0.135  -0.440
  135    HA   ILE  20           HA       ILE  20  -6.395  -2.422  -0.601
  136    HB   ILE  20           HB       ILE  20  -4.970   0.243  -0.992
  137   1HG1  ILE  20          1HG1      ILE  20  -6.846   0.360  -2.397
  138   2HG1  ILE  20          2HG1      ILE  20  -5.427  -0.017  -3.396
  139   1HG2  ILE  20          1HG2      ILE  20  -3.416  -1.557  -0.792
  140   2HG2  ILE  20          2HG2      ILE  20  -4.314  -2.527  -1.983
  141   3HG2  ILE  20          3HG2      ILE  20  -3.520  -1.010  -2.459
  142   1HD1  ILE  20          1HD1      ILE  20  -6.127  -2.416  -3.399
  143   2HD1  ILE  20          2HD1      ILE  20  -7.598  -1.953  -2.505
  144   3HD1  ILE  20          3HD1      ILE  20  -7.316  -1.329  -4.142
  145    H    SER  21           H        SER  21  -5.904  -3.548   1.269
  146    HA   SER  21           HA       SER  21  -4.833  -2.216   3.533
  147   1HB   SER  21          HB1       SER  21  -4.756  -4.775   4.231
  148   2HB   SER  21          HB2       SER  21  -6.310  -3.909   4.027
  149    HG   SER  21           HG       SER  21  -6.296  -5.918   2.918
  150    H    CYS  22           H        CYS  22  -2.927  -3.037   4.723
  151    HA   CYS  22           HA       CYS  22  -0.640  -3.051   2.838
  152   1HB   CYS  22          HB1       CYS  22  -1.788  -1.268   4.873
  153   2HB   CYS  22          HB2       CYS  22  -0.041  -1.306   4.962
  154    H    LYS  23           H        LYS  23   0.858  -4.447   3.154
  155    HA   LYS  23           HA       LYS  23   1.129  -6.127   5.523
  156   1HB   LYS  23          HB1       LYS  23   2.403  -5.924   2.859
  157   2HB   LYS  23          HB2       LYS  23   3.296  -6.719   4.159
  158   1HG   LYS  23          HG1       LYS  23   0.487  -7.518   4.234
  159   2HG   LYS  23          HG2       LYS  23   1.222  -7.744   2.628
  160   1HD   LYS  23          HD1       LYS  23   1.611  -9.794   3.833
  161   2HD   LYS  23          HD2       LYS  23   3.142  -8.908   3.809
  162   1HE   LYS  23          HE1       LYS  23   2.104  -7.943   6.129
  163   2HE   LYS  23          HE2       LYS  23   1.211  -9.471   6.075
  164   1HZ   LYS  23          HZ1       LYS  23   4.104  -9.010   6.262
  165   2HZ   LYS  23          HZ2       LYS  23   3.149  -9.852   7.282
  166   3HZ   LYS  23          HZ3       LYS  23   3.509 -10.502   5.812
  167    H    ASN  24           H        ASN  24   3.781  -6.052   5.936
  168    HA   ASN  24           HA       ASN  24   4.577  -4.287   7.742
  169   1HB   ASN  24          HB1       ASN  24   6.333  -5.605   5.828
  170   2HB   ASN  24          HB2       ASN  24   6.811  -4.952   7.375
  171   1HD2  ASN  24          1HD2      ASN  24   6.505  -6.293   9.209
  172   2HD2  ASN  24          2HD2      ASN  24   5.712  -7.848   9.152
  173    H    GLY  25           H        GLY  25   3.509  -2.343   6.640
  174   1HA   GLY  25          HA1       GLY  25   3.658  -0.249   5.972
  175   2HA   GLY  25          HA2       GLY  25   5.290  -0.302   5.991
  176    H    TYR  26           H        TYR  26   3.430  -2.536   4.091
  177    HA   TYR  26           HA       TYR  26   4.361  -1.216   1.591
  178   1HB   TYR  26          HB1       TYR  26   5.122  -3.812   2.740
  179   2HB   TYR  26          HB2       TYR  26   4.500  -3.909   1.089
  180    HD1  TYR  26           HD1      TYR  26   5.812  -3.113  -0.783
  181    HD2  TYR  26           HD2      TYR  26   7.044  -2.203   3.245
  182    HE1  TYR  26           HE1      TYR  26   7.998  -2.298  -1.626
  183    HE2  TYR  26           HE2      TYR  26   9.204  -1.359   2.400
  184    HH   TYR  26           HH       TYR  26  10.513  -0.976   0.540
  185    H    CYS  27           H        CYS  27   2.947  -1.171  -0.012
  186    HA   CYS  27           HA       CYS  27   0.146  -1.990   0.627
  187   1HB   CYS  27          HB1       CYS  27   0.389   0.316   0.662
  188   2HB   CYS  27          HB2       CYS  27   1.436   0.375  -0.759
  189    H    GLN  28           H        GLN  28  -0.441  -3.726  -0.492
  190    HA   GLN  28           HA       GLN  28   1.343  -4.742  -2.485
  191   1HB   GLN  28          HB1       GLN  28  -1.304  -5.831  -1.478
  192   2HB   GLN  28          HB2       GLN  28  -0.090  -6.735  -2.406
  193   1HG   GLN  28          HG1       GLN  28   0.210  -5.577   0.396
  194   2HG   GLN  28          HG2       GLN  28   0.121  -7.297  -0.044
  195   1HE2  GLN  28          1HE2      GLN  28   1.899  -7.675  -2.054
  196   2HE2  GLN  28          2HE2      GLN  28   3.503  -7.171  -1.551
  197    H    GLY  29           H        GLY  29   1.033  -2.896  -3.974
  198   1HA   GLY  29          HA1       GLY  29   0.658  -2.628  -6.208
  199   2HA   GLY  29          HA2       GLY  29  -0.130  -4.058  -6.253
  200    H    CYS  30           H        CYS  30  -0.656  -1.037  -4.775
  201    HA   CYS  30           HA       CYS  30  -2.909  -0.214  -4.363
  202   1HB   CYS  30          HB1       CYS  30  -1.043   0.930  -6.342
  203   2HB   CYS  30          HB2       CYS  30  -2.561   1.770  -6.253
  204    H    THR  31           H        THR  31  -2.571  -0.198  -7.964
  205    HA   THR  31           HA       THR  31  -5.412  -0.430  -8.411
  206    HB   THR  31           HB       THR  31  -4.383  -1.077 -10.753
  207    HG1  THR  31           HG1      THR  31  -2.184  -0.485 -10.885
  208   1HG2  THR  31          1HG2      THR  31  -3.750   1.622  -9.461
  209   2HG2  THR  31          2HG2      THR  31  -3.823   1.295 -11.205
  210   3HG2  THR  31          3HG2      THR  31  -5.290   1.168 -10.220
  Start of MODEL   11
    1   1H    THR   1           H        THR   1   7.760  -8.773  -9.319
    2    HA   THR   1           HA       THR   1   8.828  -6.849  -8.050
    3    HB   THR   1           HB       THR   1   8.328  -6.385 -10.288
    4    HG1  THR   1           HG1      THR   1   6.946  -4.499  -8.706
    5   1HG2  THR   1          1HG2      THR   1   6.173  -7.447 -10.621
    6   2HG2  THR   1          2HG2      THR   1   5.370  -6.266  -9.569
    7   3HG2  THR   1          3HG2      THR   1   6.067  -5.754 -11.119
    8    HA   PRO   2           HA       PRO   2   5.848  -6.477  -4.647
    9   1HB   PRO   2          HB1       PRO   2   8.377  -6.435  -3.062
   10   2HB   PRO   2          HB2       PRO   2   6.796  -7.052  -2.597
   11   1HG   PRO   2          HG1       PRO   2   8.646  -8.763  -3.567
   12   2HG   PRO   2          HG2       PRO   2   6.938  -8.901  -4.188
   13   1HD   PRO   2          HD1       PRO   2   9.241  -7.285  -5.325
   14   2HD   PRO   2          HD2       PRO   2   8.492  -8.543  -6.180
   15    H    TYR   3           H        TYR   3   5.085  -4.226  -4.942
   16    HA   TYR   3           HA       TYR   3   6.740  -2.437  -6.081
   17   1HB   TYR   3          HB1       TYR   3   3.984  -2.511  -4.895
   18   2HB   TYR   3          HB2       TYR   3   4.706  -0.941  -5.306
   19    HD1  TYR   3           HD1      TYR   3   3.653  -4.214  -6.728
   20    HD2  TYR   3           HD2      TYR   3   5.097  -0.239  -7.573
   21    HE1  TYR   3           HE1      TYR   3   3.542  -4.686  -9.149
   22    HE2  TYR   3           HE2      TYR   3   4.994  -0.722 -10.000
   23    HH   TYR   3           HH       TYR   3   3.965  -3.894 -11.280
   24    HA   PRO   4           HA       PRO   4   8.564  -0.324  -2.483
   25   1HB   PRO   4          HB1       PRO   4   9.793   1.721  -3.725
   26   2HB   PRO   4          HB2       PRO   4  10.354   0.027  -3.925
   27   1HG   PRO   4          HG1       PRO   4   8.536   1.595  -5.772
   28   2HG   PRO   4          HG2       PRO   4  10.014   0.683  -6.214
   29   1HD   PRO   4          HD1       PRO   4   7.495  -0.390  -6.426
   30   2HD   PRO   4          HD2       PRO   4   8.900  -1.390  -5.943
   31    H    VAL   5           H        VAL   5   6.003  -0.139  -2.162
   32    HA   VAL   5           HA       VAL   5   5.055   2.628  -2.322
   33    HB   VAL   5           HB       VAL   5   4.145  -0.147  -3.069
   34   1HG1  VAL   5          1HG1      VAL   5   2.702   0.047  -1.592
   35   2HG1  VAL   5          2HG1      VAL   5   2.356   1.799  -1.831
   36   3HG1  VAL   5          3HG1      VAL   5   1.788   0.548  -3.027
   37   1HG2  VAL   5          1HG2      VAL   5   3.097   1.015  -5.017
   38   2HG2  VAL   5          2HG2      VAL   5   3.482   2.592  -4.296
   39   3HG2  VAL   5          3HG2      VAL   5   4.787   1.535  -4.875
   40    H    ASN   6           H        ASN   6   4.700   3.213  -0.142
   41    HA   ASN   6           HA       ASN   6   4.970   1.179   1.909
   42   1HB   ASN   6          HB1       ASN   6   5.768   4.018   1.308
   43   2HB   ASN   6          HB2       ASN   6   5.620   3.471   2.946
   44   1HD2  ASN   6          1HD2      ASN   6   6.878   1.169   3.285
   45   2HD2  ASN   6          2HD2      ASN   6   8.491   1.181   2.580
   46    H    CYS   7           H        CYS   7   4.207   2.082   3.887
   47    HA   CYS   7           HA       CYS   7   1.786   3.676   4.107
   48   1HB   CYS   7          HB1       CYS   7   0.308   1.674   4.676
   49   2HB   CYS   7          HB2       CYS   7   0.720   1.896   2.950
   50    H    LYS   8           H        LYS   8   1.262   4.044   6.209
   51    HA   LYS   8           HA       LYS   8   2.876   2.881   8.406
   52   1HB   LYS   8          HB1       LYS   8   0.841   5.121   8.123
   53   2HB   LYS   8          HB2       LYS   8   1.430   4.523   9.707
   54   1HG   LYS   8          HG1       LYS   8   3.232   5.773   9.561
   55   2HG   LYS   8          HG2       LYS   8   3.748   5.000   8.075
   56   1HD   LYS   8          HD1       LYS   8   1.658   7.202   7.987
   57   2HD   LYS   8          HD2       LYS   8   3.386   7.615   8.196
   58   1HE   LYS   8          HE1       LYS   8   3.993   6.742   6.114
   59   2HE   LYS   8          HE2       LYS   8   2.518   5.737   6.002
   60   1HZ   LYS   8          HZ1       LYS   8   2.701   8.608   5.446
   61   2HZ   LYS   8          HZ2       LYS   8   2.124   7.299   4.554
   62   3HZ   LYS   8          HZ3       LYS   8   1.259   7.803   5.755
   63    H    THR   9           H        THR   9  -0.283   2.632   6.847
   64    HA   THR   9           HA       THR   9  -0.991   0.222   8.082
   65    HB   THR   9           HB       THR   9  -1.532   1.429  10.089
   66    HG1  THR   9           HG1      THR   9  -3.663   0.961  10.220
   67   1HG2  THR   9          1HG2      THR   9  -1.580   3.739   9.345
   68   2HG2  THR   9          2HG2      THR   9  -2.968   3.423   8.288
   69   3HG2  THR   9          3HG2      THR   9  -3.155   3.361  10.056
   70    H    ASP  10           H        ASP  10  -3.466  -0.074   7.395
   71    HA   ASP  10           HA       ASP  10  -3.640   0.034   4.538
   72   1HB   ASP  10          HB1       ASP  10  -5.660  -0.178   6.877
   73   2HB   ASP  10          HB2       ASP  10  -6.178  -0.314   5.190
   74    H    ARG  11           H        ARG  11  -5.059   2.134   6.909
   75    HA   ARG  11           HA       ARG  11  -6.440   3.810   5.166
   76   1HB   ARG  11          HB1       ARG  11  -6.770   4.103   7.487
   77   2HB   ARG  11          HB2       ARG  11  -5.059   4.139   7.866
   78   1HG   ARG  11          HG1       ARG  11  -6.110   6.393   6.203
   79   2HG   ARG  11          HG2       ARG  11  -6.662   6.226   7.923
   80   1HD   ARG  11          HD1       ARG  11  -4.896   7.605   8.242
   81   2HD   ARG  11          HD2       ARG  11  -4.088   6.048   8.441
   82    HE   ARG  11           HE       ARG  11  -2.804   6.492   6.583
   83   1HH1  ARG  11          2HH2      ARG  11  -5.610   8.582   6.437
   84   2HH1  ARG  11          1HH2      ARG  11  -4.884   9.783   5.409
   85   1HH2  ARG  11          1HH1      ARG  11  -1.736   8.083   5.293
   86   2HH2  ARG  11          2HH1      ARG  11  -2.635   9.436   4.675
   87    H    ASP  12           H        ASP  12  -2.890   3.581   5.502
   88    HA   ASP  12           HA       ASP  12  -2.613   6.227   4.374
   89   1HB   ASP  12          HB1       ASP  12  -1.071   4.868   5.996
   90   2HB   ASP  12          HB2       ASP  12  -0.536   4.059   4.531
   91    H    CYS  13           H        CYS  13  -3.518   3.238   3.062
   92    HA   CYS  13           HA       CYS  13  -3.010   4.346   0.312
   93   1HB   CYS  13          HB1       CYS  13  -2.567   1.666   1.572
   94   2HB   CYS  13          HB2       CYS  13  -2.896   1.747  -0.178
   95    H    VAL  14           H        VAL  14  -5.356   3.802   2.408
   96    HA   VAL  14           HA       VAL  14  -7.391   2.584   1.015
   97    HB   VAL  14           HB       VAL  14  -7.501   3.886   3.075
   98   1HG1  VAL  14          1HG1      VAL  14  -7.187   6.149   3.222
   99   2HG1  VAL  14          2HG1      VAL  14  -5.970   5.590   2.039
  100   3HG1  VAL  14          3HG1      VAL  14  -7.454   6.399   1.479
  101   1HG2  VAL  14          1HG2      VAL  14  -9.501   5.036   1.065
  102   2HG2  VAL  14          2HG2      VAL  14  -9.687   3.496   1.929
  103   3HG2  VAL  14          3HG2      VAL  14  -9.682   5.025   2.831
  104    H    MET  15           H        MET  15  -5.899   5.548   0.190
  105    HA   MET  15           HA       MET  15  -7.550   6.523  -1.879
  106   1HB   MET  15          HB1       MET  15  -5.637   7.886  -2.541
  107   2HB   MET  15          HB2       MET  15  -5.827   7.868  -0.777
  108   1HG   MET  15          HG1       MET  15  -4.048   6.173  -0.604
  109   2HG   MET  15          HG2       MET  15  -3.867   6.176  -2.369
  110   1HE   MET  15          HE1       MET  15  -1.296   6.498  -2.222
  111   2HE   MET  15          HE2       MET  15  -0.515   7.766  -1.249
  112   3HE   MET  15          HE3       MET  15  -1.411   6.456  -0.447
  113    H    CYS  16           H        CYS  16  -5.325   3.899  -1.910
  114    HA   CYS  16           HA       CYS  16  -4.828   3.793  -4.780
  115   1HB   CYS  16          HB1       CYS  16  -4.455   1.870  -2.500
  116   2HB   CYS  16          HB2       CYS  16  -4.090   1.399  -4.187
  117    H    GLY  17           H        GLY  17  -7.549   2.909  -2.743
  118   1HA   GLY  17          HA1       GLY  17  -9.304   2.835  -4.666
  119   2HA   GLY  17          HA2       GLY  17  -8.789   1.287  -4.746
  120    H    LEU  18           H        LEU  18  -8.912  -0.078  -2.868
  121    HA   LEU  18           HA       LEU  18 -11.271   0.526  -1.160
  122   1HB   LEU  18          HB1       LEU  18 -11.077  -1.304  -3.080
  123   2HB   LEU  18          HB2       LEU  18 -10.219  -2.257  -1.926
  124    HG   LEU  18           HG       LEU  18 -12.784  -0.909  -1.232
  125   1HD1  LEU  18          1HD1      LEU  18 -12.638  -3.575  -2.712
  126   2HD1  LEU  18          2HD1      LEU  18 -14.135  -2.825  -2.116
  127   3HD1  LEU  18          3HD1      LEU  18 -13.220  -2.044  -3.409
  128   1HD2  LEU  18          1HD2      LEU  18 -11.685  -3.433  -0.094
  129   2HD2  LEU  18          2HD2      LEU  18 -12.149  -1.874   0.684
  130   3HD2  LEU  18          3HD2      LEU  18 -13.385  -2.956   0.074
  131    H    GLY  19           H        GLY  19 -10.343  -1.986   0.009
  132   1HA   GLY  19          HA1       GLY  19  -8.783  -1.096   2.255
  133   2HA   GLY  19          HA2       GLY  19  -9.503  -2.555   2.110
  134    H    ILE  20           H        ILE  20  -7.447  -0.804   0.095
  135    HA   ILE  20           HA       ILE  20  -5.550  -2.840  -0.642
  136    HB   ILE  20           HB       ILE  20  -5.180   0.193  -0.546
  137   1HG1  ILE  20          1HG1      ILE  20  -6.996  -0.113  -1.953
  138   2HG1  ILE  20          2HG1      ILE  20  -5.603  -0.016  -3.048
  139   1HG2  ILE  20          1HG2      ILE  20  -3.436  -0.141  -2.171
  140   2HG2  ILE  20          2HG2      ILE  20  -3.032  -0.922  -0.664
  141   3HG2  ILE  20          3HG2      ILE  20  -3.604  -1.911  -2.026
  142   1HD1  ILE  20          1HD1      ILE  20  -5.578  -2.511  -3.162
  143   2HD1  ILE  20          2HD1      ILE  20  -7.119  -2.508  -2.263
  144   3HD1  ILE  20          3HD1      ILE  20  -7.020  -1.737  -3.853
  145    H    SER  21           H        SER  21  -5.300  -3.925   1.409
  146    HA   SER  21           HA       SER  21  -4.537  -2.567   3.599
  147   1HB   SER  21          HB1       SER  21  -4.157  -4.855   4.574
  148   2HB   SER  21          HB2       SER  21  -5.688  -4.653   3.689
  149    HG   SER  21           HG       SER  21  -4.740  -6.553   3.038
  150    H    CYS  22           H        CYS  22  -2.729  -2.391   4.889
  151    HA   CYS  22           HA       CYS  22  -0.222  -2.162   3.342
  152   1HB   CYS  22          HB1       CYS  22  -0.855  -0.207   4.421
  153   2HB   CYS  22          HB2       CYS  22  -1.155  -0.954   5.974
  154    H    LYS  23           H        LYS  23   1.202  -3.814   3.397
  155    HA   LYS  23           HA       LYS  23   1.153  -5.787   5.614
  156   1HB   LYS  23          HB1       LYS  23   2.614  -5.606   2.976
  157   2HB   LYS  23          HB2       LYS  23   2.910  -6.867   4.210
  158   1HG   LYS  23          HG1       LYS  23   1.413  -7.702   2.495
  159   2HG   LYS  23          HG2       LYS  23   0.589  -7.625   4.057
  160   1HD   LYS  23          HD1       LYS  23  -0.697  -5.726   3.377
  161   2HD   LYS  23          HD2       LYS  23   0.310  -5.441   1.950
  162   1HE   LYS  23          HE1       LYS  23  -0.534  -7.569   0.968
  163   2HE   LYS  23          HE2       LYS  23  -1.556  -7.816   2.398
  164   1HZ   LYS  23          HZ1       LYS  23  -1.739  -5.540   0.517
  165   2HZ   LYS  23          HZ2       LYS  23  -2.780  -6.800   0.594
  166   3HZ   LYS  23          HZ3       LYS  23  -2.708  -5.742   1.843
  167    H    ASN  24           H        ASN  24   3.752  -6.211   6.156
  168    HA   ASN  24           HA       ASN  24   4.737  -5.154   8.096
  169   1HB   ASN  24          HB1       ASN  24   6.411  -5.151   5.721
  170   2HB   ASN  24          HB2       ASN  24   7.032  -4.825   7.336
  171   1HD2  ASN  24          1HD2      ASN  24   5.788  -7.277   5.121
  172   2HD2  ASN  24          2HD2      ASN  24   6.048  -8.633   6.206
  173    H    GLY  25           H        GLY  25   5.641  -3.037   5.430
  174   1HA   GLY  25          HA1       GLY  25   4.343  -0.804   6.548
  175   2HA   GLY  25          HA2       GLY  25   5.956  -0.568   6.459
  176    H    TYR  26           H        TYR  26   3.949  -2.385   4.330
  177    HA   TYR  26           HA       TYR  26   4.996  -0.945   1.973
  178   1HB   TYR  26          HB1       TYR  26   6.280  -2.978   3.061
  179   2HB   TYR  26          HB2       TYR  26   5.058  -3.885   2.182
  180    HD1  TYR  26           HD1      TYR  26   7.298  -0.933   1.458
  181    HD2  TYR  26           HD2      TYR  26   6.140  -4.934   0.373
  182    HE1  TYR  26           HE1      TYR  26   9.006  -0.956  -0.327
  183    HE2  TYR  26           HE2      TYR  26   7.687  -4.864  -1.546
  184    HH   TYR  26           HH       TYR  26   9.007  -3.436  -2.884
  185    H    CYS  27           H        CYS  27   3.256  -0.621   0.439
  186    HA   CYS  27           HA       CYS  27   0.719  -1.832   1.395
  187   1HB   CYS  27          HB1       CYS  27   0.076   0.127   1.558
  188   2HB   CYS  27          HB2       CYS  27   1.540   0.800   0.851
  189    H    GLN  28           H        GLN  28   1.611  -3.717   0.440
  190    HA   GLN  28           HA       GLN  28   1.675  -4.026  -2.417
  191   1HB   GLN  28          HB1       GLN  28   1.367  -6.165  -0.282
  192   2HB   GLN  28          HB2       GLN  28   1.953  -6.387  -1.947
  193   1HG   GLN  28          HG1       GLN  28   3.306  -4.783   0.269
  194   2HG   GLN  28          HG2       GLN  28   3.837  -6.347  -0.417
  195   1HE2  GLN  28          1HE2      GLN  28   3.832  -2.829  -0.881
  196   2HE2  GLN  28          2HE2      GLN  28   4.941  -2.872  -2.231
  197    H    GLY  29           H        GLY  29  -0.034  -3.800  -3.660
  198   1HA   GLY  29          HA1       GLY  29  -2.209  -5.234  -3.985
  199   2HA   GLY  29          HA2       GLY  29  -2.701  -4.267  -2.764
  200    H    CYS  30           H        CYS  30  -1.531  -1.894  -3.264
  201    HA   CYS  30           HA       CYS  30  -3.285  -0.478  -4.386
  202   1HB   CYS  30          HB1       CYS  30  -1.243   0.373  -3.386
  203   2HB   CYS  30          HB2       CYS  30  -0.326   0.003  -4.848
  204    H    THR  31           H        THR  31  -0.623  -1.347  -6.631
  205    HA   THR  31           HA       THR  31  -2.333  -0.790  -8.951
  206    HB   THR  31           HB       THR  31  -0.051  -0.328  -9.263
  207    HG1  THR  31           HG1      THR  31  -0.821  -2.718 -10.561
  208   1HG2  THR  31          1HG2      THR  31   1.056  -1.716  -7.623
  209   2HG2  THR  31          2HG2      THR  31   0.509  -3.201  -8.443
  210   3HG2  THR  31          3HG2      THR  31   1.663  -2.104  -9.236
  Start of MODEL   12
    1   1H    THR   1           H        THR   1   9.055  -3.248 -12.449
    2    HA   THR   1           HA       THR   1   9.219  -0.405 -11.993
    3    HB   THR   1           HB       THR   1   6.635  -0.978 -11.871
    4    HG1  THR   1           HG1      THR   1   6.187  -2.989 -12.782
    5   1HG2  THR   1          1HG2      THR   1   6.532  -1.117 -14.328
    6   2HG2  THR   1          2HG2      THR   1   7.747   0.071 -13.825
    7   3HG2  THR   1          3HG2      THR   1   8.259  -1.532 -14.393
    8    HA   PRO   2           HA       PRO   2   9.354  -2.368  -7.891
    9   1HB   PRO   2          HB1       PRO   2  11.844  -0.950  -7.198
   10   2HB   PRO   2          HB2       PRO   2  11.443  -2.652  -7.024
   11   1HG   PRO   2          HG1       PRO   2  13.003  -1.801  -9.088
   12   2HG   PRO   2          HG2       PRO   2  11.736  -3.077  -9.399
   13   1HD   PRO   2          HD1       PRO   2  11.443  -0.061  -9.577
   14   2HD   PRO   2          HD2       PRO   2  11.319  -1.047 -10.938
   15    H    TYR   3           H        TYR   3   7.430  -0.398  -8.056
   16    HA   TYR   3           HA       TYR   3   7.905   1.963  -6.720
   17   1HB   TYR   3          HB1       TYR   3   5.334   0.369  -6.941
   18   2HB   TYR   3          HB2       TYR   3   5.583   2.125  -6.828
   19    HD1  TYR   3           HD1      TYR   3   7.533   2.796  -8.850
   20    HD2  TYR   3           HD2      TYR   3   4.268  -0.024  -8.990
   21    HE1  TYR   3           HE1      TYR   3   7.422   3.047 -11.300
   22    HE2  TYR   3           HE2      TYR   3   4.121   0.284 -11.443
   23    HH   TYR   3           HH       TYR   3   6.303   2.466 -13.238
   24    HA   PRO   4           HA       PRO   4   7.996  -0.002  -2.600
   25   1HB   PRO   4          HB1       PRO   4   8.825   2.067  -1.101
   26   2HB   PRO   4          HB2       PRO   4   9.902   1.308  -2.324
   27   1HG   PRO   4          HG1       PRO   4   8.212   3.803  -2.657
   28   2HG   PRO   4          HG2       PRO   4   9.962   3.616  -3.004
   29   1HD   PRO   4          HD1       PRO   4   8.026   3.353  -4.942
   30   2HD   PRO   4          HD2       PRO   4   9.517   2.366  -4.953
   31    H    VAL   5           H        VAL   5   5.394   0.159  -3.406
   32    HA   VAL   5           HA       VAL   5   4.045   2.223  -2.241
   33    HB   VAL   5           HB       VAL   5   2.257   0.028  -2.559
   34   1HG1  VAL   5          1HG1      VAL   5   1.508   1.615  -4.355
   35   2HG1  VAL   5          2HG1      VAL   5   2.112   2.508  -2.902
   36   3HG1  VAL   5          3HG1      VAL   5   3.174   2.286  -4.337
   37   1HG2  VAL   5          1HG2      VAL   5   2.539  -0.681  -4.842
   38   2HG2  VAL   5          2HG2      VAL   5   4.076   0.179  -4.979
   39   3HG2  VAL   5          3HG2      VAL   5   3.923  -1.222  -3.890
   40    H    ASN   6           H        ASN   6   4.209   2.640  -0.283
   41    HA   ASN   6           HA       ASN   6   4.143   0.575   1.761
   42   1HB   ASN   6          HB1       ASN   6   5.630   3.073   1.008
   43   2HB   ASN   6          HB2       ASN   6   5.494   2.627   2.677
   44   1HD2  ASN   6          1HD2      ASN   6   7.965   2.539   2.478
   45   2HD2  ASN   6          2HD2      ASN   6   8.666   1.057   1.847
   46    H    CYS   7           H        CYS   7   3.981   1.574   3.820
   47    HA   CYS   7           HA       CYS   7   1.545   3.263   4.144
   48   1HB   CYS   7          HB1       CYS   7   0.232   1.307   5.001
   49   2HB   CYS   7          HB2       CYS   7   0.624   1.265   3.258
   50    H    LYS   8           H        LYS   8   1.431   4.170   6.044
   51    HA   LYS   8           HA       LYS   8   2.726   3.187   8.475
   52   1HB   LYS   8          HB1       LYS   8   0.599   5.287   7.905
   53   2HB   LYS   8          HB2       LYS   8   1.241   4.937   9.532
   54   1HG   LYS   8          HG1       LYS   8   3.491   5.465   8.829
   55   2HG   LYS   8          HG2       LYS   8   3.013   5.666   7.155
   56   1HD   LYS   8          HD1       LYS   8   2.120   7.384   9.520
   57   2HD   LYS   8          HD2       LYS   8   3.401   7.823   8.374
   58   1HE   LYS   8          HE1       LYS   8   0.439   7.474   7.758
   59   2HE   LYS   8          HE2       LYS   8   1.298   9.020   7.874
   60   1HZ   LYS   8          HZ1       LYS   8   1.909   6.922   5.883
   61   2HZ   LYS   8          HZ2       LYS   8   0.875   8.060   5.599
   62   3HZ   LYS   8          HZ3       LYS   8   2.475   8.488   5.862
   63    H    THR   9           H        THR   9  -0.365   2.690   6.796
   64    HA   THR   9           HA       THR   9  -1.054   0.364   8.233
   65    HB   THR   9           HB       THR   9  -1.727   1.722  10.086
   66    HG1  THR   9           HG1      THR   9  -3.894   1.293  10.125
   67   1HG2  THR   9          1HG2      THR   9  -1.749   3.954   9.175
   68   2HG2  THR   9          2HG2      THR   9  -3.036   3.543   8.030
   69   3HG2  THR   9          3HG2      THR   9  -3.379   3.627   9.773
   70    H    ASP  10           H        ASP  10  -3.576  -0.044   7.491
   71    HA   ASP  10           HA       ASP  10  -3.476  -0.081   4.561
   72   1HB   ASP  10          HB1       ASP  10  -4.708  -1.863   5.640
   73   2HB   ASP  10          HB2       ASP  10  -5.596  -0.695   6.662
   74    H    ARG  11           H        ARG  11  -5.112   1.972   6.913
   75    HA   ARG  11           HA       ARG  11  -6.468   3.546   5.050
   76   1HB   ARG  11          HB1       ARG  11  -6.829   3.785   7.446
   77   2HB   ARG  11          HB2       ARG  11  -5.153   4.188   7.761
   78   1HG   ARG  11          HG1       ARG  11  -6.849   5.934   5.977
   79   2HG   ARG  11          HG2       ARG  11  -6.957   6.007   7.766
   80   1HD   ARG  11          HD1       ARG  11  -5.339   7.553   7.678
   81   2HD   ARG  11          HD2       ARG  11  -4.209   6.252   7.261
   82    HE   ARG  11           HE       ARG  11  -4.941   6.732   4.852
   83   1HH1  ARG  11          2HH2      ARG  11  -4.893   9.381   7.209
   84   2HH1  ARG  11          1HH2      ARG  11  -4.414  10.570   6.045
   85   1HH2  ARG  11          1HH1      ARG  11  -4.176   8.226   3.379
   86   2HH2  ARG  11          2HH1      ARG  11  -4.026   9.901   3.797
   87    H    ASP  12           H        ASP  12  -2.954   3.452   5.611
   88    HA   ASP  12           HA       ASP  12  -2.625   6.105   4.564
   89   1HB   ASP  12          HB1       ASP  12  -1.169   4.673   6.159
   90   2HB   ASP  12          HB2       ASP  12  -0.607   3.853   4.708
   91    H    CYS  13           H        CYS  13  -3.386   3.070   3.150
   92    HA   CYS  13           HA       CYS  13  -2.648   4.051   0.406
   93   1HB   CYS  13          HB1       CYS  13  -2.744   1.339   1.749
   94   2HB   CYS  13          HB2       CYS  13  -2.688   1.478  -0.023
   95    H    VAL  14           H        VAL  14  -5.235   3.688   2.377
   96    HA   VAL  14           HA       VAL  14  -7.161   2.478   0.794
   97    HB   VAL  14           HB       VAL  14  -7.388   3.654   2.924
   98   1HG1  VAL  14          1HG1      VAL  14  -7.229   5.933   3.173
   99   2HG1  VAL  14          2HG1      VAL  14  -5.933   5.461   2.038
  100   3HG1  VAL  14          3HG1      VAL  14  -7.416   6.225   1.418
  101   1HG2  VAL  14          1HG2      VAL  14  -9.620   4.712   2.619
  102   2HG2  VAL  14          2HG2      VAL  14  -9.363   4.762   0.862
  103   3HG2  VAL  14          3HG2      VAL  14  -9.510   3.201   1.697
  104    H    MET  15           H        MET  15  -5.525   5.397   0.238
  105    HA   MET  15           HA       MET  15  -7.031   6.597  -1.846
  106   1HB   MET  15          HB1       MET  15  -5.020   7.884  -2.349
  107   2HB   MET  15          HB2       MET  15  -5.325   7.803  -0.602
  108   1HG   MET  15          HG1       MET  15  -3.658   5.994  -0.413
  109   2HG   MET  15          HG2       MET  15  -3.329   6.103  -2.141
  110   1HE   MET  15          HE1       MET  15  -3.279   9.338  -2.610
  111   2HE   MET  15          HE2       MET  15  -1.528   9.571  -2.446
  112   3HE   MET  15          HE3       MET  15  -2.152   8.150  -3.315
  113    H    CYS  16           H        CYS  16  -4.909   3.879  -1.923
  114    HA   CYS  16           HA       CYS  16  -4.325   3.837  -4.768
  115   1HB   CYS  16          HB1       CYS  16  -4.216   1.826  -2.524
  116   2HB   CYS  16          HB2       CYS  16  -3.781   1.420  -4.225
  117    H    GLY  17           H        GLY  17  -7.098   2.838  -2.776
  118   1HA   GLY  17          HA1       GLY  17  -8.757   2.370  -4.883
  119   2HA   GLY  17          HA2       GLY  17  -8.148   0.906  -4.493
  120    H    LEU  18           H        LEU  18  -8.635  -0.120  -2.501
  121    HA   LEU  18           HA       LEU  18 -11.006   0.994  -1.045
  122   1HB   LEU  18          HB1       LEU  18 -11.655  -0.439  -2.634
  123   2HB   LEU  18          HB2       LEU  18 -10.589  -1.709  -2.052
  124    HG   LEU  18           HG       LEU  18 -11.727  -1.872  -0.027
  125   1HD1  LEU  18          1HD1      LEU  18 -13.599  -0.434   0.790
  126   2HD1  LEU  18          2HD1      LEU  18 -12.050   0.395   0.860
  127   3HD1  LEU  18          3HD1      LEU  18 -13.201   0.766  -0.449
  128   1HD2  LEU  18          1HD2      LEU  18 -13.632  -0.909  -2.098
  129   2HD2  LEU  18          2HD2      LEU  18 -12.864  -2.542  -2.090
  130   3HD2  LEU  18          3HD2      LEU  18 -14.089  -2.122  -0.841
  131    H    GLY  19           H        GLY  19  -9.723  -2.074  -0.340
  132   1HA   GLY  19          HA1       GLY  19  -8.572  -1.288   2.203
  133   2HA   GLY  19          HA2       GLY  19  -9.268  -2.731   1.887
  134    H    ILE  20           H        ILE  20  -7.050  -0.783   0.239
  135    HA   ILE  20           HA       ILE  20  -5.314  -2.854  -0.746
  136    HB   ILE  20           HB       ILE  20  -4.813   0.140  -0.505
  137   1HG1  ILE  20          1HG1      ILE  20  -6.701   0.085  -1.772
  138   2HG1  ILE  20          2HG1      ILE  20  -5.426   0.024  -3.004
  139   1HG2  ILE  20          1HG2      ILE  20  -3.095  -0.074  -2.061
  140   2HG2  ILE  20          2HG2      ILE  20  -2.774  -1.354  -0.908
  141   3HG2  ILE  20          3HG2      ILE  20  -3.535  -1.738  -2.466
  142   1HD1  ILE  20          1HD1      ILE  20  -7.062  -1.510  -3.697
  143   2HD1  ILE  20          2HD1      ILE  20  -5.720  -2.482  -3.058
  144   3HD1  ILE  20          3HD1      ILE  20  -7.196  -2.247  -2.095
  145    H    SER  21           H        SER  21  -4.920  -4.119   0.972
  146    HA   SER  21           HA       SER  21  -4.581  -3.272   3.494
  147   1HB   SER  21          HB1       SER  21  -3.497  -5.958   2.980
  148   2HB   SER  21          HB2       SER  21  -4.879  -5.443   3.974
  149    HG   SER  21           HG       SER  21  -6.052  -5.173   1.964
  150    H    CYS  22           H        CYS  22  -2.961  -2.409   4.646
  151    HA   CYS  22           HA       CYS  22  -0.244  -2.368   3.667
  152   1HB   CYS  22          HB1       CYS  22  -0.990  -0.473   4.703
  153   2HB   CYS  22          HB2       CYS  22  -1.459  -1.255   6.193
  154    H    LYS  23           H        LYS  23   0.981  -4.144   3.674
  155    HA   LYS  23           HA       LYS  23   1.023  -6.101   5.907
  156   1HB   LYS  23          HB1       LYS  23   2.774  -5.953   3.524
  157   2HB   LYS  23          HB2       LYS  23   2.567  -7.253   4.744
  158   1HG   LYS  23          HG1       LYS  23   0.153  -7.383   4.141
  159   2HG   LYS  23          HG2       LYS  23   0.380  -6.225   2.847
  160   1HD   LYS  23          HD1       LYS  23   2.208  -8.625   3.065
  161   2HD   LYS  23          HD2       LYS  23   0.546  -8.823   2.441
  162   1HE   LYS  23          HE1       LYS  23   2.340  -8.517   0.677
  163   2HE   LYS  23          HE2       LYS  23   0.973  -7.383   0.603
  164   1HZ   LYS  23          HZ1       LYS  23   3.055  -6.290   0.234
  165   2HZ   LYS  23          HZ2       LYS  23   2.390  -5.701   1.612
  166   3HZ   LYS  23          HZ3       LYS  23   3.629  -6.775   1.691
  167    H    ASN  24           H        ASN  24   3.667  -6.424   6.295
  168    HA   ASN  24           HA       ASN  24   5.071  -4.838   7.826
  169   1HB   ASN  24          HB1       ASN  24   6.263  -6.349   5.645
  170   2HB   ASN  24          HB2       ASN  24   7.084  -5.797   7.082
  171   1HD2  ASN  24          1HD2      ASN  24   7.275  -7.448   8.621
  172   2HD2  ASN  24          2HD2      ASN  24   6.118  -8.755   8.803
  173    H    GLY  25           H        GLY  25   4.173  -2.715   6.937
  174   1HA   GLY  25          HA1       GLY  25   4.618  -0.639   6.313
  175   2HA   GLY  25          HA2       GLY  25   6.177  -1.009   6.000
  176    H    TYR  26           H        TYR  26   3.877  -2.926   4.352
  177    HA   TYR  26           HA       TYR  26   4.391  -1.467   1.808
  178   1HB   TYR  26          HB1       TYR  26   6.118  -3.284   2.542
  179   2HB   TYR  26          HB2       TYR  26   4.910  -4.347   1.834
  180    HD1  TYR  26           HD1      TYR  26   7.886  -2.726   1.177
  181    HD2  TYR  26           HD2      TYR  26   4.002  -3.315  -0.619
  182    HE1  TYR  26           HE1      TYR  26   8.863  -2.390  -1.070
  183    HE2  TYR  26           HE2      TYR  26   4.994  -2.971  -2.852
  184    HH   TYR  26           HH       TYR  26   6.981  -1.963  -3.955
  185    H    CYS  27           H        CYS  27   2.345  -1.229   0.753
  186    HA   CYS  27           HA       CYS  27   0.271  -3.007   1.716
  187   1HB   CYS  27          HB1       CYS  27  -1.198  -1.262   1.257
  188   2HB   CYS  27          HB2       CYS  27   0.215  -0.574   2.073
  189    H    GLN  28           H        GLN  28  -1.133  -4.130   0.501
  190    HA   GLN  28           HA       GLN  28   0.057  -4.996  -2.063
  191   1HB   GLN  28          HB1       GLN  28  -1.947  -6.735  -1.724
  192   2HB   GLN  28          HB2       GLN  28  -0.333  -6.937  -1.033
  193   1HG   GLN  28          HG1       GLN  28  -1.115  -6.104   1.118
  194   2HG   GLN  28          HG2       GLN  28  -2.688  -5.669   0.438
  195   1HE2  GLN  28          1HE2      GLN  28  -4.258  -7.097   1.199
  196   2HE2  GLN  28          2HE2      GLN  28  -3.994  -8.829   1.310
  197    H    GLY  29           H        GLY  29  -0.739  -4.666  -4.009
  198   1HA   GLY  29          HA1       GLY  29  -2.297  -4.735  -5.613
  199   2HA   GLY  29          HA2       GLY  29  -3.462  -4.934  -4.486
  200    H    CYS  30           H        CYS  30  -1.383  -2.230  -4.732
  201    HA   CYS  30           HA       CYS  30  -3.276  -0.459  -4.413
  202   1HB   CYS  30          HB1       CYS  30  -1.027   0.021  -3.850
  203   2HB   CYS  30          HB2       CYS  30  -0.484  -0.141  -5.534
  204    H    THR  31           H        THR  31  -4.870  -1.077  -5.968
  205    HA   THR  31           HA       THR  31  -5.057   0.958  -8.038
  206    HB   THR  31           HB       THR  31  -3.998  -0.763  -9.355
  207    HG1  THR  31           HG1      THR  31  -5.644  -0.971 -10.884
  208   1HG2  THR  31          1HG2      THR  31  -4.537  -2.740  -7.999
  209   2HG2  THR  31          2HG2      THR  31  -6.254  -2.587  -8.422
  210   3HG2  THR  31          3HG2      THR  31  -5.055  -2.981  -9.676
  Start of MODEL   13
    1   1H    THR   1           H        THR   1   6.213  -7.436  -5.423
    2    HA   THR   1           HA       THR   1   6.004  -6.211  -8.110
    3    HB   THR   1           HB       THR   1   3.794  -6.225  -7.275
    4    HG1  THR   1           HG1      THR   1   4.350  -4.390  -8.374
    5   1HG2  THR   1          1HG2      THR   1   3.006  -5.142  -5.285
    6   2HG2  THR   1          2HG2      THR   1   4.163  -6.400  -4.834
    7   3HG2  THR   1          3HG2      THR   1   4.635  -4.689  -4.786
    8    HA   PRO   2           HA       PRO   2   9.514  -4.839  -5.731
    9   1HB   PRO   2          HB1       PRO   2  10.969  -4.822  -8.319
   10   2HB   PRO   2          HB2       PRO   2  11.537  -5.299  -6.726
   11   1HG   PRO   2          HG1       PRO   2  10.644  -7.189  -8.446
   12   2HG   PRO   2          HG2       PRO   2  10.110  -7.283  -6.705
   13   1HD   PRO   2          HD1       PRO   2   8.743  -5.887  -9.030
   14   2HD   PRO   2          HD2       PRO   2   8.042  -7.183  -8.189
   15    H    TYR   3           H        TYR   3   7.505  -2.832  -6.439
   16    HA   TYR   3           HA       TYR   3   9.055  -0.458  -7.200
   17   1HB   TYR   3          HB1       TYR   3   6.178  -1.395  -7.210
   18   2HB   TYR   3          HB2       TYR   3   6.548   0.298  -6.945
   19    HD1  TYR   3           HD1      TYR   3   7.208   1.712  -8.845
   20    HD2  TYR   3           HD2      TYR   3   6.899  -2.564  -9.309
   21    HE1  TYR   3           HE1      TYR   3   7.493   1.953 -11.298
   22    HE2  TYR   3           HE2      TYR   3   7.187  -2.320 -11.755
   23    HH   TYR   3           HH       TYR   3   7.518  -0.855 -13.506
   24    HA   PRO   4           HA       PRO   4   8.906   0.128  -2.753
   25   1HB   PRO   4          HB1       PRO   4   9.231   2.796  -2.460
   26   2HB   PRO   4          HB2       PRO   4  10.502   1.768  -3.210
   27   1HG   PRO   4          HG1       PRO   4   8.373   3.388  -4.642
   28   2HG   PRO   4          HG2       PRO   4  10.145   3.442  -4.916
   29   1HD   PRO   4          HD1       PRO   4   8.492   1.873  -6.438
   30   2HD   PRO   4          HD2       PRO   4  10.119   1.305  -5.953
   31    H    VAL   5           H        VAL   5   6.286  -0.498  -3.663
   32    HA   VAL   5           HA       VAL   5   4.581   1.618  -3.009
   33    HB   VAL   5           HB       VAL   5   3.099  -0.752  -2.985
   34   1HG1  VAL   5          1HG1      VAL   5   3.951   1.101  -5.185
   35   2HG1  VAL   5          2HG1      VAL   5   2.358   0.257  -5.142
   36   3HG1  VAL   5          3HG1      VAL   5   2.757   1.506  -3.897
   37   1HG2  VAL   5          1HG2      VAL   5   5.107  -1.072  -5.216
   38   2HG2  VAL   5          2HG2      VAL   5   4.970  -2.135  -3.791
   39   3HG2  VAL   5          3HG2      VAL   5   3.636  -2.015  -4.951
   40    H    ASN   6           H        ASN   6   4.569   2.334  -1.153
   41    HA   ASN   6           HA       ASN   6   4.946   0.656   1.201
   42   1HB   ASN   6          HB1       ASN   6   5.725   3.344   0.076
   43   2HB   ASN   6          HB2       ASN   6   5.804   3.004   1.779
   44   1HD2  ASN   6          1HD2      ASN   6   8.171   3.713   1.031
   45   2HD2  ASN   6          2HD2      ASN   6   9.218   2.364   0.626
   46    H    CYS   7           H        CYS   7   4.399   1.920   3.093
   47    HA   CYS   7           HA       CYS   7   2.305   3.838   3.311
   48   1HB   CYS   7          HB1       CYS   7   0.673   2.126   4.392
   49   2HB   CYS   7          HB2       CYS   7   0.741   2.325   2.606
   50    H    LYS   8           H        LYS   8   1.759   4.295   5.449
   51    HA   LYS   8           HA       LYS   8   3.428   3.216   7.626
   52   1HB   LYS   8          HB1       LYS   8   1.075   5.147   7.512
   53   2HB   LYS   8          HB2       LYS   8   1.922   4.694   9.014
   54   1HG   LYS   8          HG1       LYS   8   4.003   5.569   8.203
   55   2HG   LYS   8          HG2       LYS   8   3.383   5.830   6.581
   56   1HD   LYS   8          HD1       LYS   8   2.435   7.262   9.107
   57   2HD   LYS   8          HD2       LYS   8   3.627   7.919   7.968
   58   1HE   LYS   8          HE1       LYS   8   0.696   7.309   7.395
   59   2HE   LYS   8          HE2       LYS   8   1.402   8.922   7.614
   60   1HZ   LYS   8          HZ1       LYS   8   2.094   7.052   5.434
   61   2HZ   LYS   8          HZ2       LYS   8   1.015   8.173   5.280
   62   3HZ   LYS   8          HZ3       LYS   8   2.600   8.634   5.547
   63    H    THR   9           H        THR   9  -0.135   3.321   6.982
   64    HA   THR   9           HA       THR   9  -0.439   0.477   7.710
   65    HB   THR   9           HB       THR   9  -2.390   1.155   9.085
   66    HG1  THR   9           HG1      THR   9  -2.510   3.382   9.680
   67   1HG2  THR   9          1HG2      THR   9   0.108   2.621  10.010
   68   2HG2  THR   9          2HG2      THR   9  -1.177   1.955  11.038
   69   3HG2  THR   9          3HG2      THR   9  -0.108   0.860  10.138
   70    H    ASP  10           H        ASP  10  -2.941  -0.028   7.194
   71    HA   ASP  10           HA       ASP  10  -3.401   0.052   4.485
   72   1HB   ASP  10          HB1       ASP  10  -5.341   0.116   6.901
   73   2HB   ASP  10          HB2       ASP  10  -5.851  -0.328   5.269
   74    H    ARG  11           H        ARG  11  -4.804   2.305   6.719
   75    HA   ARG  11           HA       ARG  11  -6.245   3.747   4.785
   76   1HB   ARG  11          HB1       ARG  11  -6.207   5.677   6.298
   77   2HB   ARG  11          HB2       ARG  11  -6.468   4.156   7.205
   78   1HG   ARG  11          HG1       ARG  11  -4.859   5.027   8.551
   79   2HG   ARG  11          HG2       ARG  11  -3.798   4.285   7.331
   80   1HD   ARG  11          HD1       ARG  11  -2.997   6.517   7.843
   81   2HD   ARG  11          HD2       ARG  11  -3.638   6.522   6.186
   82    HE   ARG  11           HE       ARG  11  -5.273   7.973   6.785
   83   1HH1  ARG  11          2HH2      ARG  11  -3.821   6.678   9.712
   84   2HH1  ARG  11          1HH2      ARG  11  -4.513   7.850  10.793
   85   1HH2  ARG  11          1HH1      ARG  11  -6.251   9.545   8.177
   86   2HH2  ARG  11          2HH1      ARG  11  -5.955   9.513   9.884
   87    H    ASP  12           H        ASP  12  -2.736   3.702   5.172
   88    HA   ASP  12           HA       ASP  12  -2.450   6.257   3.912
   89   1HB   ASP  12          HB1       ASP  12  -1.004   4.835   5.601
   90   2HB   ASP  12          HB2       ASP  12  -0.407   4.033   4.160
   91    H    CYS  13           H        CYS  13  -3.298   3.143   2.761
   92    HA   CYS  13           HA       CYS  13  -2.874   4.109  -0.053
   93   1HB   CYS  13          HB1       CYS  13  -2.108   1.625   1.348
   94   2HB   CYS  13          HB2       CYS  13  -2.803   1.357  -0.271
   95    H    VAL  14           H        VAL  14  -5.145   3.607   2.076
   96    HA   VAL  14           HA       VAL  14  -7.197   2.261   0.792
   97    HB   VAL  14           HB       VAL  14  -7.363   3.740   2.712
   98   1HG1  VAL  14          1HG1      VAL  14  -7.289   6.125   0.936
   99   2HG1  VAL  14          2HG1      VAL  14  -7.019   5.980   2.692
  100   3HG1  VAL  14          3HG1      VAL  14  -5.800   5.357   1.538
  101   1HG2  VAL  14          1HG2      VAL  14  -9.308   4.714   0.562
  102   2HG2  VAL  14          2HG2      VAL  14  -9.526   3.271   1.575
  103   3HG2  VAL  14          3HG2      VAL  14  -9.520   4.883   2.316
  104    H    MET  15           H        MET  15  -5.811   5.195  -0.291
  105    HA   MET  15           HA       MET  15  -7.475   5.876  -2.469
  106   1HB   MET  15          HB1       MET  15  -5.672   7.390  -3.098
  107   2HB   MET  15          HB2       MET  15  -5.939   7.414  -1.343
  108   1HG   MET  15          HG1       MET  15  -4.025   5.837  -1.075
  109   2HG   MET  15          HG2       MET  15  -3.763   5.905  -2.831
  110   1HE   MET  15          HE1       MET  15  -2.805   9.288   0.148
  111   2HE   MET  15          HE2       MET  15  -4.482   8.770  -0.129
  112   3HE   MET  15          HE3       MET  15  -3.306   7.644   0.600
  113    H    CYS  16           H        CYS  16  -5.133   3.400  -2.230
  114    HA   CYS  16           HA       CYS  16  -4.400   3.220  -5.055
  115   1HB   CYS  16          HB1       CYS  16  -3.941   1.553  -2.615
  116   2HB   CYS  16          HB2       CYS  16  -3.652   0.816  -4.242
  117    H    GLY  17           H        GLY  17  -7.149   2.194  -3.104
  118   1HA   GLY  17          HA1       GLY  17  -8.621   1.745  -5.376
  119   2HA   GLY  17          HA2       GLY  17  -8.213   0.269  -4.807
  120    H    LEU  18           H        LEU  18  -8.725  -0.312  -2.597
  121    HA   LEU  18           HA       LEU  18 -11.204   1.007  -1.510
  122   1HB   LEU  18          HB1       LEU  18 -11.891  -0.481  -2.999
  123   2HB   LEU  18          HB2       LEU  18 -10.911  -1.772  -2.321
  124    HG   LEU  18           HG       LEU  18 -12.081  -1.713  -0.277
  125   1HD1  LEU  18          1HD1      LEU  18 -13.968  -0.159   0.286
  126   2HD1  LEU  18          2HD1      LEU  18 -12.403   0.639   0.359
  127   3HD1  LEU  18          3HD1      LEU  18 -13.469   0.897  -1.045
  128   1HD2  LEU  18          1HD2      LEU  18 -14.411  -2.010  -1.180
  129   2HD2  LEU  18          2HD2      LEU  18 -13.868  -0.929  -2.520
  130   3HD2  LEU  18          3HD2      LEU  18 -13.131  -2.566  -2.321
  131    H    GLY  19           H        GLY  19  -9.965  -2.081  -0.679
  132   1HA   GLY  19          HA1       GLY  19  -9.023  -1.259   1.934
  133   2HA   GLY  19          HA2       GLY  19  -9.700  -2.704   1.587
  134    H    ILE  20           H        ILE  20  -7.295  -0.858  -0.029
  135    HA   ILE  20           HA       ILE  20  -5.450  -3.049  -0.456
  136    HB   ILE  20           HB       ILE  20  -4.848  -0.056  -0.585
  137   1HG1  ILE  20          1HG1      ILE  20  -6.631  -0.313  -2.065
  138   2HG1  ILE  20          2HG1      ILE  20  -5.160  -0.410  -3.062
  139   1HG2  ILE  20          1HG2      ILE  20  -3.419  -2.341  -1.934
  140   2HG2  ILE  20          2HG2      ILE  20  -3.058  -0.593  -1.951
  141   3HG2  ILE  20          3HG2      ILE  20  -2.859  -1.502  -0.471
  142   1HD1  ILE  20          1HD1      ILE  20  -6.921  -2.720  -2.229
  143   2HD1  ILE  20          2HD1      ILE  20  -6.689  -2.048  -3.852
  144   3HD1  ILE  20          3HD1      ILE  20  -5.347  -2.886  -3.046
  145    H    SER  21           H        SER  21  -5.558  -3.917   1.760
  146    HA   SER  21           HA       SER  21  -4.602  -2.450   3.889
  147   1HB   SER  21          HB1       SER  21  -4.481  -4.742   4.982
  148   2HB   SER  21          HB2       SER  21  -6.026  -4.350   4.186
  149    HG   SER  21           HG       SER  21  -5.618  -6.278   3.370
  150    H    CYS  22           H        CYS  22  -2.603  -2.682   5.183
  151    HA   CYS  22           HA       CYS  22  -0.338  -2.826   3.295
  152   1HB   CYS  22          HB1       CYS  22  -1.514  -0.955   5.226
  153   2HB   CYS  22          HB2       CYS  22   0.240  -0.948   5.273
  154    H    LYS  23           H        LYS  23   1.052  -4.292   3.576
  155    HA   LYS  23           HA       LYS  23   1.273  -5.872   6.059
  156   1HB   LYS  23          HB1       LYS  23   2.561  -6.080   3.313
  157   2HB   LYS  23          HB2       LYS  23   2.947  -7.149   4.706
  158   1HG   LYS  23          HG1       LYS  23   1.448  -8.396   3.496
  159   2HG   LYS  23          HG2       LYS  23   0.498  -7.738   4.822
  160   1HD   LYS  23          HD1       LYS  23   0.307  -5.926   2.575
  161   2HD   LYS  23          HD2       LYS  23   0.083  -7.589   1.969
  162   1HE   LYS  23          HE1       LYS  23  -1.686  -7.940   3.693
  163   2HE   LYS  23          HE2       LYS  23  -1.482  -6.255   4.230
  164   1HZ   LYS  23          HZ1       LYS  23  -2.148  -5.549   2.026
  165   2HZ   LYS  23          HZ2       LYS  23  -2.433  -7.110   1.560
  166   3HZ   LYS  23          HZ3       LYS  23  -3.322  -6.387   2.752
  167    H    ASN  24           H        ASN  24   4.132  -6.162   5.920
  168    HA   ASN  24           HA       ASN  24   5.133  -4.410   7.676
  169   1HB   ASN  24          HB1       ASN  24   6.649  -5.920   5.702
  170   2HB   ASN  24          HB2       ASN  24   7.349  -5.094   7.092
  171   1HD2  ASN  24          1HD2      ASN  24   6.049  -8.036   5.964
  172   2HD2  ASN  24          2HD2      ASN  24   5.717  -8.756   7.530
  173    H    GLY  25           H        GLY  25   4.156  -2.449   6.800
  174   1HA   GLY  25          HA1       GLY  25   4.279  -0.354   6.111
  175   2HA   GLY  25          HA2       GLY  25   5.899  -0.459   5.934
  176    H    TYR  26           H        TYR  26   3.705  -2.567   4.314
  177    HA   TYR  26           HA       TYR  26   4.580  -1.435   1.707
  178   1HB   TYR  26          HB1       TYR  26   5.341  -3.929   2.919
  179   2HB   TYR  26          HB2       TYR  26   4.447  -4.230   1.420
  180    HD1  TYR  26           HD1      TYR  26   5.360  -3.594  -0.755
  181    HD2  TYR  26           HD2      TYR  26   7.376  -2.436   2.874
  182    HE1  TYR  26           HE1      TYR  26   7.300  -2.811  -2.078
  183    HE2  TYR  26           HE2      TYR  26   9.302  -1.650   1.553
  184    HH   TYR  26           HH       TYR  26  10.163  -1.324  -0.543
  185    H    CYS  27           H        CYS  27   3.125  -1.083   0.310
  186    HA   CYS  27           HA       CYS  27   0.288  -1.771   0.831
  187   1HB   CYS  27          HB1       CYS  27   0.689   0.462   0.759
  188   2HB   CYS  27          HB2       CYS  27   1.816   0.418  -0.581
  189    H    GLN  28           H        GLN  28   1.118  -3.945   0.250
  190    HA   GLN  28           HA       GLN  28   1.878  -4.716  -2.331
  191   1HB   GLN  28          HB1       GLN  28   0.247  -6.208  -0.236
  192   2HB   GLN  28          HB2       GLN  28   0.959  -6.981  -1.666
  193   1HG   GLN  28          HG1       GLN  28   2.527  -5.524   0.504
  194   2HG   GLN  28          HG2       GLN  28   2.311  -7.292   0.396
  195   1HE2  GLN  28          1HE2      GLN  28   4.903  -6.162   0.460
  196   2HE2  GLN  28          2HE2      GLN  28   5.616  -6.399  -1.123
  197    H    GLY  29           H        GLY  29   0.886  -4.507  -4.224
  198   1HA   GLY  29          HA1       GLY  29  -0.655  -5.231  -5.716
  199   2HA   GLY  29          HA2       GLY  29  -1.714  -5.585  -4.524
  200    H    CYS  30           H        CYS  30  -0.804  -2.436  -4.085
  201    HA   CYS  30           HA       CYS  30  -2.681  -0.967  -4.045
  202   1HB   CYS  30          HB1       CYS  30  -0.564  -0.029  -4.245
  203   2HB   CYS  30          HB2       CYS  30  -0.374  -0.490  -5.934
  204    H    THR  31           H        THR  31  -1.822  -1.212  -7.556
  205    HA   THR  31           HA       THR  31  -4.491  -0.508  -8.413
  206    HB   THR  31           HB       THR  31  -3.403  -1.466 -10.610
  207    HG1  THR  31           HG1      THR  31  -1.134  -1.626 -10.413
  208   1HG2  THR  31          1HG2      THR  31  -2.111   0.877  -9.131
  209   2HG2  THR  31          2HG2      THR  31  -2.040   0.584 -10.883
  210   3HG2  THR  31          3HG2      THR  31  -3.591   0.953 -10.109
  Start of MODEL   14
    1   1H    THR   1           H        THR   1  11.242  -5.279  -9.996
    2    HA   THR   1           HA       THR   1  10.973  -3.181  -9.116
    3    HB   THR   1           HB       THR   1  10.273  -2.867 -11.335
    4    HG1  THR   1           HG1      THR   1   8.977  -1.011 -10.980
    5   1HG2  THR   1          1HG2      THR   1   7.367  -3.327 -10.557
    6   2HG2  THR   1          2HG2      THR   1   8.006  -2.862 -12.138
    7   3HG2  THR   1          3HG2      THR   1   8.368  -4.464 -11.479
    8    HA   PRO   2           HA       PRO   2   8.394  -4.397  -5.680
    9   1HB   PRO   2          HB1       PRO   2  10.589  -3.156  -4.106
   10   2HB   PRO   2          HB2       PRO   2   9.619  -4.575  -3.731
   11   1HG   PRO   2          HG1       PRO   2  12.067  -4.876  -4.854
   12   2HG   PRO   2          HG2       PRO   2  10.689  -5.894  -5.481
   13   1HD   PRO   2          HD1       PRO   2  11.647  -3.186  -6.469
   14   2HD   PRO   2          HD2       PRO   2  11.669  -4.584  -7.434
   15    H    TYR   3           H        TYR   3   6.756  -2.758  -6.405
   16    HA   TYR   3           HA       TYR   3   6.738  -0.210  -6.646
   17   1HB   TYR   3          HB1       TYR   3   4.640  -1.735  -5.061
   18   2HB   TYR   3          HB2       TYR   3   4.449  -0.333  -6.141
   19    HD1  TYR   3           HD1      TYR   3   5.019  -0.576  -8.622
   20    HD2  TYR   3           HD2      TYR   3   4.409  -3.922  -5.971
   21    HE1  TYR   3           HE1      TYR   3   4.854  -2.100 -10.572
   22    HE2  TYR   3           HE2      TYR   3   4.282  -5.440  -7.916
   23    HH   TYR   3           HH       TYR   3   4.484  -5.629 -10.208
   24    HA   PRO   4           HA       PRO   4   7.839   1.148  -2.362
   25   1HB   PRO   4          HB1       PRO   4   8.631   3.676  -2.889
   26   2HB   PRO   4          HB2       PRO   4   9.628   2.266  -3.383
   27   1HG   PRO   4          HG1       PRO   4   7.664   3.820  -5.086
   28   2HG   PRO   4          HG2       PRO   4   9.365   3.413  -5.482
   29   1HD   PRO   4          HD1       PRO   4   7.228   1.904  -6.342
   30   2HD   PRO   4          HD2       PRO   4   8.795   1.156  -5.917
   31    H    VAL   5           H        VAL   5   5.248   0.664  -2.670
   32    HA   VAL   5           HA       VAL   5   3.594   3.058  -2.649
   33    HB   VAL   5           HB       VAL   5   3.564   0.174  -3.604
   34   1HG1  VAL   5          1HG1      VAL   5   1.138   0.713  -4.129
   35   2HG1  VAL   5          2HG1      VAL   5   1.805   0.079  -2.601
   36   3HG1  VAL   5          3HG1      VAL   5   1.396   1.840  -2.695
   37   1HG2  VAL   5          1HG2      VAL   5   2.767   1.247  -5.772
   38   2HG2  VAL   5          2HG2      VAL   5   2.794   2.834  -4.985
   39   3HG2  VAL   5          3HG2      VAL   5   4.314   1.969  -5.281
   40    H    ASN   6           H        ASN   6   3.335   3.319  -0.459
   41    HA   ASN   6           HA       ASN   6   3.815   1.053   1.320
   42   1HB   ASN   6          HB1       ASN   6   5.192   3.540   0.477
   43   2HB   ASN   6          HB2       ASN   6   5.110   3.316   2.176
   44   1HD2  ASN   6          1HD2      ASN   6   7.167   2.413   2.830
   45   2HD2  ASN   6          2HD2      ASN   6   8.060   1.247   1.868
   46    H    CYS   7           H        CYS   7   3.902   1.826   3.415
   47    HA   CYS   7           HA       CYS   7   1.508   3.366   4.259
   48   1HB   CYS   7          HB1       CYS   7   0.215   1.316   4.854
   49   2HB   CYS   7          HB2       CYS   7   0.537   1.448   3.104
   50    H    LYS   8           H        LYS   8   1.176   3.638   6.353
   51    HA   LYS   8           HA       LYS   8   2.829   2.308   8.428
   52   1HB   LYS   8          HB1       LYS   8   0.827   4.601   8.367
   53   2HB   LYS   8          HB2       LYS   8   1.451   3.874   9.878
   54   1HG   LYS   8          HG1       LYS   8   3.292   5.087   9.772
   55   2HG   LYS   8          HG2       LYS   8   3.712   4.480   8.182
   56   1HD   LYS   8          HD1       LYS   8   1.656   6.704   8.479
   57   2HD   LYS   8          HD2       LYS   8   3.406   7.061   8.586
   58   1HE   LYS   8          HE1       LYS   8   3.822   6.294   6.387
   59   2HE   LYS   8          HE2       LYS   8   2.236   5.480   6.285
   60   1HZ   LYS   8          HZ1       LYS   8   2.069   7.282   5.013
   61   2HZ   LYS   8          HZ2       LYS   8   1.174   7.609   6.256
   62   3HZ   LYS   8          HZ3       LYS   8   2.662   8.387   6.131
   63    H    THR   9           H        THR   9  -0.479   2.588   7.072
   64    HA   THR   9           HA       THR   9  -1.030  -0.101   7.736
   65    HB   THR   9           HB       THR   9  -1.681   0.733   9.905
   66    HG1  THR   9           HG1      THR   9  -4.194   0.369   8.703
   67   1HG2  THR   9          1HG2      THR   9  -3.482   2.334  10.249
   68   2HG2  THR   9          2HG2      THR   9  -2.180   3.114   9.328
   69   3HG2  THR   9          3HG2      THR   9  -3.655   2.552   8.501
   70    H    ASP  10           H        ASP  10  -3.577  -0.249   7.052
   71    HA   ASP  10           HA       ASP  10  -3.811   0.007   4.264
   72   1HB   ASP  10          HB1       ASP  10  -6.084  -0.758   4.890
   73   2HB   ASP  10          HB2       ASP  10  -5.013  -1.334   6.218
   74    H    ARG  11           H        ARG  11  -5.002   2.010   6.771
   75    HA   ARG  11           HA       ARG  11  -6.380   3.898   5.252
   76   1HB   ARG  11          HB1       ARG  11  -6.250   4.067   7.743
   77   2HB   ARG  11          HB2       ARG  11  -4.501   4.349   7.677
   78   1HG   ARG  11          HG1       ARG  11  -6.244   6.264   6.211
   79   2HG   ARG  11          HG2       ARG  11  -6.244   6.301   7.994
   80   1HD   ARG  11          HD1       ARG  11  -4.000   6.963   8.106
   81   2HD   ARG  11          HD2       ARG  11  -3.594   6.361   6.504
   82    HE   ARG  11           HE       ARG  11  -5.541   8.558   6.724
   83   1HH1  ARG  11          2HH2      ARG  11  -2.032   7.800   5.850
   84   2HH1  ARG  11          1HH2      ARG  11  -1.992   9.148   4.824
   85   1HH2  ARG  11          1HH1      ARG  11  -5.268  10.321   5.354
   86   2HH2  ARG  11          2HH1      ARG  11  -3.747  10.629   4.585
   87    H    ASP  12           H        ASP  12  -2.846   3.563   5.407
   88    HA   ASP  12           HA       ASP  12  -2.592   6.231   4.327
   89   1HB   ASP  12          HB1       ASP  12  -1.121   4.734   5.930
   90   2HB   ASP  12          HB2       ASP  12  -0.495   4.087   4.443
   91    H    CYS  13           H        CYS  13  -3.540   3.271   2.989
   92    HA   CYS  13           HA       CYS  13  -2.908   4.233   0.219
   93   1HB   CYS  13          HB1       CYS  13  -2.872   1.514   1.538
   94   2HB   CYS  13          HB2       CYS  13  -2.813   1.704  -0.217
   95    H    VAL  14           H        VAL  14  -5.351   3.870   2.329
   96    HA   VAL  14           HA       VAL  14  -7.421   2.699   0.967
   97    HB   VAL  14           HB       VAL  14  -7.453   3.936   3.023
   98   1HG1  VAL  14          1HG1      VAL  14  -7.434   6.486   1.487
   99   2HG1  VAL  14          2HG1      VAL  14  -7.149   6.177   3.230
  100   3HG1  VAL  14          3HG1      VAL  14  -5.949   5.654   2.014
  101   1HG2  VAL  14          1HG2      VAL  14  -9.658   3.567   1.909
  102   2HG2  VAL  14          2HG2      VAL  14  -9.642   5.084   2.833
  103   3HG2  VAL  14          3HG2      VAL  14  -9.486   5.120   1.066
  104    H    MET  15           H        MET  15  -5.765   5.569   0.170
  105    HA   MET  15           HA       MET  15  -7.363   6.686  -1.884
  106   1HB   MET  15          HB1       MET  15  -5.371   7.936  -2.539
  107   2HB   MET  15          HB2       MET  15  -5.579   7.922  -0.776
  108   1HG   MET  15          HG1       MET  15  -3.932   6.087  -0.619
  109   2HG   MET  15          HG2       MET  15  -3.692   6.144  -2.362
  110   1HE   MET  15          HE1       MET  15  -2.563   8.162  -3.651
  111   2HE   MET  15          HE2       MET  15  -3.632   9.378  -2.900
  112   3HE   MET  15          HE3       MET  15  -1.872   9.590  -2.845
  113    H    CYS  16           H        CYS  16  -5.309   3.911  -1.950
  114    HA   CYS  16           HA       CYS  16  -4.843   3.780  -4.800
  115   1HB   CYS  16          HB1       CYS  16  -4.791   1.699  -2.619
  116   2HB   CYS  16          HB2       CYS  16  -4.275   1.384  -4.326
  117    H    GLY  17           H        GLY  17  -7.675   3.071  -2.797
  118   1HA   GLY  17          HA1       GLY  17  -9.390   3.001  -4.817
  119   2HA   GLY  17          HA2       GLY  17  -8.945   1.431  -4.745
  120    H    LEU  18           H        LEU  18  -9.366   0.147  -2.875
  121    HA   LEU  18           HA       LEU  18 -11.691   1.075  -1.288
  122   1HB   LEU  18          HB1       LEU  18 -11.429  -1.087  -2.837
  123   2HB   LEU  18          HB2       LEU  18 -10.628  -1.791  -1.475
  124    HG   LEU  18           HG       LEU  18 -13.230  -0.349  -1.156
  125   1HD1  LEU  18          1HD1      LEU  18 -13.567  -1.866  -3.107
  126   2HD1  LEU  18          2HD1      LEU  18 -13.008  -3.237  -2.121
  127   3HD1  LEU  18          3HD1      LEU  18 -14.529  -2.407  -1.730
  128   1HD2  LEU  18          1HD2      LEU  18 -12.662  -0.948   0.926
  129   2HD2  LEU  18          2HD2      LEU  18 -13.855  -2.151   0.470
  130   3HD2  LEU  18          3HD2      LEU  18 -12.140  -2.607   0.456
  131    H    GLY  19           H        GLY  19 -10.850  -1.098   0.383
  132   1HA   GLY  19          HA1       GLY  19  -9.186   0.222   2.357
  133   2HA   GLY  19          HA2       GLY  19 -10.047  -1.142   2.617
  134    H    ILE  20           H        ILE  20  -7.900  -0.215   0.156
  135    HA   ILE  20           HA       ILE  20  -6.599  -2.601  -0.371
  136    HB   ILE  20           HB       ILE  20  -5.483   0.229  -0.530
  137   1HG1  ILE  20          1HG1      ILE  20  -7.227   0.248  -2.013
  138   2HG1  ILE  20          2HG1      ILE  20  -5.855  -0.184  -3.057
  139   1HG2  ILE  20          1HG2      ILE  20  -3.583  -1.226  -0.487
  140   2HG2  ILE  20          2HG2      ILE  20  -4.364  -2.340  -1.634
  141   3HG2  ILE  20          3HG2      ILE  20  -3.873  -0.716  -2.141
  142   1HD1  ILE  20          1HD1      ILE  20  -8.026  -2.020  -2.022
  143   2HD1  ILE  20          2HD1      ILE  20  -7.674  -1.559  -3.696
  144   3HD1  ILE  20          3HD1      ILE  20  -6.534  -2.595  -2.812
  145    H    SER  21           H        SER  21  -5.171  -3.927   0.537
  146    HA   SER  21           HA       SER  21  -4.679  -3.708   3.300
  147   1HB   SER  21          HB1       SER  21  -3.192  -5.783   2.602
  148   2HB   SER  21          HB2       SER  21  -4.970  -5.835   2.479
  149    HG   SER  21           HG       SER  21  -3.363  -4.948   0.300
  150    H    CYS  22           H        CYS  22  -3.057  -2.791   4.368
  151    HA   CYS  22           HA       CYS  22  -0.456  -2.201   3.037
  152   1HB   CYS  22          HB1       CYS  22  -1.062  -0.411   4.292
  153   2HB   CYS  22          HB2       CYS  22  -1.544  -1.327   5.709
  154    H    LYS  23           H        LYS  23   0.972  -3.844   2.922
  155    HA   LYS  23           HA       LYS  23   1.063  -5.953   4.930
  156   1HB   LYS  23          HB1       LYS  23   1.521  -5.758   2.119
  157   2HB   LYS  23          HB2       LYS  23   2.963  -6.374   2.899
  158   1HG   LYS  23          HG1       LYS  23   0.203  -7.378   3.732
  159   2HG   LYS  23          HG2       LYS  23   1.055  -7.949   2.257
  160   1HD   LYS  23          HD1       LYS  23   1.805  -9.545   3.671
  161   2HD   LYS  23          HD2       LYS  23   3.039  -8.303   3.920
  162   1HE   LYS  23          HE1       LYS  23   1.789  -7.571   5.976
  163   2HE   LYS  23          HE2       LYS  23   0.590  -8.843   5.688
  164   1HZ   LYS  23          HZ1       LYS  23   3.453  -9.184   6.274
  165   2HZ   LYS  23          HZ2       LYS  23   2.207  -9.557   7.277
  166   3HZ   LYS  23          HZ3       LYS  23   2.441 -10.447   5.909
  167    H    ASN  24           H        ASN  24   3.759  -6.367   4.952
  168    HA   ASN  24           HA       ASN  24   4.980  -4.844   6.776
  169   1HB   ASN  24          HB1       ASN  24   6.217  -6.468   4.704
  170   2HB   ASN  24          HB2       ASN  24   7.096  -5.788   6.055
  171   1HD2  ASN  24          1HD2      ASN  24   7.052  -6.952   8.000
  172   2HD2  ASN  24          2HD2      ASN  24   6.009  -8.323   8.296
  173    H    GLY  25           H        GLY  25   4.226  -2.704   5.925
  174   1HA   GLY  25          HA1       GLY  25   4.969  -0.594   5.674
  175   2HA   GLY  25          HA2       GLY  25   6.405  -1.103   5.085
  176    H    TYR  26           H        TYR  26   4.117  -2.770   3.332
  177    HA   TYR  26           HA       TYR  26   4.406  -0.911   1.039
  178   1HB   TYR  26          HB1       TYR  26   5.447  -3.671   1.573
  179   2HB   TYR  26          HB2       TYR  26   4.815  -3.310  -0.039
  180    HD1  TYR  26           HD1      TYR  26   7.245  -1.951   2.525
  181    HD2  TYR  26           HD2      TYR  26   6.316  -2.513  -1.646
  182    HE1  TYR  26           HE1      TYR  26   9.376  -0.859   1.899
  183    HE2  TYR  26           HE2      TYR  26   8.474  -1.484  -2.262
  184    HH   TYR  26           HH       TYR  26  10.338  -0.395  -1.513
  185    H    CYS  27           H        CYS  27   2.350  -0.939  -0.287
  186    HA   CYS  27           HA       CYS  27   0.321  -2.628   1.033
  187   1HB   CYS  27          HB1       CYS  27  -1.142  -0.880   0.795
  188   2HB   CYS  27          HB2       CYS  27   0.317  -0.311   1.609
  189    H    GLN  28           H        GLN  28   0.644  -4.340  -0.295
  190    HA   GLN  28           HA       GLN  28   0.035  -4.590  -3.034
  191   1HB   GLN  28          HB1       GLN  28  -0.994  -6.817  -2.270
  192   2HB   GLN  28          HB2       GLN  28   0.726  -6.559  -1.920
  193   1HG   GLN  28          HG1       GLN  28   0.394  -6.379   0.338
  194   2HG   GLN  28          HG2       GLN  28  -1.237  -5.731   0.206
  195   1HE2  GLN  28          1HE2      GLN  28  -3.033  -7.142   0.244
  196   2HE2  GLN  28          2HE2      GLN  28  -2.828  -8.877   0.424
  197    H    GLY  29           H        GLY  29  -1.875  -4.673  -4.220
  198   1HA   GLY  29          HA1       GLY  29  -4.231  -5.099  -4.178
  199   2HA   GLY  29          HA2       GLY  29  -4.377  -4.209  -2.816
  200    H    CYS  30           H        CYS  30  -2.624  -2.011  -3.654
  201    HA   CYS  30           HA       CYS  30  -4.378  -0.490  -5.343
  202   1HB   CYS  30          HB1       CYS  30  -1.422  -0.138  -5.495
  203   2HB   CYS  30          HB2       CYS  30  -2.598   1.117  -5.615
  204    H    THR  31           H        THR  31  -1.659  -2.660  -5.859
  205    HA   THR  31           HA       THR  31  -2.692  -3.484  -8.413
  206    HB   THR  31           HB       THR  31  -1.154  -1.818  -9.227
  207    HG1  THR  31           HG1      THR  31   0.120  -3.237 -10.437
  208   1HG2  THR  31          1HG2      THR  31   0.964  -3.233  -7.547
  209   2HG2  THR  31          2HG2      THR  31   1.270  -1.942  -8.728
  210   3HG2  THR  31          3HG2      THR  31   0.326  -1.597  -7.269
  Start of MODEL   15
    1   1H    THR   1           H        THR   1   9.015  -1.944 -13.462
    2    HA   THR   1           HA       THR   1   7.498  -2.748 -11.585
    3    HB   THR   1           HB       THR   1  10.409  -3.606 -11.490
    4    HG1  THR   1           HG1      THR   1   9.858  -4.791 -13.379
    5   1HG2  THR   1          1HG2      THR   1   8.811  -4.779  -9.984
    6   2HG2  THR   1          2HG2      THR   1   7.783  -5.152 -11.385
    7   3HG2  THR   1          3HG2      THR   1   9.416  -5.840 -11.269
    8    HA   PRO   2           HA       PRO   2  10.283  -1.763  -7.984
    9   1HB   PRO   2          HB1       PRO   2  12.075   0.505  -8.625
   10   2HB   PRO   2          HB2       PRO   2  12.401  -0.935  -7.672
   11   1HG   PRO   2          HG1       PRO   2  13.195  -0.816 -10.262
   12   2HG   PRO   2          HG2       PRO   2  12.437  -2.357  -9.653
   13   1HD   PRO   2          HD1       PRO   2  11.072   0.039 -10.927
   14   2HD   PRO   2          HD2       PRO   2  11.106  -1.479 -11.660
   15    H    TYR   3           H        TYR   3   7.731  -0.389  -8.512
   16    HA   TYR   3           HA       TYR   3   7.771   2.287  -7.666
   17   1HB   TYR   3          HB1       TYR   3   5.494   0.293  -7.620
   18   2HB   TYR   3          HB2       TYR   3   5.498   2.042  -7.932
   19    HD1  TYR   3           HD1      TYR   3   5.019  -1.025  -9.485
   20    HD2  TYR   3           HD2      TYR   3   7.092   2.716 -10.052
   21    HE1  TYR   3           HE1      TYR   3   5.079  -1.421 -11.930
   22    HE2  TYR   3           HE2      TYR   3   7.182   2.295 -12.486
   23    HH   TYR   3           HH       TYR   3   6.665   0.832 -14.196
   24    HA   PRO   4           HA       PRO   4   8.083   0.779  -3.357
   25   1HB   PRO   4          HB1       PRO   4   8.587   3.080  -2.052
   26   2HB   PRO   4          HB2       PRO   4   9.778   2.389  -3.208
   27   1HG   PRO   4          HG1       PRO   4   7.725   4.553  -3.760
   28   2HG   PRO   4          HG2       PRO   4   9.489   4.613  -4.090
   29   1HD   PRO   4          HD1       PRO   4   7.645   3.879  -5.996
   30   2HD   PRO   4          HD2       PRO   4   9.270   3.140  -5.918
   31    H    VAL   5           H        VAL   5   5.496   0.496  -4.179
   32    HA   VAL   5           HA       VAL   5   3.825   2.408  -3.090
   33    HB   VAL   5           HB       VAL   5   2.363   0.025  -3.363
   34   1HG1  VAL   5          1HG1      VAL   5   3.053   2.229  -5.290
   35   2HG1  VAL   5          2HG1      VAL   5   1.485   1.349  -5.279
   36   3HG1  VAL   5          3HG1      VAL   5   1.932   2.407  -3.887
   37   1HG2  VAL   5          1HG2      VAL   5   4.227   0.149  -5.732
   38   2HG2  VAL   5          2HG2      VAL   5   4.230  -1.137  -4.492
   39   3HG2  VAL   5          3HG2      VAL   5   2.811  -0.885  -5.522
   40    H    ASN   6           H        ASN   6   3.819   2.844  -1.148
   41    HA   ASN   6           HA       ASN   6   4.112   0.799   0.921
   42   1HB   ASN   6          HB1       ASN   6   5.402   3.319   0.020
   43   2HB   ASN   6          HB2       ASN   6   5.195   3.163   1.720
   44   1HD2  ASN   6          1HD2      ASN   6   7.393   2.689   2.384
   45   2HD2  ASN   6          2HD2      ASN   6   8.336   1.388   1.673
   46    H    CYS   7           H        CYS   7   3.947   1.851   2.962
   47    HA   CYS   7           HA       CYS   7   1.496   3.394   3.545
   48   1HB   CYS   7          HB1       CYS   7   0.298   1.311   4.396
   49   2HB   CYS   7          HB2       CYS   7   0.467   1.430   2.625
   50    H    LYS   8           H        LYS   8   1.234   3.801   5.728
   51    HA   LYS   8           HA       LYS   8   3.052   2.622   7.752
   52   1HB   LYS   8          HB1       LYS   8   0.786   4.640   7.748
   53   2HB   LYS   8          HB2       LYS   8   1.465   3.925   9.250
   54   1HG   LYS   8          HG1       LYS   8   3.076   5.411   9.239
   55   2HG   LYS   8          HG2       LYS   8   3.723   4.775   7.746
   56   1HD   LYS   8          HD1       LYS   8   1.432   6.756   7.631
   57   2HD   LYS   8          HD2       LYS   8   3.077   7.341   8.029
   58   1HE   LYS   8          HE1       LYS   8   3.958   6.700   5.959
   59   2HE   LYS   8          HE2       LYS   8   2.622   5.554   5.644
   60   1HZ   LYS   8          HZ1       LYS   8   1.184   7.588   5.540
   61   2HZ   LYS   8          HZ2       LYS   8   2.595   8.434   5.201
   62   3HZ   LYS   8          HZ3       LYS   8   2.031   7.112   4.316
   63    H    THR   9           H        THR   9  -0.459   2.750   6.982
   64    HA   THR   9           HA       THR   9  -0.852  -0.061   7.799
   65    HB   THR   9           HB       THR   9  -2.972   0.746   8.886
   66    HG1  THR   9           HG1      THR   9  -1.806   3.319   8.755
   67   1HG2  THR   9          1HG2      THR   9  -1.949   1.638  10.929
   68   2HG2  THR   9          2HG2      THR   9  -0.899   0.372  10.254
   69   3HG2  THR   9          3HG2      THR   9  -0.483   2.086  10.032
   70    H    ASP  10           H        ASP  10  -3.131  -0.716   6.901
   71    HA   ASP  10           HA       ASP  10  -3.548  -0.334   4.186
   72   1HB   ASP  10          HB1       ASP  10  -5.470  -0.636   6.597
   73   2HB   ASP  10          HB2       ASP  10  -6.010  -0.822   4.928
   74    H    ARG  11           H        ARG  11  -4.917   1.586   6.734
   75    HA   ARG  11           HA       ARG  11  -6.432   3.331   5.196
   76   1HB   ARG  11          HB1       ARG  11  -6.521   3.398   7.608
   77   2HB   ARG  11          HB2       ARG  11  -4.780   3.611   7.763
   78   1HG   ARG  11          HG1       ARG  11  -6.185   5.815   6.347
   79   2HG   ARG  11          HG2       ARG  11  -6.650   5.510   8.071
   80   1HD   ARG  11          HD1       ARG  11  -4.998   7.071   8.342
   81   2HD   ARG  11          HD2       ARG  11  -4.090   5.565   8.539
   82    HE   ARG  11           HE       ARG  11  -2.874   6.046   6.640
   83   1HH1  ARG  11          2HH2      ARG  11  -5.743   8.045   6.578
   84   2HH1  ARG  11          1HH2      ARG  11  -5.069   9.305   5.587
   85   1HH2  ARG  11          1HH1      ARG  11  -1.863   7.725   5.377
   86   2HH2  ARG  11          2HH1      ARG  11  -2.818   9.068   4.832
   87    H    ASP  12           H        ASP  12  -2.867   3.240   5.393
   88    HA   ASP  12           HA       ASP  12  -2.721   5.933   4.362
   89   1HB   ASP  12          HB1       ASP  12  -1.084   4.583   5.878
   90   2HB   ASP  12          HB2       ASP  12  -0.579   3.819   4.377
   91    H    CYS  13           H        CYS  13  -3.548   2.968   2.961
   92    HA   CYS  13           HA       CYS  13  -3.033   4.122   0.230
   93   1HB   CYS  13          HB1       CYS  13  -2.720   1.401   1.457
   94   2HB   CYS  13          HB2       CYS  13  -3.095   1.498  -0.284
   95    H    VAL  14           H        VAL  14  -5.444   3.540   2.338
   96    HA   VAL  14           HA       VAL  14  -7.446   2.382   0.802
   97    HB   VAL  14           HB       VAL  14  -7.569   3.422   3.014
   98   1HG1  VAL  14          1HG1      VAL  14  -7.708   6.084   1.683
   99   2HG1  VAL  14          2HG1      VAL  14  -7.415   5.679   3.399
  100   3HG1  VAL  14          3HG1      VAL  14  -6.182   5.308   2.164
  101   1HG2  VAL  14          1HG2      VAL  14  -9.833   4.435   2.902
  102   2HG2  VAL  14          2HG2      VAL  14  -9.671   4.632   1.143
  103   3HG2  VAL  14          3HG2      VAL  14  -9.742   3.004   1.854
  104    H    MET  15           H        MET  15  -5.934   5.389   0.339
  105    HA   MET  15           HA       MET  15  -7.584   6.643  -1.596
  106   1HB   MET  15          HB1       MET  15  -5.665   8.077  -2.053
  107   2HB   MET  15          HB2       MET  15  -5.891   7.833  -0.308
  108   1HG   MET  15          HG1       MET  15  -4.136   6.084  -0.358
  109   2HG   MET  15          HG2       MET  15  -3.880   6.390  -2.073
  110   1HE   MET  15          HE1       MET  15  -4.021   9.666  -2.168
  111   2HE   MET  15          HE2       MET  15  -2.279   9.975  -2.055
  112   3HE   MET  15          HE3       MET  15  -2.873   8.631  -3.058
  113    H    CYS  16           H        CYS  16  -5.396   4.018  -1.949
  114    HA   CYS  16           HA       CYS  16  -4.878   4.265  -4.815
  115   1HB   CYS  16          HB1       CYS  16  -4.524   2.115  -2.747
  116   2HB   CYS  16          HB2       CYS  16  -4.182   1.789  -4.474
  117    H    GLY  17           H        GLY  17  -7.521   3.012  -2.808
  118   1HA   GLY  17          HA1       GLY  17  -9.261   2.868  -4.880
  119   2HA   GLY  17          HA2       GLY  17  -8.700   1.342  -4.724
  120    H    LEU  18           H        LEU  18  -8.958   0.173  -2.733
  121    HA   LEU  18           HA       LEU  18 -11.155   1.133  -0.932
  122   1HB   LEU  18          HB1       LEU  18 -12.151   0.128  -2.655
  123   2HB   LEU  18          HB2       LEU  18 -11.160  -1.317  -2.508
  124    HG   LEU  18           HG       LEU  18 -12.020  -1.811  -0.392
  125   1HD1  LEU  18          1HD1      LEU  18 -13.301   0.949  -0.122
  126   2HD1  LEU  18          2HD1      LEU  18 -13.663  -0.439   0.916
  127   3HD1  LEU  18          3HD1      LEU  18 -12.049   0.256   0.939
  128   1HD2  LEU  18          1HD2      LEU  18 -13.447  -1.994  -2.374
  129   2HD2  LEU  18          2HD2      LEU  18 -14.480  -1.754  -0.918
  130   3HD2  LEU  18          3HD2      LEU  18 -14.069  -0.347  -1.972
  131    H    GLY  19           H        GLY  19 -10.065  -2.106  -1.110
  132   1HA   GLY  19          HA1       GLY  19  -8.959  -2.057   1.533
  133   2HA   GLY  19          HA2       GLY  19  -9.477  -3.374   0.719
  134    H    ILE  20           H        ILE  20  -7.359  -0.945  -0.361
  135    HA   ILE  20           HA       ILE  20  -5.272  -2.771  -1.251
  136    HB   ILE  20           HB       ILE  20  -5.170   0.246  -0.945
  137   1HG1  ILE  20          1HG1      ILE  20  -6.984  -0.100  -2.337
  138   2HG1  ILE  20          2HG1      ILE  20  -5.625   0.241  -3.422
  139   1HG2  ILE  20          1HG2      ILE  20  -2.964  -0.930  -1.177
  140   2HG2  ILE  20          2HG2      ILE  20  -3.521  -1.531  -2.746
  141   3HG2  ILE  20          3HG2      ILE  20  -3.355   0.210  -2.454
  142   1HD1  ILE  20          1HD1      ILE  20  -6.884  -2.457  -2.883
  143   2HD1  ILE  20          2HD1      ILE  20  -6.908  -1.516  -4.384
  144   3HD1  ILE  20          3HD1      ILE  20  -5.385  -2.223  -3.811
  145    H    SER  21           H        SER  21  -5.171  -3.908   0.698
  146    HA   SER  21           HA       SER  21  -4.527  -2.779   3.144
  147   1HB   SER  21          HB1       SER  21  -5.723  -4.906   2.708
  148   2HB   SER  21          HB2       SER  21  -4.210  -5.673   2.225
  149    HG   SER  21           HG       SER  21  -4.932  -4.588   4.762
  150    H    CYS  22           H        CYS  22  -2.680  -3.033   4.566
  151    HA   CYS  22           HA       CYS  22  -0.075  -2.830   3.104
  152   1HB   CYS  22          HB1       CYS  22  -0.784  -0.740   3.939
  153   2HB   CYS  22          HB2       CYS  22  -1.107  -1.363   5.559
  154    H    LYS  23           H        LYS  23   1.671  -3.984   3.777
  155    HA   LYS  23           HA       LYS  23   1.643  -5.241   6.448
  156   1HB   LYS  23          HB1       LYS  23   2.226  -6.728   3.851
  157   2HB   LYS  23          HB2       LYS  23   2.646  -7.294   5.504
  158   1HG   LYS  23          HG1       LYS  23   0.673  -8.421   5.171
  159   2HG   LYS  23          HG2       LYS  23   0.121  -6.964   5.992
  160   1HD   LYS  23          HD1       LYS  23  -0.128  -6.062   3.489
  161   2HD   LYS  23          HD2       LYS  23  -0.056  -7.788   3.063
  162   1HE   LYS  23          HE1       LYS  23  -2.361  -6.858   3.221
  163   2HE   LYS  23          HE2       LYS  23  -2.105  -8.240   4.277
  164   1HZ   LYS  23          HZ1       LYS  23  -1.795  -5.505   5.333
  165   2HZ   LYS  23          HZ2       LYS  23  -3.279  -6.117   5.094
  166   3HZ   LYS  23          HZ3       LYS  23  -2.229  -6.868   6.129
  167    H    ASN  24           H        ASN  24   3.524  -4.901   7.419
  168    HA   ASN  24           HA       ASN  24   5.549  -3.879   7.808
  169   1HB   ASN  24          HB1       ASN  24   6.167  -6.066   5.995
  170   2HB   ASN  24          HB2       ASN  24   7.375  -5.207   6.929
  171   1HD2  ASN  24          1HD2      ASN  24   7.849  -6.208   8.883
  172   2HD2  ASN  24          2HD2      ASN  24   6.705  -7.181   9.791
  173    H    GLY  25           H        GLY  25   4.390  -1.982   6.282
  174   1HA   GLY  25          HA1       GLY  25   5.292  -0.083   5.530
  175   2HA   GLY  25          HA2       GLY  25   6.641  -0.853   5.027
  176    H    TYR  26           H        TYR  26   4.722  -2.835   3.588
  177    HA   TYR  26           HA       TYR  26   4.633  -1.227   1.100
  178   1HB   TYR  26          HB1       TYR  26   5.540  -3.983   1.824
  179   2HB   TYR  26          HB2       TYR  26   4.832  -3.706   0.222
  180    HD1  TYR  26           HD1      TYR  26   6.042  -2.558  -1.501
  181    HD2  TYR  26           HD2      TYR  26   7.545  -2.571   2.542
  182    HE1  TYR  26           HE1      TYR  26   8.109  -1.454  -2.272
  183    HE2  TYR  26           HE2      TYR  26   9.586  -1.380   1.776
  184    HH   TYR  26           HH       TYR  26  10.084  -0.457  -1.638
  185    H    CYS  27           H        CYS  27   2.785  -1.130  -0.076
  186    HA   CYS  27           HA       CYS  27   0.403  -2.396   1.102
  187   1HB   CYS  27          HB1       CYS  27  -0.366  -0.412   1.320
  188   2HB   CYS  27          HB2       CYS  27   1.189   0.265   0.795
  189    H    GLN  28           H        GLN  28  -1.063  -3.419  -0.056
  190    HA   GLN  28           HA       GLN  28   0.231  -4.575  -2.414
  191   1HB   GLN  28          HB1       GLN  28  -2.020  -5.603  -0.667
  192   2HB   GLN  28          HB2       GLN  28  -1.056  -6.539  -1.830
  193   1HG   GLN  28          HG1       GLN  28  -0.076  -5.247   0.755
  194   2HG   GLN  28          HG2       GLN  28  -0.276  -6.989   0.427
  195   1HE2  GLN  28          1HE2      GLN  28   2.151  -4.868   0.952
  196   2HE2  GLN  28          2HE2      GLN  28   3.303  -5.505  -0.207
  197    H    GLY  29           H        GLY  29  -0.408  -4.029  -4.387
  198   1HA   GLY  29          HA1       GLY  29  -1.822  -4.350  -6.117
  199   2HA   GLY  29          HA2       GLY  29  -3.065  -4.632  -5.096
  200    H    CYS  30           H        CYS  30  -1.545  -1.674  -4.585
  201    HA   CYS  30           HA       CYS  30  -3.515  -0.069  -4.760
  202   1HB   CYS  30          HB1       CYS  30  -1.311   0.620  -4.097
  203   2HB   CYS  30          HB2       CYS  30  -0.697   0.442  -5.753
  204    H    THR  31           H        THR  31  -1.590  -0.712  -7.735
  205    HA   THR  31           HA       THR  31  -3.896  -0.583  -9.383
  206    HB   THR  31           HB       THR  31  -3.596   1.847  -9.107
  207    HG1  THR  31           HG1      THR  31  -4.371   1.259 -11.063
  208   1HG2  THR  31          1HG2      THR  31  -0.861   1.403 -10.369
  209   2HG2  THR  31          2HG2      THR  31  -1.623   2.964 -10.007
  210   3HG2  THR  31          3HG2      THR  31  -1.162   1.878  -8.682
  Start of MODEL   16
    1   1H    THR   1           H        THR   1   8.064  -6.732 -10.305
    2    HA   THR   1           HA       THR   1   9.819  -4.371 -10.330
    3    HB   THR   1           HB       THR   1   8.795  -4.248 -12.447
    4    HG1  THR   1           HG1      THR   1   9.027  -2.307 -11.374
    5   1HG2  THR   1          1HG2      THR   1   6.753  -5.615 -12.113
    6   2HG2  THR   1          2HG2      THR   1   6.025  -4.279 -11.193
    7   3HG2  THR   1          3HG2      THR   1   6.445  -4.057 -12.893
    8    HA   PRO   2           HA       PRO   2   7.762  -4.917  -6.408
    9   1HB   PRO   2          HB1       PRO   2  10.205  -3.516  -5.437
   10   2HB   PRO   2          HB2       PRO   2   9.267  -4.775  -4.645
   11   1HG   PRO   2          HG1       PRO   2  11.467  -5.454  -6.064
   12   2HG   PRO   2          HG2       PRO   2   9.959  -6.458  -6.273
   13   1HD   PRO   2          HD1       PRO   2  10.883  -4.059  -7.885
   14   2HD   PRO   2          HD2       PRO   2  10.644  -5.597  -8.565
   15    H    TYR   3           H        TYR   3   5.940  -3.363  -6.564
   16    HA   TYR   3           HA       TYR   3   6.019  -0.786  -7.313
   17   1HB   TYR   3          HB1       TYR   3   4.283  -2.150  -5.204
   18   2HB   TYR   3          HB2       TYR   3   3.859  -0.771  -6.228
   19    HD1  TYR   3           HD1      TYR   3   4.330  -1.293  -8.890
   20    HD2  TYR   3           HD2      TYR   3   3.275  -4.166  -5.849
   21    HE1  TYR   3           HE1      TYR   3   3.608  -2.875 -10.638
   22    HE2  TYR   3           HE2      TYR   3   2.556  -5.753  -7.614
   23    HH   TYR   3           HH       TYR   3   2.773  -4.970 -11.090
   24    HA   PRO   4           HA       PRO   4   8.143   0.785  -3.555
   25   1HB   PRO   4          HB1       PRO   4   8.595   3.346  -4.293
   26   2HB   PRO   4          HB2       PRO   4   9.463   1.979  -5.071
   27   1HG   PRO   4          HG1       PRO   4   6.992   3.409  -6.087
   28   2HG   PRO   4          HG2       PRO   4   8.510   3.081  -6.987
   29   1HD   PRO   4          HD1       PRO   4   6.304   1.449  -7.163
   30   2HD   PRO   4          HD2       PRO   4   7.965   0.784  -7.208
   31    H    VAL   5           H        VAL   5   5.587   0.191  -2.953
   32    HA   VAL   5           HA       VAL   5   3.983   2.585  -2.568
   33    HB   VAL   5           HB       VAL   5   3.711  -0.315  -3.387
   34   1HG1  VAL   5          1HG1      VAL   5   2.250  -0.278  -1.956
   35   2HG1  VAL   5          2HG1      VAL   5   1.741   1.436  -2.171
   36   3HG1  VAL   5          3HG1      VAL   5   1.268   0.142  -3.385
   37   1HG2  VAL   5          1HG2      VAL   5   2.427   0.749  -5.339
   38   2HG2  VAL   5          2HG2      VAL   5   2.696   2.342  -4.617
   39   3HG2  VAL   5          3HG2      VAL   5   4.070   1.422  -5.256
   40    H    ASN   6           H        ASN   6   4.005   2.998  -0.402
   41    HA   ASN   6           HA       ASN   6   4.468   0.907   1.542
   42   1HB   ASN   6          HB1       ASN   6   5.378   3.729   0.908
   43   2HB   ASN   6          HB2       ASN   6   5.501   3.035   2.494
   44   1HD2  ASN   6          1HD2      ASN   6   6.671   0.712   2.444
   45   2HD2  ASN   6          2HD2      ASN   6   8.072   0.623   1.377
   46    H    CYS   7           H        CYS   7   4.005   1.872   3.618
   47    HA   CYS   7           HA       CYS   7   1.578   3.494   3.963
   48   1HB   CYS   7          HB1       CYS   7   0.166   1.463   4.540
   49   2HB   CYS   7          HB2       CYS   7   0.537   1.658   2.816
   50    H    LYS   8           H        LYS   8   1.343   4.046   6.077
   51    HA   LYS   8           HA       LYS   8   2.657   2.491   8.253
   52   1HB   LYS   8          HB1       LYS   8   0.911   4.934   8.228
   53   2HB   LYS   8          HB2       LYS   8   1.479   4.057   9.701
   54   1HG   LYS   8          HG1       LYS   8   3.220   5.472   9.549
   55   2HG   LYS   8          HG2       LYS   8   3.840   4.247   8.422
   56   1HD   LYS   8          HD1       LYS   8   4.222   6.466   7.576
   57   2HD   LYS   8          HD2       LYS   8   3.121   5.564   6.517
   58   1HE   LYS   8          HE1       LYS   8   2.466   7.914   6.737
   59   2HE   LYS   8          HE2       LYS   8   1.205   6.865   7.392
   60   1HZ   LYS   8          HZ1       LYS   8   1.616   8.716   8.791
   61   2HZ   LYS   8          HZ2       LYS   8   2.017   7.328   9.574
   62   3HZ   LYS   8          HZ3       LYS   8   3.203   8.315   8.979
   63    H    THR   9           H        THR   9  -0.479   2.587   6.603
   64    HA   THR   9           HA       THR   9  -1.482   0.284   7.986
   65    HB   THR   9           HB       THR   9  -2.416   1.449   9.650
   66    HG1  THR   9           HG1      THR   9  -4.387   1.088   8.398
   67   1HG2  THR   9          1HG2      THR   9  -1.276   3.560   9.434
   68   2HG2  THR   9          2HG2      THR   9  -2.315   4.029   8.063
   69   3HG2  THR   9          3HG2      THR   9  -2.989   3.864   9.689
   70    H    ASP  10           H        ASP  10  -3.847  -0.082   6.966
   71    HA   ASP  10           HA       ASP  10  -3.753  -0.077   4.096
   72   1HB   ASP  10          HB1       ASP  10  -6.000  -1.054   4.605
   73   2HB   ASP  10          HB2       ASP  10  -4.856  -1.578   5.910
   74    H    ARG  11           H        ARG  11  -5.196   1.752   6.613
   75    HA   ARG  11           HA       ARG  11  -6.571   3.717   5.121
   76   1HB   ARG  11          HB1       ARG  11  -6.477   3.773   7.623
   77   2HB   ARG  11          HB2       ARG  11  -4.731   4.082   7.585
   78   1HG   ARG  11          HG1       ARG  11  -6.491   6.006   6.154
   79   2HG   ARG  11          HG2       ARG  11  -6.495   6.001   7.939
   80   1HD   ARG  11          HD1       ARG  11  -4.287   6.735   8.074
   81   2HD   ARG  11          HD2       ARG  11  -3.828   6.133   6.490
   82    HE   ARG  11           HE       ARG  11  -5.832   8.287   6.662
   83   1HH1  ARG  11          2HH2      ARG  11  -2.305   7.590   5.805
   84   2HH1  ARG  11          1HH2      ARG  11  -2.276   8.944   4.791
   85   1HH2  ARG  11          1HH1      ARG  11  -5.592  10.039   5.272
   86   2HH2  ARG  11          2HH1      ARG  11  -4.071  10.374   4.512
   87    H    ASP  12           H        ASP  12  -3.034   3.330   5.364
   88    HA   ASP  12           HA       ASP  12  -2.668   6.000   4.378
   89   1HB   ASP  12          HB1       ASP  12  -1.396   4.256   5.991
   90   2HB   ASP  12          HB2       ASP  12  -0.611   3.811   4.515
   91    H    CYS  13           H        CYS  13  -3.677   3.191   2.919
   92    HA   CYS  13           HA       CYS  13  -2.986   4.232   0.191
   93   1HB   CYS  13          HB1       CYS  13  -2.689   1.569   1.523
   94   2HB   CYS  13          HB2       CYS  13  -3.205   1.534  -0.185
   95    H    VAL  14           H        VAL  14  -5.444   3.758   2.256
   96    HA   VAL  14           HA       VAL  14  -7.485   2.736   0.772
   97    HB   VAL  14           HB       VAL  14  -7.549   3.877   2.907
   98   1HG1  VAL  14          1HG1      VAL  14  -7.226   6.112   3.216
   99   2HG1  VAL  14          2HG1      VAL  14  -6.016   5.623   1.996
  100   3HG1  VAL  14          3HG1      VAL  14  -7.484   6.495   1.488
  101   1HG2  VAL  14          1HG2      VAL  14  -9.727   5.047   2.751
  102   2HG2  VAL  14          2HG2      VAL  14  -9.550   5.174   0.989
  103   3HG2  VAL  14          3HG2      VAL  14  -9.743   3.581   1.749
  104    H    MET  15           H        MET  15  -5.819   5.637   0.151
  105    HA   MET  15           HA       MET  15  -7.392   6.898  -1.832
  106   1HB   MET  15          HB1       MET  15  -5.364   8.108  -2.461
  107   2HB   MET  15          HB2       MET  15  -5.551   8.022  -0.697
  108   1HG   MET  15          HG1       MET  15  -3.922   6.182  -0.610
  109   2HG   MET  15          HG2       MET  15  -3.755   6.234  -2.373
  110   1HE   MET  15          HE1       MET  15  -1.156   6.316  -2.202
  111   2HE   MET  15          HE2       MET  15  -0.271   7.489  -1.197
  112   3HE   MET  15          HE3       MET  15  -1.282   6.244  -0.426
  113    H    CYS  16           H        CYS  16  -5.357   4.126  -2.065
  114    HA   CYS  16           HA       CYS  16  -4.910   4.096  -4.920
  115   1HB   CYS  16          HB1       CYS  16  -4.818   2.003  -2.759
  116   2HB   CYS  16          HB2       CYS  16  -4.427   1.635  -4.461
  117    H    GLY  17           H        GLY  17  -7.716   3.191  -2.906
  118   1HA   GLY  17          HA1       GLY  17  -9.467   3.149  -4.904
  119   2HA   GLY  17          HA2       GLY  17  -8.929   1.607  -4.943
  120    H    LEU  18           H        LEU  18  -9.324   0.140  -3.215
  121    HA   LEU  18           HA       LEU  18 -11.594   0.880  -1.467
  122   1HB   LEU  18          HB1       LEU  18 -11.348  -1.201  -3.107
  123   2HB   LEU  18          HB2       LEU  18 -10.395  -1.918  -1.854
  124    HG   LEU  18           HG       LEU  18 -13.032  -0.636  -1.263
  125   1HD1  LEU  18          1HD1      LEU  18 -12.737  -3.480  -2.336
  126   2HD1  LEU  18          2HD1      LEU  18 -14.263  -2.748  -1.800
  127   3HD1  LEU  18          3HD1      LEU  18 -13.445  -2.116  -3.231
  128   1HD2  LEU  18          1HD2      LEU  18 -11.726  -2.888   0.185
  129   2HD2  LEU  18          2HD2      LEU  18 -12.259  -1.257   0.745
  130   3HD2  LEU  18          3HD2      LEU  18 -13.445  -2.488   0.353
  131    H    GLY  19           H        GLY  19 -10.512  -1.342   0.075
  132   1HA   GLY  19          HA1       GLY  19  -9.206  -0.033   2.159
  133   2HA   GLY  19          HA2       GLY  19  -9.198  -1.656   1.979
  134    H    ILE  20           H        ILE  20  -7.810  -2.155  -0.224
  135    HA   ILE  20           HA       ILE  20  -5.690  -2.658  -0.820
  136    HB   ILE  20           HB       ILE  20  -5.331   0.356  -0.716
  137   1HG1  ILE  20          1HG1      ILE  20  -7.240   0.125  -2.015
  138   2HG1  ILE  20          2HG1      ILE  20  -5.911   0.123  -3.208
  139   1HG2  ILE  20          1HG2      ILE  20  -4.016  -1.725  -2.454
  140   2HG2  ILE  20          2HG2      ILE  20  -3.702   0.023  -2.426
  141   3HG2  ILE  20          3HG2      ILE  20  -3.242  -0.971  -1.050
  142   1HD1  ILE  20          1HD1      ILE  20  -7.471  -1.512  -3.884
  143   2HD1  ILE  20          2HD1      ILE  20  -6.020  -2.350  -3.296
  144   3HD1  ILE  20          3HD1      ILE  20  -7.487  -2.279  -2.290
  145    H    SER  21           H        SER  21  -5.575  -3.772   1.228
  146    HA   SER  21           HA       SER  21  -4.732  -2.947   3.575
  147   1HB   SER  21          HB1       SER  21  -3.825  -5.568   2.357
  148   2HB   SER  21          HB2       SER  21  -4.432  -5.251   3.996
  149    HG   SER  21           HG       SER  21  -6.075  -6.179   2.703
  150    H    CYS  22           H        CYS  22  -2.865  -2.847   4.785
  151    HA   CYS  22           HA       CYS  22  -0.275  -2.580   3.336
  152   1HB   CYS  22          HB1       CYS  22  -0.986  -0.519   4.194
  153   2HB   CYS  22          HB2       CYS  22  -1.327  -1.140   5.802
  154    H    LYS  23           H        LYS  23   1.161  -4.145   3.698
  155    HA   LYS  23           HA       LYS  23   1.153  -5.728   6.227
  156   1HB   LYS  23          HB1       LYS  23   2.509  -6.118   3.554
  157   2HB   LYS  23          HB2       LYS  23   2.888  -7.037   5.041
  158   1HG   LYS  23          HG1       LYS  23   0.296  -7.397   5.161
  159   2HG   LYS  23          HG2       LYS  23   0.290  -6.980   3.470
  160   1HD   LYS  23          HD1       LYS  23   2.025  -9.120   4.821
  161   2HD   LYS  23          HD2       LYS  23   0.501  -9.488   4.030
  162   1HE   LYS  23          HE1       LYS  23   2.850  -8.181   2.583
  163   2HE   LYS  23          HE2       LYS  23   2.723  -9.948   2.742
  164   1HZ   LYS  23          HZ1       LYS  23   1.781  -8.750   0.687
  165   2HZ   LYS  23          HZ2       LYS  23   0.920  -9.998   1.361
  166   3HZ   LYS  23          HZ3       LYS  23   0.499  -8.430   1.633
  167    H    ASN  24           H        ASN  24   3.717  -6.039   6.696
  168    HA   ASN  24           HA       ASN  24   4.700  -4.023   8.075
  169   1HB   ASN  24          HB1       ASN  24   5.580  -6.300   8.090
  170   2HB   ASN  24          HB2       ASN  24   6.379  -6.027   6.531
  171   1HD2  ASN  24          1HD2      ASN  24   8.462  -6.518   7.592
  172   2HD2  ASN  24          2HD2      ASN  24   9.210  -5.294   8.602
  173    H    GLY  25           H        GLY  25   4.118  -2.225   6.758
  174   1HA   GLY  25          HA1       GLY  25   4.957  -0.184   6.226
  175   2HA   GLY  25          HA2       GLY  25   6.415  -0.821   5.859
  176    H    TYR  26           H        TYR  26   4.044  -2.572   4.250
  177    HA   TYR  26           HA       TYR  26   4.731  -1.183   1.709
  178   1HB   TYR  26          HB1       TYR  26   5.992  -3.417   2.697
  179   2HB   TYR  26          HB2       TYR  26   4.739  -4.087   1.645
  180    HD1  TYR  26           HD1      TYR  26   7.777  -1.990   1.796
  181    HD2  TYR  26           HD2      TYR  26   4.790  -3.732  -0.779
  182    HE1  TYR  26           HE1      TYR  26   9.172  -1.454  -0.192
  183    HE2  TYR  26           HE2      TYR  26   6.206  -3.254  -2.745
  184    HH   TYR  26           HH       TYR  26   7.933  -1.823  -3.447
  185    H    CYS  27           H        CYS  27   2.977  -1.101   0.150
  186    HA   CYS  27           HA       CYS  27   0.457  -2.137   1.372
  187   1HB   CYS  27          HB1       CYS  27  -0.056  -0.086   1.491
  188   2HB   CYS  27          HB2       CYS  27   1.322   0.475   0.545
  189    H    GLN  28           H        GLN  28  -1.208  -2.952   0.119
  190    HA   GLN  28           HA       GLN  28  -0.052  -4.451  -2.209
  191   1HB   GLN  28          HB1       GLN  28  -1.679  -5.429   0.151
  192   2HB   GLN  28          HB2       GLN  28  -0.970  -6.433  -1.120
  193   1HG   GLN  28          HG1       GLN  28   0.693  -4.689   0.751
  194   2HG   GLN  28          HG2       GLN  28   0.225  -6.383   1.103
  195   1HE2  GLN  28          1HE2      GLN  28   2.013  -4.370  -1.372
  196   2HE2  GLN  28          2HE2      GLN  28   3.091  -5.686  -1.788
  197    H    GLY  29           H        GLY  29  -1.274  -4.565  -3.958
  198   1HA   GLY  29          HA1       GLY  29  -3.341  -5.109  -4.952
  199   2HA   GLY  29          HA2       GLY  29  -4.151  -4.320  -3.774
  200    H    CYS  30           H        CYS  30  -2.358  -2.022  -3.803
  201    HA   CYS  30           HA       CYS  30  -3.830  -0.252  -4.975
  202   1HB   CYS  30          HB1       CYS  30  -1.825   0.203  -3.611
  203   2HB   CYS  30          HB2       CYS  30  -0.791  -0.125  -5.014
  204    H    THR  31           H        THR  31  -0.985  -1.549  -6.793
  205    HA   THR  31           HA       THR  31  -1.912  -0.476  -9.350
  206    HB   THR  31           HB       THR  31   0.009  -1.974 -10.121
  207    HG1  THR  31           HG1      THR  31  -0.170  -3.409  -8.354
  208   1HG2  THR  31          1HG2      THR  31   1.769  -0.562  -9.169
  209   2HG2  THR  31          2HG2      THR  31   0.357   0.438  -9.545
  210   3HG2  THR  31          3HG2      THR  31   0.697  -0.025  -7.863
  Start of MODEL   17
    1   1H    THR   1           H        THR   1  13.394  -4.025  -9.565
    2    HA   THR   1           HA       THR   1  13.014  -2.787  -6.967
    3    HB   THR   1           HB       THR   1  12.672  -0.783  -8.474
    4    HG1  THR   1           HG1      THR   1  11.916  -2.023 -10.237
    5   1HG2  THR   1          1HG2      THR   1  15.008  -0.667  -9.241
    6   2HG2  THR   1          2HG2      THR   1  14.929  -1.350  -7.605
    7   3HG2  THR   1          3HG2      THR   1  15.205  -2.412  -9.003
    8    HA   PRO   2           HA       PRO   2   8.729  -4.066  -7.567
    9   1HB   PRO   2          HB1       PRO   2   8.714  -3.811  -4.592
   10   2HB   PRO   2          HB2       PRO   2   7.849  -4.964  -5.599
   11   1HG   PRO   2          HG1       PRO   2  10.199  -5.682  -4.463
   12   2HG   PRO   2          HG2       PRO   2   9.903  -6.134  -6.206
   13   1HD   PRO   2          HD1       PRO   2  11.266  -3.665  -5.091
   14   2HD   PRO   2          HD2       PRO   2  12.051  -4.771  -6.111
   15    H    TYR   3           H        TYR   3   6.569  -2.716  -6.921
   16    HA   TYR   3           HA       TYR   3   6.723  -0.067  -7.417
   17   1HB   TYR   3          HB1       TYR   3   4.775  -1.646  -5.676
   18   2HB   TYR   3          HB2       TYR   3   4.481  -0.138  -6.568
   19    HD1  TYR   3           HD1      TYR   3   4.203  -3.688  -6.746
   20    HD2  TYR   3           HD2      TYR   3   4.797  -0.140  -9.129
   21    HE1  TYR   3           HE1      TYR   3   3.568  -4.942  -8.791
   22    HE2  TYR   3           HE2      TYR   3   4.162  -1.395 -11.159
   23    HH   TYR   3           HH       TYR   3   3.531  -3.440 -12.029
   24    HA   PRO   4           HA       PRO   4   8.438   1.045  -3.291
   25   1HB   PRO   4          HB1       PRO   4   9.037   3.648  -3.709
   26   2HB   PRO   4          HB2       PRO   4   9.962   2.330  -4.507
   27   1HG   PRO   4          HG1       PRO   4   7.674   3.941  -5.668
   28   2HG   PRO   4          HG2       PRO   4   9.282   3.643  -6.405
   29   1HD   PRO   4          HD1       PRO   4   7.071   2.124  -7.005
   30   2HD   PRO   4          HD2       PRO   4   8.705   1.402  -6.918
   31    H    VAL   5           H        VAL   5   5.864   0.484  -2.980
   32    HA   VAL   5           HA       VAL   5   4.230   2.863  -2.643
   33    HB   VAL   5           HB       VAL   5   4.039  -0.016  -3.565
   34   1HG1  VAL   5          1HG1      VAL   5   1.969   1.760  -2.639
   35   2HG1  VAL   5          2HG1      VAL   5   1.678   0.445  -3.901
   36   3HG1  VAL   5          3HG1      VAL   5   2.409   0.034  -2.322
   37   1HG2  VAL   5          1HG2      VAL   5   3.224   2.722  -4.805
   38   2HG2  VAL   5          2HG2      VAL   5   4.643   1.807  -5.334
   39   3HG2  VAL   5          3HG2      VAL   5   3.001   1.180  -5.632
   40    H    ASN   6           H        ASN   6   4.050   3.203  -0.492
   41    HA   ASN   6           HA       ASN   6   4.360   1.066   1.429
   42   1HB   ASN   6          HB1       ASN   6   5.596   3.754   0.761
   43   2HB   ASN   6          HB2       ASN   6   5.672   3.052   2.344
   44   1HD2  ASN   6          1HD2      ASN   6   6.622   0.645   2.310
   45   2HD2  ASN   6          2HD2      ASN   6   7.954   0.386   1.186
   46    H    CYS   7           H        CYS   7   4.099   2.013   3.507
   47    HA   CYS   7           HA       CYS   7   1.744   3.808   3.844
   48   1HB   CYS   7          HB1       CYS   7   0.244   2.142   4.525
   49   2HB   CYS   7          HB2       CYS   7   1.069   1.400   3.129
   50    H    LYS   8           H        LYS   8   1.334   4.310   6.046
   51    HA   LYS   8           HA       LYS   8   3.227   3.377   8.140
   52   1HB   LYS   8          HB1       LYS   8   0.926   5.361   8.004
   53   2HB   LYS   8          HB2       LYS   8   1.669   4.804   9.538
   54   1HG   LYS   8          HG1       LYS   8   3.280   6.288   9.319
   55   2HG   LYS   8          HG2       LYS   8   3.843   5.560   7.834
   56   1HD   LYS   8          HD1       LYS   8   1.525   7.517   7.769
   57   2HD   LYS   8          HD2       LYS   8   3.199   8.118   7.951
   58   1HE   LYS   8          HE1       LYS   8   3.873   7.251   5.862
   59   2HE   LYS   8          HE2       LYS   8   2.441   6.183   5.756
   60   1HZ   LYS   8          HZ1       LYS   8   1.101   8.213   5.606
   61   2HZ   LYS   8          HZ2       LYS   8   2.499   9.054   5.204
   62   3HZ   LYS   8          HZ3       LYS   8   1.900   7.725   4.354
   63    H    THR   9           H        THR   9  -0.297   3.400   7.292
   64    HA   THR   9           HA       THR   9  -0.593   0.604   8.094
   65    HB   THR   9           HB       THR   9  -2.730   1.286   9.210
   66    HG1  THR   9           HG1      THR   9  -3.037   3.446   9.689
   67   1HG2  THR   9          1HG2      THR   9  -0.333   2.761  10.373
   68   2HG2  THR   9          2HG2      THR   9  -1.721   2.130  11.286
   69   3HG2  THR   9          3HG2      THR   9  -0.571   1.003  10.531
   70    H    ASP  10           H        ASP  10  -2.926  -0.029   7.206
   71    HA   ASP  10           HA       ASP  10  -3.037   0.126   4.437
   72   1HB   ASP  10          HB1       ASP  10  -5.208  -0.917   4.912
   73   2HB   ASP  10          HB2       ASP  10  -4.135  -1.375   6.267
   74    H    ARG  11           H        ARG  11  -4.842   1.925   6.700
   75    HA   ARG  11           HA       ARG  11  -6.288   3.320   4.713
   76   1HB   ARG  11          HB1       ARG  11  -6.738   5.182   6.304
   77   2HB   ARG  11          HB2       ARG  11  -7.227   3.518   6.762
   78   1HG   ARG  11          HG1       ARG  11  -6.382   4.707   8.672
   79   2HG   ARG  11          HG2       ARG  11  -5.362   3.321   8.219
   80   1HD   ARG  11          HD1       ARG  11  -4.174   5.462   8.989
   81   2HD   ARG  11          HD2       ARG  11  -3.638   4.726   7.461
   82    HE   ARG  11           HE       ARG  11  -5.654   6.775   7.067
   83   1HH1  ARG  11          2HH2      ARG  11  -2.254   6.347   7.823
   84   2HH1  ARG  11          1HH2      ARG  11  -1.664   7.434   6.595
   85   1HH2  ARG  11          1HH1      ARG  11  -4.915   8.469   5.608
   86   2HH2  ARG  11          2HH1      ARG  11  -3.223   8.867   5.562
   87    H    ASP  12           H        ASP  12  -2.970   3.820   5.448
   88    HA   ASP  12           HA       ASP  12  -2.825   6.493   4.383
   89   1HB   ASP  12          HB1       ASP  12  -1.222   5.131   5.933
   90   2HB   ASP  12          HB2       ASP  12  -0.645   4.397   4.450
   91    H    CYS  13           H        CYS  13  -3.134   3.309   2.990
   92    HA   CYS  13           HA       CYS  13  -2.695   4.417   0.238
   93   1HB   CYS  13          HB1       CYS  13  -2.545   1.659   1.460
   94   2HB   CYS  13          HB2       CYS  13  -2.303   1.959  -0.260
   95    H    VAL  14           H        VAL  14  -5.203   3.852   2.239
   96    HA   VAL  14           HA       VAL  14  -7.044   2.364   0.758
   97    HB   VAL  14           HB       VAL  14  -7.381   3.558   2.797
   98   1HG1  VAL  14          1HG1      VAL  14  -7.428   5.814   3.026
   99   2HG1  VAL  14          2HG1      VAL  14  -6.091   5.486   1.890
  100   3HG1  VAL  14          3HG1      VAL  14  -7.640   6.095   1.264
  101   1HG2  VAL  14          1HG2      VAL  14  -9.700   4.372   2.451
  102   2HG2  VAL  14          2HG2      VAL  14  -9.427   4.430   0.698
  103   3HG2  VAL  14          3HG2      VAL  14  -9.421   2.871   1.548
  104    H    MET  15           H        MET  15  -5.699   5.422   0.068
  105    HA   MET  15           HA       MET  15  -7.303   6.365  -2.069
  106   1HB   MET  15          HB1       MET  15  -5.424   7.811  -2.652
  107   2HB   MET  15          HB2       MET  15  -5.702   7.770  -0.899
  108   1HG   MET  15          HG1       MET  15  -3.840   6.193  -0.633
  109   2HG   MET  15          HG2       MET  15  -3.597   6.159  -2.393
  110   1HE   MET  15          HE1       MET  15  -2.559   9.792   0.255
  111   2HE   MET  15          HE2       MET  15  -4.248   9.395  -0.124
  112   3HE   MET  15          HE3       MET  15  -3.271   8.284   0.872
  113    H    CYS  16           H        CYS  16  -4.949   3.841  -2.018
  114    HA   CYS  16           HA       CYS  16  -4.300   3.703  -4.798
  115   1HB   CYS  16          HB1       CYS  16  -4.239   1.672  -2.568
  116   2HB   CYS  16          HB2       CYS  16  -3.687   1.313  -4.257
  117    H    GLY  17           H        GLY  17  -7.210   2.663  -3.030
  118   1HA   GLY  17          HA1       GLY  17  -8.698   2.557  -5.281
  119   2HA   GLY  17          HA2       GLY  17  -8.214   1.010  -5.083
  120    H    LEU  18           H        LEU  18  -8.915  -0.267  -3.328
  121    HA   LEU  18           HA       LEU  18 -11.237   0.796  -1.823
  122   1HB   LEU  18          HB1       LEU  18 -11.119  -1.396  -3.331
  123   2HB   LEU  18          HB2       LEU  18 -10.330  -2.132  -1.982
  124    HG   LEU  18           HG       LEU  18 -12.831  -0.538  -1.632
  125   1HD1  LEU  18          1HD1      LEU  18 -14.270  -2.522  -2.142
  126   2HD1  LEU  18          2HD1      LEU  18 -13.300  -2.070  -3.546
  127   3HD1  LEU  18          3HD1      LEU  18 -12.808  -3.453  -2.542
  128   1HD2  LEU  18          1HD2      LEU  18 -12.255  -1.127   0.450
  129   2HD2  LEU  18          2HD2      LEU  18 -13.551  -2.239   0.045
  130   3HD2  LEU  18          3HD2      LEU  18 -11.881  -2.834   0.010
  131    H    GLY  19           H        GLY  19 -10.491  -1.440  -0.094
  132   1HA   GLY  19          HA1       GLY  19  -9.263  -0.181   2.023
  133   2HA   GLY  19          HA2       GLY  19  -9.279  -1.807   1.862
  134    H    ILE  20           H        ILE  20  -7.718  -2.248  -0.317
  135    HA   ILE  20           HA       ILE  20  -5.599  -3.010  -0.517
  136    HB   ILE  20           HB       ILE  20  -4.928  -0.031  -0.549
  137   1HG1  ILE  20          1HG1      ILE  20  -6.719  -0.215  -1.997
  138   2HG1  ILE  20          2HG1      ILE  20  -5.256  -0.239  -3.003
  139   1HG2  ILE  20          1HG2      ILE  20  -3.108  -0.624  -1.898
  140   2HG2  ILE  20          2HG2      ILE  20  -2.983  -1.665  -0.496
  141   3HG2  ILE  20          3HG2      ILE  20  -3.605  -2.331  -2.008
  142   1HD1  ILE  20          1HD1      ILE  20  -6.999  -2.618  -2.314
  143   2HD1  ILE  20          2HD1      ILE  20  -6.824  -1.812  -3.881
  144   3HD1  ILE  20          3HD1      ILE  20  -5.455  -2.706  -3.195
  145    H    SER  21           H        SER  21  -5.938  -3.972   1.655
  146    HA   SER  21           HA       SER  21  -5.034  -2.770   3.999
  147   1HB   SER  21          HB1       SER  21  -4.926  -5.400   4.555
  148   2HB   SER  21          HB2       SER  21  -6.397  -4.377   4.476
  149    HG   SER  21           HG       SER  21  -6.682  -6.254   3.211
  150    H    CYS  22           H        CYS  22  -3.118  -1.963   4.075
  151    HA   CYS  22           HA       CYS  22  -0.912  -2.837   2.599
  152   1HB   CYS  22          HB1       CYS  22  -1.074  -0.557   3.234
  153   2HB   CYS  22          HB2       CYS  22  -0.896  -0.862   4.966
  154    H    LYS  23           H        LYS  23   1.049  -3.872   3.055
  155    HA   LYS  23           HA       LYS  23   1.020  -5.758   5.353
  156   1HB   LYS  23          HB1       LYS  23   1.703  -5.988   2.567
  157   2HB   LYS  23          HB2       LYS  23   3.185  -6.245   3.508
  158   1HG   LYS  23          HG1       LYS  23   2.404  -8.370   3.449
  159   2HG   LYS  23          HG2       LYS  23   1.665  -7.856   4.955
  160   1HD   LYS  23          HD1       LYS  23   0.407  -8.243   2.213
  161   2HD   LYS  23          HD2       LYS  23   0.003  -9.057   3.736
  162   1HE   LYS  23          HE1       LYS  23  -0.891  -6.859   4.588
  163   2HE   LYS  23          HE2       LYS  23  -0.534  -6.163   2.968
  164   1HZ   LYS  23          HZ1       LYS  23  -2.703  -6.609   3.006
  165   2HZ   LYS  23          HZ2       LYS  23  -2.028  -7.722   2.008
  166   3HZ   LYS  23          HZ3       LYS  23  -2.549  -8.188   3.517
  167    H    ASN  24           H        ASN  24   3.859  -6.063   5.415
  168    HA   ASN  24           HA       ASN  24   4.695  -4.440   7.397
  169   1HB   ASN  24          HB1       ASN  24   6.423  -5.840   5.521
  170   2HB   ASN  24          HB2       ASN  24   6.876  -5.261   7.105
  171   1HD2  ASN  24          1HD2      ASN  24   6.573  -6.760   8.808
  172   2HD2  ASN  24          2HD2      ASN  24   5.556  -8.183   8.672
  173    H    GLY  25           H        GLY  25   3.868  -2.383   6.450
  174   1HA   GLY  25          HA1       GLY  25   4.333  -0.230   6.040
  175   2HA   GLY  25          HA2       GLY  25   5.924  -0.554   5.865
  176    H    TYR  26           H        TYR  26   3.729  -2.371   3.959
  177    HA   TYR  26           HA       TYR  26   4.695  -0.979   1.489
  178   1HB   TYR  26          HB1       TYR  26   5.962  -3.077   2.597
  179   2HB   TYR  26          HB2       TYR  26   4.810  -3.891   1.533
  180    HD1  TYR  26           HD1      TYR  26   7.932  -2.094   1.739
  181    HD2  TYR  26           HD2      TYR  26   4.761  -3.247  -0.950
  182    HE1  TYR  26           HE1      TYR  26   9.385  -1.571  -0.207
  183    HE2  TYR  26           HE2      TYR  26   6.233  -2.789  -2.878
  184    HH   TYR  26           HH       TYR  26   8.129  -1.554  -3.490
  185    H    CYS  27           H        CYS  27   2.824  -0.700  -0.092
  186    HA   CYS  27           HA       CYS  27   0.484  -2.288   0.799
  187   1HB   CYS  27          HB1       CYS  27  -0.847  -0.534   0.183
  188   2HB   CYS  27          HB2       CYS  27   0.277  -0.123   1.491
  189    H    GLN  28           H        GLN  28   1.643  -3.801  -0.413
  190    HA   GLN  28           HA       GLN  28   1.851  -4.656  -2.834
  191   1HB   GLN  28          HB1       GLN  28   0.359  -6.610  -2.225
  192   2HB   GLN  28          HB2       GLN  28   1.662  -6.189  -1.081
  193   1HG   GLN  28          HG1       GLN  28   0.205  -5.870   0.573
  194   2HG   GLN  28          HG2       GLN  28  -0.779  -4.747  -0.379
  195   1HE2  GLN  28          1HE2      GLN  28  -2.176  -5.843  -2.119
  196   2HE2  GLN  28          2HE2      GLN  28  -3.055  -7.276  -1.585
  197    H    GLY  29           H        GLY  29   1.067  -3.942  -4.741
  198   1HA   GLY  29          HA1       GLY  29  -0.376  -4.112  -6.446
  199   2HA   GLY  29          HA2       GLY  29  -1.265  -5.112  -5.510
  200    H    CYS  30           H        CYS  30  -0.858  -1.904  -4.528
  201    HA   CYS  30           HA       CYS  30  -3.104  -0.837  -4.052
  202   1HB   CYS  30          HB1       CYS  30  -0.793   0.169  -5.603
  203   2HB   CYS  30          HB2       CYS  30  -2.134   1.270  -5.578
  204    H    THR  31           H        THR  31  -2.246  -0.867  -7.525
  205    HA   THR  31           HA       THR  31  -4.741  -0.148  -8.595
  206    HB   THR  31           HB       THR  31  -2.722  -0.383  -9.935
  207    HG1  THR  31           HG1      THR  31  -4.809  -0.647 -10.913
  208   1HG2  THR  31          1HG2      THR  31  -3.077  -3.383  -9.533
  209   2HG2  THR  31          2HG2      THR  31  -1.912  -2.603 -10.620
  210   3HG2  THR  31          3HG2      THR  31  -1.754  -2.406  -8.865
  Start of MODEL   18
    1   1H    THR   1           H        THR   1  12.537  -4.193  -2.578
    2    HA   THR   1           HA       THR   1  10.192  -5.698  -3.425
    3    HB   THR   1           HB       THR   1   9.151  -4.273  -1.654
    4    HG1  THR   1           HG1      THR   1  10.594  -2.510  -1.961
    5   1HG2  THR   1          1HG2      THR   1  10.334  -5.247   0.248
    6   2HG2  THR   1          2HG2      THR   1  10.182  -6.445  -1.052
    7   3HG2  THR   1          3HG2      THR   1  11.736  -5.630  -0.768
    8    HA   PRO   2           HA       PRO   2  10.876  -2.912  -6.770
    9   1HB   PRO   2          HB1       PRO   2   8.383  -4.289  -7.725
   10   2HB   PRO   2          HB2       PRO   2   9.590  -3.479  -8.733
   11   1HG   PRO   2          HG1       PRO   2  10.001  -6.053  -8.037
   12   2HG   PRO   2          HG2       PRO   2  11.395  -4.881  -7.913
   13   1HD   PRO   2          HD1       PRO   2   9.569  -5.962  -5.783
   14   2HD   PRO   2          HD2       PRO   2  11.260  -5.778  -5.641
   15    H    TYR   3           H        TYR   3   7.289  -2.926  -5.989
   16    HA   TYR   3           HA       TYR   3   6.771  -0.341  -6.818
   17   1HB   TYR   3          HB1       TYR   3   5.276  -1.811  -4.637
   18   2HB   TYR   3          HB2       TYR   3   4.681  -0.849  -6.007
   19    HD1  TYR   3           HD1      TYR   3   5.189  -1.784  -8.409
   20    HD2  TYR   3           HD2      TYR   3   5.096  -4.154  -4.808
   21    HE1  TYR   3           HE1      TYR   3   5.101  -3.846  -9.770
   22    HE2  TYR   3           HE2      TYR   3   5.017  -6.219  -6.176
   23    HH   TYR   3           HH       TYR   3   5.069  -6.154  -9.746
   24    HA   PRO   4           HA       PRO   4   8.563   1.405  -2.922
   25   1HB   PRO   4          HB1       PRO   4   8.728   4.013  -3.572
   26   2HB   PRO   4          HB2       PRO   4   9.789   2.799  -4.370
   27   1HG   PRO   4          HG1       PRO   4   7.177   3.930  -5.419
   28   2HG   PRO   4          HG2       PRO   4   8.755   3.866  -6.270
   29   1HD   PRO   4          HD1       PRO   4   6.804   1.943  -6.590
   30   2HD   PRO   4          HD2       PRO   4   8.546   1.546  -6.631
   31    H    VAL   5           H        VAL   5   5.847   0.492  -2.819
   32    HA   VAL   5           HA       VAL   5   4.079   2.770  -2.673
   33    HB   VAL   5           HB       VAL   5   4.044  -0.199  -3.263
   34   1HG1  VAL   5          1HG1      VAL   5   1.631   0.289  -3.757
   35   2HG1  VAL   5          2HG1      VAL   5   2.355  -0.048  -2.155
   36   3HG1  VAL   5          3HG1      VAL   5   1.943   1.660  -2.564
   37   1HG2  VAL   5          1HG2      VAL   5   3.116   0.679  -5.511
   38   2HG2  VAL   5          2HG2      VAL   5   3.254   2.328  -4.894
   39   3HG2  VAL   5          3HG2      VAL   5   4.719   1.385  -5.207
   40    H    ASN   6           H        ASN   6   3.973   3.363  -0.588
   41    HA   ASN   6           HA       ASN   6   4.409   1.469   1.549
   42   1HB   ASN   6          HB1       ASN   6   5.278   4.237   0.679
   43   2HB   ASN   6          HB2       ASN   6   5.425   3.655   2.315
   44   1HD2  ASN   6          1HD2      ASN   6   7.773   4.457   1.291
   45   2HD2  ASN   6          2HD2      ASN   6   8.730   3.098   0.733
   46    H    CYS   7           H        CYS   7   3.939   2.531   3.538
   47    HA   CYS   7           HA       CYS   7   1.368   4.042   3.701
   48   1HB   CYS   7          HB1       CYS   7   0.042   2.213   4.163
   49   2HB   CYS   7          HB2       CYS   7   1.226   1.446   3.065
   50    H    LYS   8           H        LYS   8   1.070   4.922   5.840
   51    HA   LYS   8           HA       LYS   8   2.856   4.052   8.040
   52   1HB   LYS   8          HB1       LYS   8   0.514   5.899   7.861
   53   2HB   LYS   8          HB2       LYS   8   1.234   5.301   9.409
   54   1HG   LYS   8          HG1       LYS   8   2.526   7.091   9.216
   55   2HG   LYS   8          HG2       LYS   8   3.532   6.081   8.231
   56   1HD   LYS   8          HD1       LYS   8   1.358   7.663   6.862
   57   2HD   LYS   8          HD2       LYS   8   2.745   8.562   7.547
   58   1HE   LYS   8          HE1       LYS   8   4.241   7.709   6.038
   59   2HE   LYS   8          HE2       LYS   8   3.361   6.181   5.824
   60   1HZ   LYS   8          HZ1       LYS   8   1.723   7.320   4.586
   61   2HZ   LYS   8          HZ2       LYS   8   2.516   8.760   4.698
   62   3HZ   LYS   8          HZ3       LYS   8   3.190   7.497   3.869
   63    H    THR   9           H        THR   9  -0.344   3.232   6.705
   64    HA   THR   9           HA       THR   9  -0.376   0.636   7.678
   65    HB   THR   9           HB       THR   9  -0.834   1.389   9.894
   66    HG1  THR   9           HG1      THR   9  -2.348  -0.295   9.058
   67   1HG2  THR   9          1HG2      THR   9  -1.550   3.735   9.421
   68   2HG2  THR   9          2HG2      THR   9  -3.095   3.098   8.803
   69   3HG2  THR   9          3HG2      THR   9  -2.661   2.886  10.504
   70    H    ASP  10           H        ASP  10  -3.091   0.146   7.502
   71    HA   ASP  10           HA       ASP  10  -3.407   0.012   4.708
   72   1HB   ASP  10          HB1       ASP  10  -5.397  -0.158   7.077
   73   2HB   ASP  10          HB2       ASP  10  -5.658  -0.923   5.538
   74    H    ARG  11           H        ARG  11  -5.173   1.962   6.934
   75    HA   ARG  11           HA       ARG  11  -6.708   3.520   5.159
   76   1HB   ARG  11          HB1       ARG  11  -6.750   5.210   6.836
   77   2HB   ARG  11          HB2       ARG  11  -6.184   3.873   7.840
   78   1HG   ARG  11          HG1       ARG  11  -3.828   4.542   7.259
   79   2HG   ARG  11          HG2       ARG  11  -4.502   5.981   6.403
   80   1HD   ARG  11          HD1       ARG  11  -5.298   6.895   8.480
   81   2HD   ARG  11          HD2       ARG  11  -4.460   5.577   9.324
   82    HE   ARG  11           HE       ARG  11  -2.721   6.767   7.306
   83   1HH1  ARG  11          2HH2      ARG  11  -3.948   7.621  10.496
   84   2HH1  ARG  11          1HH2      ARG  11  -2.642   8.721  10.834
   85   1HH2  ARG  11          1HH1      ARG  11  -1.168   8.058   7.614
   86   2HH2  ARG  11          2HH1      ARG  11  -0.927   9.020   9.080
   87    H    ASP  12           H        ASP  12  -3.197   3.520   5.408
   88    HA   ASP  12           HA       ASP  12  -3.130   6.147   4.274
   89   1HB   ASP  12          HB1       ASP  12  -1.775   4.647   6.079
   90   2HB   ASP  12          HB2       ASP  12  -0.802   4.299   4.681
   91    H    CYS  13           H        CYS  13  -3.709   3.084   2.978
   92    HA   CYS  13           HA       CYS  13  -2.977   4.086   0.246
   93   1HB   CYS  13          HB1       CYS  13  -2.724   1.378   1.576
   94   2HB   CYS  13          HB2       CYS  13  -2.553   1.588  -0.168
   95    H    VAL  14           H        VAL  14  -5.494   3.419   2.182
   96    HA   VAL  14           HA       VAL  14  -7.314   1.969   0.667
   97    HB   VAL  14           HB       VAL  14  -7.589   3.223   2.757
   98   1HG1  VAL  14          1HG1      VAL  14  -7.625   5.483   2.912
   99   2HG1  VAL  14          2HG1      VAL  14  -6.307   5.099   1.767
  100   3HG1  VAL  14          3HG1      VAL  14  -7.867   5.709   1.151
  101   1HG2  VAL  14          1HG2      VAL  14  -9.881   4.197   2.408
  102   2HG2  VAL  14          2HG2      VAL  14  -9.683   3.957   0.659
  103   3HG2  VAL  14          3HG2      VAL  14  -9.705   2.560   1.767
  104    H    MET  15           H        MET  15  -5.984   5.047  -0.008
  105    HA   MET  15           HA       MET  15  -7.617   5.954  -2.130
  106   1HB   MET  15          HB1       MET  15  -5.835   7.555  -2.560
  107   2HB   MET  15          HB2       MET  15  -6.113   7.394  -0.815
  108   1HG   MET  15          HG1       MET  15  -4.172   5.864  -0.664
  109   2HG   MET  15          HG2       MET  15  -3.900   6.048  -2.405
  110   1HE   MET  15          HE1       MET  15  -1.584   6.402  -0.356
  111   2HE   MET  15          HE2       MET  15  -1.394   6.653  -2.107
  112   3HE   MET  15          HE3       MET  15  -0.808   7.883  -0.962
  113    H    CYS  16           H        CYS  16  -5.171   3.521  -2.098
  114    HA   CYS  16           HA       CYS  16  -4.365   3.613  -4.867
  115   1HB   CYS  16          HB1       CYS  16  -4.403   1.442  -2.787
  116   2HB   CYS  16          HB2       CYS  16  -3.776   1.161  -4.451
  117    H    GLY  17           H        GLY  17  -7.300   2.427  -3.236
  118   1HA   GLY  17          HA1       GLY  17  -8.649   2.365  -5.634
  119   2HA   GLY  17          HA2       GLY  17  -8.303   0.813  -5.260
  120    H    LEU  18           H        LEU  18  -9.167  -0.202  -3.397
  121    HA   LEU  18           HA       LEU  18 -11.825   0.886  -2.602
  122   1HB   LEU  18          HB1       LEU  18 -11.890  -0.998  -3.758
  123   2HB   LEU  18          HB2       LEU  18 -10.792  -1.832  -2.668
  124    HG   LEU  18           HG       LEU  18 -12.302  -1.653  -0.859
  125   1HD1  LEU  18          1HD1      LEU  18 -14.538  -0.530  -0.918
  126   2HD1  LEU  18          2HD1      LEU  18 -13.217   0.629  -0.850
  127   3HD1  LEU  18          3HD1      LEU  18 -14.055   0.323  -2.391
  128   1HD2  LEU  18          1HD2      LEU  18 -12.767  -3.134  -2.749
  129   2HD2  LEU  18          2HD2      LEU  18 -14.315  -2.688  -1.943
  130   3HD2  LEU  18          3HD2      LEU  18 -13.788  -1.809  -3.428
  131    H    GLY  19           H        GLY  19 -10.112  -1.546  -0.896
  132   1HA   GLY  19          HA1       GLY  19  -9.353   0.097   1.374
  133   2HA   GLY  19          HA2       GLY  19 -10.221  -1.271   1.578
  134    H    ILE  20           H        ILE  20  -7.508  -0.281  -0.330
  135    HA   ILE  20           HA       ILE  20  -6.226  -2.824  -0.401
  136    HB   ILE  20           HB       ILE  20  -4.958  -0.107  -0.816
  137   1HG1  ILE  20          1HG1      ILE  20  -6.811  -0.056  -2.244
  138   2HG1  ILE  20          2HG1      ILE  20  -5.404  -0.439  -3.256
  139   1HG2  ILE  20          1HG2      ILE  20  -4.203  -2.850  -1.864
  140   2HG2  ILE  20          2HG2      ILE  20  -3.431  -1.311  -2.293
  141   3HG2  ILE  20          3HG2      ILE  20  -3.327  -1.907  -0.640
  142   1HD1  ILE  20          1HD1      ILE  20  -6.054  -2.841  -3.196
  143   2HD1  ILE  20          2HD1      ILE  20  -7.519  -2.392  -2.286
  144   3HD1  ILE  20          3HD1      ILE  20  -7.279  -1.794  -3.940
  145    H    SER  21           H        SER  21  -6.067  -3.674   1.706
  146    HA   SER  21           HA       SER  21  -4.978  -2.395   3.912
  147   1HB   SER  21          HB1       SER  21  -4.558  -4.900   4.551
  148   2HB   SER  21          HB2       SER  21  -6.231  -4.374   4.229
  149    HG   SER  21           HG       SER  21  -4.517  -5.464   2.243
  150    H    CYS  22           H        CYS  22  -2.911  -2.733   4.963
  151    HA   CYS  22           HA       CYS  22  -0.680  -2.870   2.964
  152   1HB   CYS  22          HB1       CYS  22  -1.081  -0.572   3.366
  153   2HB   CYS  22          HB2       CYS  22  -1.013  -0.714   5.127
  154    H    LYS  23           H        LYS  23   1.177  -3.893   3.487
  155    HA   LYS  23           HA       LYS  23   1.288  -5.490   5.976
  156   1HB   LYS  23          HB1       LYS  23   3.117  -5.524   3.615
  157   2HB   LYS  23          HB2       LYS  23   3.066  -6.652   5.008
  158   1HG   LYS  23          HG1       LYS  23   0.576  -6.971   4.458
  159   2HG   LYS  23          HG2       LYS  23   0.954  -6.177   2.920
  160   1HD   LYS  23          HD1       LYS  23   2.965  -8.029   2.981
  161   2HD   LYS  23          HD2       LYS  23   1.791  -8.826   4.054
  162   1HE   LYS  23          HE1       LYS  23   0.050  -8.493   2.236
  163   2HE   LYS  23          HE2       LYS  23   1.322  -7.698   1.249
  164   1HZ   LYS  23          HZ1       LYS  23   2.453  -9.804   1.144
  165   2HZ   LYS  23          HZ2       LYS  23   1.197 -10.543   1.935
  166   3HZ   LYS  23          HZ3       LYS  23   0.944  -9.789   0.478
  167    H    ASN  24           H        ASN  24   4.224  -5.433   5.991
  168    HA   ASN  24           HA       ASN  24   4.786  -3.582   7.955
  169   1HB   ASN  24          HB1       ASN  24   6.630  -5.137   6.319
  170   2HB   ASN  24          HB2       ASN  24   7.099  -4.193   7.727
  171   1HD2  ASN  24          1HD2      ASN  24   6.666  -7.274   6.849
  172   2HD2  ASN  24          2HD2      ASN  24   5.936  -7.923   8.309
  173    H    GLY  25           H        GLY  25   3.867  -1.725   6.855
  174   1HA   GLY  25          HA1       GLY  25   4.176   0.419   6.283
  175   2HA   GLY  25          HA2       GLY  25   5.783   0.193   6.105
  176    H    TYR  26           H        TYR  26   3.724  -1.941   4.369
  177    HA   TYR  26           HA       TYR  26   4.543  -0.629   1.805
  178   1HB   TYR  26          HB1       TYR  26   6.288  -2.110   2.707
  179   2HB   TYR  26          HB2       TYR  26   5.114  -3.423   2.576
  180    HD1  TYR  26           HD1      TYR  26   4.380  -4.223   0.293
  181    HD2  TYR  26           HD2      TYR  26   7.415  -1.201   0.810
  182    HE1  TYR  26           HE1      TYR  26   5.130  -4.566  -2.050
  183    HE2  TYR  26           HE2      TYR  26   8.222  -1.620  -1.478
  184    HH   TYR  26           HH       TYR  26   7.695  -2.562  -3.477
  185    H    CYS  27           H        CYS  27   2.753  -0.760   0.167
  186    HA   CYS  27           HA       CYS  27   0.552  -2.491   1.137
  187   1HB   CYS  27          HB1       CYS  27  -0.893  -0.826   0.626
  188   2HB   CYS  27          HB2       CYS  27   0.350  -0.208   1.724
  189    H    GLN  28           H        GLN  28   1.072  -4.179  -0.070
  190    HA   GLN  28           HA       GLN  28   1.448  -4.447  -2.790
  191   1HB   GLN  28          HB1       GLN  28   0.360  -6.678  -2.514
  192   2HB   GLN  28          HB2       GLN  28   1.603  -6.340  -1.298
  193   1HG   GLN  28          HG1       GLN  28   0.022  -6.053   0.417
  194   2HG   GLN  28          HG2       GLN  28  -1.299  -5.701  -0.719
  195   1HE2  GLN  28          1HE2      GLN  28  -2.825  -7.248  -0.313
  196   2HE2  GLN  28          2HE2      GLN  28  -2.501  -8.967  -0.371
  197    H    GLY  29           H        GLY  29   0.076  -4.967  -4.568
  198   1HA   GLY  29          HA1       GLY  29  -1.828  -5.189  -5.711
  199   2HA   GLY  29          HA2       GLY  29  -2.593  -5.390  -4.282
  200    H    CYS  30           H        CYS  30  -1.264  -2.309  -4.451
  201    HA   CYS  30           HA       CYS  30  -3.613  -0.919  -4.540
  202   1HB   CYS  30          HB1       CYS  30  -0.826  -0.251  -5.452
  203   2HB   CYS  30          HB2       CYS  30  -2.043   0.987  -5.583
  204    H    THR  31           H        THR  31  -1.741  -2.118  -7.310
  205    HA   THR  31           HA       THR  31  -4.129  -2.228  -8.855
  206    HB   THR  31           HB       THR  31  -3.548   0.112  -9.344
  207    HG1  THR  31           HG1      THR  31  -4.494  -0.946 -11.007
  208   1HG2  THR  31          1HG2      THR  31  -1.516   0.652 -10.593
  209   2HG2  THR  31          2HG2      THR  31  -1.104  -0.022  -9.002
  210   3HG2  THR  31          3HG2      THR  31  -0.956  -1.028 -10.463
  Start of MODEL   19
    1   1H    THR   1           H        THR   1   7.143  -5.093  -3.013
    2    HA   THR   1           HA       THR   1   9.185  -4.019  -2.881
    3    HB   THR   1           HB       THR   1  10.477  -6.263  -4.480
    4    HG1  THR   1           HG1      THR   1   9.491  -6.807  -2.402
    5   1HG2  THR   1          1HG2      THR   1  12.543  -5.381  -3.470
    6   2HG2  THR   1          2HG2      THR   1  11.759  -4.139  -4.463
    7   3HG2  THR   1          3HG2      THR   1  11.624  -4.078  -2.692
    8    HA   PRO   2           HA       PRO   2   9.471  -3.913  -7.696
    9   1HB   PRO   2          HB1       PRO   2   6.733  -4.915  -8.367
   10   2HB   PRO   2          HB2       PRO   2   8.146  -4.795  -9.415
   11   1HG   PRO   2          HG1       PRO   2   7.703  -7.104  -8.095
   12   2HG   PRO   2          HG2       PRO   2   9.395  -6.425  -8.086
   13   1HD   PRO   2          HD1       PRO   2   7.168  -6.038  -6.066
   14   2HD   PRO   2          HD2       PRO   2   8.666  -6.715  -5.674
   15    H    TYR   3           H        TYR   3   6.142  -3.372  -6.342
   16    HA   TYR   3           HA       TYR   3   5.842  -0.753  -7.397
   17   1HB   TYR   3          HB1       TYR   3   4.239  -2.254  -5.305
   18   2HB   TYR   3          HB2       TYR   3   3.736  -1.047  -6.509
   19    HD1  TYR   3           HD1      TYR   3   4.025  -1.678  -9.028
   20    HD2  TYR   3           HD2      TYR   3   3.855  -4.534  -5.800
   21    HE1  TYR   3           HE1      TYR   3   3.638  -3.496 -10.657
   22    HE2  TYR   3           HE2      TYR   3   3.476  -6.355  -7.440
   23    HH   TYR   3           HH       TYR   3   3.347  -5.765 -10.961
   24    HA   PRO   4           HA       PRO   4   7.816   0.657  -3.411
   25   1HB   PRO   4          HB1       PRO   4   8.420   3.191  -4.088
   26   2HB   PRO   4          HB2       PRO   4   9.356   1.811  -4.753
   27   1HG   PRO   4          HG1       PRO   4   7.060   3.286  -6.073
   28   2HG   PRO   4          HG2       PRO   4   8.675   2.933  -6.770
   29   1HD   PRO   4          HD1       PRO   4   6.476   1.337  -7.225
   30   2HD   PRO   4          HD2       PRO   4   8.130   0.668  -7.077
   31    H    VAL   5           H        VAL   5   5.216   0.109  -3.137
   32    HA   VAL   5           HA       VAL   5   3.597   2.523  -2.993
   33    HB   VAL   5           HB       VAL   5   3.382  -0.414  -3.708
   34   1HG1  VAL   5          1HG1      VAL   5   0.952   0.172  -4.039
   35   2HG1  VAL   5          2HG1      VAL   5   1.753  -0.292  -2.508
   36   3HG1  VAL   5          3HG1      VAL   5   1.391   1.458  -2.785
   37   1HG2  VAL   5          1HG2      VAL   5   2.354   0.598  -5.856
   38   2HG2  VAL   5          2HG2      VAL   5   2.621   2.211  -5.183
   39   3HG2  VAL   5          3HG2      VAL   5   4.010   1.200  -5.620
   40    H    ASN   6           H        ASN   6   3.598   2.994  -0.840
   41    HA   ASN   6           HA       ASN   6   4.144   0.950   1.117
   42   1HB   ASN   6          HB1       ASN   6   5.063   3.739   0.373
   43   2HB   ASN   6          HB2       ASN   6   5.409   2.962   1.894
   44   1HD2  ASN   6          1HD2      ASN   6   6.396   0.552   1.496
   45   2HD2  ASN   6          2HD2      ASN   6   7.638   0.496   0.252
   46    H    CYS   7           H        CYS   7   4.002   1.800   3.211
   47    HA   CYS   7           HA       CYS   7   1.616   3.398   3.888
   48   1HB   CYS   7          HB1       CYS   7   0.287   1.433   4.646
   49   2HB   CYS   7          HB2       CYS   7   0.598   1.433   2.887
   50    H    LYS   8           H        LYS   8   1.150   3.522   6.051
   51    HA   LYS   8           HA       LYS   8   2.938   2.260   8.074
   52   1HB   LYS   8          HB1       LYS   8   1.000   4.606   8.092
   53   2HB   LYS   8          HB2       LYS   8   1.753   3.892   9.552
   54   1HG   LYS   8          HG1       LYS   8   3.543   5.142   9.239
   55   2HG   LYS   8          HG2       LYS   8   3.904   4.340   7.731
   56   1HD   LYS   8          HD1       LYS   8   1.882   6.591   7.713
   57   2HD   LYS   8          HD2       LYS   8   3.610   6.995   7.937
   58   1HE   LYS   8          HE1       LYS   8   4.224   6.084   5.843
   59   2HE   LYS   8          HE2       LYS   8   2.661   5.222   5.680
   60   1HZ   LYS   8          HZ1       LYS   8   2.334   6.850   4.318
   61   2HZ   LYS   8          HZ2       LYS   8   1.611   7.417   5.581
   62   3HZ   LYS   8          HZ3       LYS   8   3.110   8.065   5.196
   63    H    THR   9           H        THR   9  -0.494   2.963   7.204
   64    HA   THR   9           HA       THR   9  -1.367   0.296   8.128
   65    HB   THR   9           HB       THR   9  -3.443   1.510   8.930
   66    HG1  THR   9           HG1      THR   9  -3.094   3.785   9.314
   67   1HG2  THR   9          1HG2      THR   9  -2.452   2.293  11.037
   68   2HG2  THR   9          2HG2      THR   9  -1.568   0.852  10.495
   69   3HG2  THR   9          3HG2      THR   9  -0.865   2.468  10.254
   70    H    ASP  10           H        ASP  10  -3.754   0.011   7.051
   71    HA   ASP  10           HA       ASP  10  -3.379  -0.006   4.229
   72   1HB   ASP  10          HB1       ASP  10  -5.564  -1.073   4.435
   73   2HB   ASP  10          HB2       ASP  10  -4.778  -1.403   6.016
   74    H    ARG  11           H        ARG  11  -5.209   1.899   6.371
   75    HA   ARG  11           HA       ARG  11  -6.347   3.581   4.415
   76   1HB   ARG  11          HB1       ARG  11  -6.793   5.267   6.030
   77   2HB   ARG  11          HB2       ARG  11  -7.110   3.616   6.651
   78   1HG   ARG  11          HG1       ARG  11  -6.149   4.876   8.408
   79   2HG   ARG  11          HG2       ARG  11  -4.995   3.668   7.807
   80   1HD   ARG  11          HD1       ARG  11  -4.291   6.187   8.447
   81   2HD   ARG  11          HD2       ARG  11  -3.502   5.309   7.109
   82    HE   ARG  11           HE       ARG  11  -4.426   6.728   5.585
   83   1HH1  ARG  11          2HH2      ARG  11  -6.105   7.199   8.633
   84   2HH1  ARG  11          1HH2      ARG  11  -6.978   8.618   8.129
   85   1HH2  ARG  11          1HH1      ARG  11  -5.561   8.538   4.846
   86   2HH2  ARG  11          2HH1      ARG  11  -6.650   9.404   5.885
   87    H    ASP  12           H        ASP  12  -2.976   3.491   5.240
   88    HA   ASP  12           HA       ASP  12  -2.496   6.216   4.387
   89   1HB   ASP  12          HB1       ASP  12  -1.062   4.658   5.823
   90   2HB   ASP  12          HB2       ASP  12  -0.594   3.875   4.330
   91    H    CYS  13           H        CYS  13  -3.181   3.170   2.796
   92    HA   CYS  13           HA       CYS  13  -2.707   4.333   0.074
   93   1HB   CYS  13          HB1       CYS  13  -2.821   1.554   1.243
   94   2HB   CYS  13          HB2       CYS  13  -2.697   1.835  -0.498
   95    H    VAL  14           H        VAL  14  -5.192   4.048   2.139
   96    HA   VAL  14           HA       VAL  14  -7.282   2.954   0.737
   97    HB   VAL  14           HB       VAL  14  -7.422   4.276   2.714
   98   1HG1  VAL  14          1HG1      VAL  14  -5.676   5.838   1.779
   99   2HG1  VAL  14          2HG1      VAL  14  -7.049   6.780   1.153
  100   3HG1  VAL  14          3HG1      VAL  14  -6.912   6.461   2.910
  101   1HG2  VAL  14          1HG2      VAL  14  -9.169   5.602   0.593
  102   2HG2  VAL  14          2HG2      VAL  14  -9.542   4.075   1.419
  103   3HG2  VAL  14          3HG2      VAL  14  -9.465   5.590   2.341
  104    H    MET  15           H        MET  15  -5.520   5.737  -0.113
  105    HA   MET  15           HA       MET  15  -7.033   6.826  -2.233
  106   1HB   MET  15          HB1       MET  15  -4.983   7.965  -2.922
  107   2HB   MET  15          HB2       MET  15  -5.207   8.019  -1.162
  108   1HG   MET  15          HG1       MET  15  -3.587   6.196  -0.891
  109   2HG   MET  15          HG2       MET  15  -3.408   6.074  -2.654
  110   1HE   MET  15          HE1       MET  15  -2.597   8.148   0.546
  111   2HE   MET  15          HE2       MET  15  -1.738   9.549  -0.127
  112   3HE   MET  15          HE3       MET  15  -3.485   9.378  -0.394
  113    H    CYS  16           H        CYS  16  -5.048   3.997  -2.172
  114    HA   CYS  16           HA       CYS  16  -4.594   3.696  -5.006
  115   1HB   CYS  16          HB1       CYS  16  -4.626   1.750  -2.705
  116   2HB   CYS  16          HB2       CYS  16  -4.227   1.260  -4.402
  117    H    GLY  17           H        GLY  17  -7.395   3.013  -2.908
  118   1HA   GLY  17          HA1       GLY  17  -9.175   3.138  -4.887
  119   2HA   GLY  17          HA2       GLY  17  -8.833   1.542  -4.858
  120    H    LEU  18           H        LEU  18  -9.121   0.322  -2.885
  121    HA   LEU  18           HA       LEU  18 -11.491   1.247  -1.355
  122   1HB   LEU  18          HB1       LEU  18 -11.251  -0.834  -2.995
  123   2HB   LEU  18          HB2       LEU  18 -10.512  -1.642  -1.659
  124    HG   LEU  18           HG       LEU  18 -13.068  -0.131  -1.334
  125   1HD1  LEU  18          1HD1      LEU  18 -12.921  -2.972  -2.440
  126   2HD1  LEU  18          2HD1      LEU  18 -14.424  -2.108  -2.050
  127   3HD1  LEU  18          3HD1      LEU  18 -13.401  -1.533  -3.369
  128   1HD2  LEU  18          1HD2      LEU  18 -12.589  -0.851   0.728
  129   2HD2  LEU  18          2HD2      LEU  18 -13.813  -1.979   0.181
  130   3HD2  LEU  18          3HD2      LEU  18 -12.120  -2.507   0.192
  131    H    GLY  19           H        GLY  19 -10.751  -1.076   0.210
  132   1HA   GLY  19          HA1       GLY  19  -9.224   0.079   2.377
  133   2HA   GLY  19          HA2       GLY  19 -10.082  -1.308   2.459
  134    H    ILE  20           H        ILE  20  -7.788  -0.107   0.290
  135    HA   ILE  20           HA       ILE  20  -6.358  -2.489  -0.245
  136    HB   ILE  20           HB       ILE  20  -5.325   0.357  -0.518
  137   1HG1  ILE  20          1HG1      ILE  20  -7.267   0.360  -1.764
  138   2HG1  ILE  20          2HG1      ILE  20  -5.968   0.057  -2.936
  139   1HG2  ILE  20          1HG2      ILE  20  -3.815  -0.504  -2.097
  140   2HG2  ILE  20          2HG2      ILE  20  -3.540  -1.397  -0.623
  141   3HG2  ILE  20          3HG2      ILE  20  -4.437  -2.158  -1.952
  142   1HD1  ILE  20          1HD1      ILE  20  -6.522  -2.389  -2.826
  143   2HD1  ILE  20          2HD1      ILE  20  -7.938  -1.964  -1.833
  144   3HD1  ILE  20          3HD1      ILE  20  -7.802  -1.359  -3.495
  145    H    SER  21           H        SER  21  -6.160  -3.444   1.728
  146    HA   SER  21           HA       SER  21  -4.855  -3.127   3.969
  147   1HB   SER  21          HB1       SER  21  -5.686  -5.259   3.233
  148   2HB   SER  21          HB2       SER  21  -4.367  -5.373   2.033
  149    HG   SER  21           HG       SER  21  -4.130  -5.412   4.866
  150    H    CYS  22           H        CYS  22  -2.967  -2.808   4.849
  151    HA   CYS  22           HA       CYS  22  -0.529  -2.308   3.211
  152   1HB   CYS  22          HB1       CYS  22  -0.979  -0.365   4.279
  153   2HB   CYS  22          HB2       CYS  22  -1.425  -1.082   5.818
  154    H    LYS  23           H        LYS  23   1.041  -3.773   3.329
  155    HA   LYS  23           HA       LYS  23   1.170  -5.772   5.511
  156   1HB   LYS  23          HB1       LYS  23   2.289  -5.827   2.769
  157   2HB   LYS  23          HB2       LYS  23   2.687  -6.969   4.071
  158   1HG   LYS  23          HG1       LYS  23  -0.149  -6.589   4.149
  159   2HG   LYS  23          HG2       LYS  23   0.347  -6.760   2.456
  160   1HD   LYS  23          HD1       LYS  23  -0.154  -8.992   3.255
  161   2HD   LYS  23          HD2       LYS  23   1.612  -8.854   3.211
  162   1HE   LYS  23          HE1       LYS  23   1.615  -8.339   5.648
  163   2HE   LYS  23          HE2       LYS  23  -0.163  -8.388   5.670
  164   1HZ   LYS  23          HZ1       LYS  23  -0.033 -10.713   5.082
  165   2HZ   LYS  23          HZ2       LYS  23   1.612 -10.664   5.072
  166   3HZ   LYS  23          HZ3       LYS  23   0.790 -10.422   6.474
  167    H    ASN  24           H        ASN  24   3.866  -6.163   5.545
  168    HA   ASN  24           HA       ASN  24   4.955  -4.304   7.185
  169   1HB   ASN  24          HB1       ASN  24   5.628  -6.666   6.881
  170   2HB   ASN  24          HB2       ASN  24   6.518  -6.229   5.424
  171   1HD2  ASN  24          1HD2      ASN  24   8.192  -4.371   5.775
  172   2HD2  ASN  24          2HD2      ASN  24   9.124  -4.474   7.272
  173    H    GLY  25           H        GLY  25   4.370  -2.393   6.005
  174   1HA   GLY  25          HA1       GLY  25   5.238  -0.363   5.525
  175   2HA   GLY  25          HA2       GLY  25   6.643  -1.019   5.011
  176    H    TYR  26           H        TYR  26   4.205  -2.720   3.451
  177    HA   TYR  26           HA       TYR  26   4.439  -1.069   1.007
  178   1HB   TYR  26          HB1       TYR  26   5.351  -3.852   1.642
  179   2HB   TYR  26          HB2       TYR  26   4.639  -3.518   0.059
  180    HD1  TYR  26           HD1      TYR  26   7.479  -2.782   2.336
  181    HD2  TYR  26           HD2      TYR  26   5.847  -2.196  -1.611
  182    HE1  TYR  26           HE1      TYR  26   9.698  -2.063   1.528
  183    HE2  TYR  26           HE2      TYR  26   8.094  -1.540  -2.434
  184    HH   TYR  26           HH       TYR  26  10.956  -1.420  -0.301
  185    H    CYS  27           H        CYS  27   2.302  -1.138  -0.229
  186    HA   CYS  27           HA       CYS  27   0.297  -2.688   1.314
  187   1HB   CYS  27          HB1       CYS  27  -1.226  -0.984   0.785
  188   2HB   CYS  27          HB2       CYS  27   0.144  -0.348   1.687
  189    H    GLN  28           H        GLN  28  -1.327  -3.735   0.330
  190    HA   GLN  28           HA       GLN  28  -0.147  -4.956  -2.099
  191   1HB   GLN  28          HB1       GLN  28  -1.352  -6.996  -1.343
  192   2HB   GLN  28          HB2       GLN  28  -0.005  -6.424  -0.328
  193   1HG   GLN  28          HG1       GLN  28  -1.555  -5.500   1.290
  194   2HG   GLN  28          HG2       GLN  28  -2.937  -5.913   0.263
  195   1HE2  GLN  28          1HE2      GLN  28  -2.999  -6.839   2.890
  196   2HE2  GLN  28          2HE2      GLN  28  -2.743  -8.570   2.839
  197    H    GLY  29           H        GLY  29  -1.141  -4.929  -3.983
  198   1HA   GLY  29          HA1       GLY  29  -2.825  -5.173  -5.448
  199   2HA   GLY  29          HA2       GLY  29  -3.850  -5.501  -4.219
  200    H    CYS  30           H        CYS  30  -2.187  -2.520  -4.357
  201    HA   CYS  30           HA       CYS  30  -4.283  -0.810  -4.220
  202   1HB   CYS  30          HB1       CYS  30  -1.607  -0.605  -5.570
  203   2HB   CYS  30          HB2       CYS  30  -2.661   0.777  -5.714
  204    H    THR  31           H        THR  31  -3.010  -2.244  -7.238
  205    HA   THR  31           HA       THR  31  -4.954  -1.190  -9.055
  206    HB   THR  31           HB       THR  31  -4.346  -3.548 -10.098
  207    HG1  THR  31           HG1      THR  31  -2.474  -4.414  -9.133
  208   1HG2  THR  31          1HG2      THR  31  -3.359  -1.409 -10.864
  209   2HG2  THR  31          2HG2      THR  31  -2.171  -1.472  -9.546
  210   3HG2  THR  31          3HG2      THR  31  -2.141  -2.696 -10.832
  Start of MODEL   20
    1   1H    THR   1           H        THR   1  12.430  -6.288  -2.784
    2    HA   THR   1           HA       THR   1  11.634  -6.688  -5.194
    3    HB   THR   1           HB       THR   1  10.507  -8.486  -3.030
    4    HG1  THR   1           HG1      THR   1  12.688  -9.197  -2.787
    5   1HG2  THR   1          1HG2      THR   1  10.305  -9.186  -5.417
    6   2HG2  THR   1          2HG2      THR   1  12.066  -9.032  -5.597
    7   3HG2  THR   1          3HG2      THR   1  11.387 -10.252  -4.499
    8    HA   PRO   2           HA       PRO   2   6.974  -6.533  -4.245
    9   1HB   PRO   2          HB1       PRO   2   6.689  -4.599  -2.012
   10   2HB   PRO   2          HB2       PRO   2   5.716  -6.014  -2.389
   11   1HG   PRO   2          HG1       PRO   2   7.634  -6.122  -0.455
   12   2HG   PRO   2          HG2       PRO   2   7.428  -7.537  -1.588
   13   1HD   PRO   2          HD1       PRO   2   9.245  -5.123  -1.883
   14   2HD   PRO   2          HD2       PRO   2   9.836  -6.704  -1.754
   15    H    TYR   3           H        TYR   3   5.248  -4.453  -4.642
   16    HA   TYR   3           HA       TYR   3   6.329  -2.560  -6.354
   17   1HB   TYR   3          HB1       TYR   3   3.870  -2.773  -4.564
   18   2HB   TYR   3          HB2       TYR   3   4.148  -1.513  -5.778
   19    HD1  TYR   3           HD1      TYR   3   2.908  -4.861  -5.217
   20    HD2  TYR   3           HD2      TYR   3   4.399  -2.146  -8.218
   21    HE1  TYR   3           HE1      TYR   3   1.943  -6.292  -7.001
   22    HE2  TYR   3           HE2      TYR   3   3.426  -3.569  -9.990
   23    HH   TYR   3           HH       TYR   3   2.261  -5.498 -10.469
   24    HA   PRO   4           HA       PRO   4   7.907   0.048  -2.888
   25   1HB   PRO   4          HB1       PRO   4   9.090   2.019  -4.299
   26   2HB   PRO   4          HB2       PRO   4   9.773   0.356  -4.277
   27   1HG   PRO   4          HG1       PRO   4   7.973   1.580  -6.386
   28   2HG   PRO   4          HG2       PRO   4   9.535   0.737  -6.641
   29   1HD   PRO   4          HD1       PRO   4   7.099  -0.529  -6.863
   30   2HD   PRO   4          HD2       PRO   4   8.542  -1.374  -6.229
   31    H    VAL   5           H        VAL   5   5.192  -0.004  -3.060
   32    HA   VAL   5           HA       VAL   5   4.144   2.674  -3.590
   33    HB   VAL   5           HB       VAL   5   3.381  -0.225  -3.977
   34   1HG1  VAL   5          1HG1      VAL   5   1.798   0.202  -2.747
   35   2HG1  VAL   5          2HG1      VAL   5   1.610   1.946  -3.168
   36   3HG1  VAL   5          3HG1      VAL   5   1.001   0.634  -4.279
   37   1HG2  VAL   5          1HG2      VAL   5   4.224   1.113  -5.971
   38   2HG2  VAL   5          2HG2      VAL   5   2.544   0.582  -6.189
   39   3HG2  VAL   5          3HG2      VAL   5   2.891   2.260  -5.721
   40    H    ASN   6           H        ASN   6   3.978   3.477  -1.555
   41    HA   ASN   6           HA       ASN   6   4.638   1.762   0.590
   42   1HB   ASN   6          HB1       ASN   6   4.889   4.753   0.121
   43   2HB   ASN   6          HB2       ASN   6   5.821   3.626   1.130
   44   1HD2  ASN   6          1HD2      ASN   6   5.586   5.067  -2.032
   45   2HD2  ASN   6          2HD2      ASN   6   6.731   3.985  -2.817
   46    H    CYS   7           H        CYS   7   4.158   2.526   2.724
   47    HA   CYS   7           HA       CYS   7   1.655   4.077   3.161
   48   1HB   CYS   7          HB1       CYS   7   0.399   2.244   3.887
   49   2HB   CYS   7          HB2       CYS   7   1.329   1.521   2.549
   50    H    LYS   8           H        LYS   8   1.489   4.829   5.415
   51    HA   LYS   8           HA       LYS   8   3.407   3.782   7.353
   52   1HB   LYS   8          HB1       LYS   8   2.574   6.143   7.198
   53   2HB   LYS   8          HB2       LYS   8   0.993   5.579   7.689
   54   1HG   LYS   8          HG1       LYS   8   2.838   4.344   9.472
   55   2HG   LYS   8          HG2       LYS   8   3.506   5.958   9.202
   56   1HD   LYS   8          HD1       LYS   8   2.047   6.007  11.175
   57   2HD   LYS   8          HD2       LYS   8   1.230   6.888   9.872
   58   1HE   LYS   8          HE1       LYS   8  -0.119   4.874   9.359
   59   2HE   LYS   8          HE2       LYS   8   0.792   3.925  10.554
   60   1HZ   LYS   8          HZ1       LYS   8  -0.097   5.351  12.263
   61   2HZ   LYS   8          HZ2       LYS   8  -0.951   6.223  11.155
   62   3HZ   LYS   8          HZ3       LYS   8  -1.310   4.637  11.415
   63    H    THR   9           H        THR   9   0.108   3.148   6.124
   64    HA   THR   9           HA       THR   9  -0.041   0.572   7.188
   65    HB   THR   9           HB       THR   9  -0.496   1.817   9.346
   66    HG1  THR   9           HG1      THR   9  -2.782   0.394   8.555
   67   1HG2  THR   9          1HG2      THR   9  -3.151   2.584   8.095
   68   2HG2  THR   9          2HG2      THR   9  -2.549   2.990   9.706
   69   3HG2  THR   9          3HG2      THR   9  -1.809   3.728   8.264
   70    H    ASP  10           H        ASP  10  -2.559  -0.189   6.711
   71    HA   ASP  10           HA       ASP  10  -3.267   0.144   4.103
   72   1HB   ASP  10          HB1       ASP  10  -5.031  -0.093   6.640
   73   2HB   ASP  10          HB2       ASP  10  -5.609  -0.468   5.013
   74    H    ARG  11           H        ARG  11  -4.646   2.072   6.669
   75    HA   ARG  11           HA       ARG  11  -6.288   3.707   5.092
   76   1HB   ARG  11          HB1       ARG  11  -6.225   3.931   7.561
   77   2HB   ARG  11          HB2       ARG  11  -4.508   4.355   7.545
   78   1HG   ARG  11          HG1       ARG  11  -6.411   6.105   6.040
   79   2HG   ARG  11          HG2       ARG  11  -6.403   6.161   7.825
   80   1HD   ARG  11          HD1       ARG  11  -4.216   7.010   7.911
   81   2HD   ARG  11          HD2       ARG  11  -3.800   6.510   6.278
   82    HE   ARG  11           HE       ARG  11  -5.974   8.458   6.582
   83   1HH1  ARG  11          2HH2      ARG  11  -2.414   8.105   5.656
   84   2HH1  ARG  11          1HH2      ARG  11  -2.466   9.583   4.842
   85   1HH2  ARG  11          1HH1      ARG  11  -5.852  10.389   5.430
   86   2HH2  ARG  11          2HH1      ARG  11  -4.362  10.902   4.707
   87    H    ASP  12           H        ASP  12  -2.750   3.764   5.211
   88    HA   ASP  12           HA       ASP  12  -2.702   6.432   4.178
   89   1HB   ASP  12          HB1       ASP  12  -1.182   4.811   5.730
   90   2HB   ASP  12          HB2       ASP  12  -0.435   4.458   4.205
   91    H    CYS  13           H        CYS  13  -3.434   3.420   2.803
   92    HA   CYS  13           HA       CYS  13  -2.918   4.471   0.033
   93   1HB   CYS  13          HB1       CYS  13  -2.812   1.740   1.325
   94   2HB   CYS  13          HB2       CYS  13  -2.847   1.930  -0.441
   95    H    VAL  14           H        VAL  14  -5.342   3.934   2.177
   96    HA   VAL  14           HA       VAL  14  -7.344   2.695   0.722
   97    HB   VAL  14           HB       VAL  14  -7.420   3.773   2.886
   98   1HG1  VAL  14          1HG1      VAL  14  -6.130   5.677   1.960
   99   2HG1  VAL  14          2HG1      VAL  14  -7.693   6.400   1.514
  100   3HG1  VAL  14          3HG1      VAL  14  -7.337   6.016   3.233
  101   1HG2  VAL  14          1HG2      VAL  14  -9.723   4.715   2.805
  102   2HG2  VAL  14          2HG2      VAL  14  -9.612   4.856   1.038
  103   3HG2  VAL  14          3HG2      VAL  14  -9.610   3.253   1.804
  104    H    MET  15           H        MET  15  -5.833   5.678   0.124
  105    HA   MET  15           HA       MET  15  -7.517   6.910  -1.789
  106   1HB   MET  15          HB1       MET  15  -5.573   8.226  -2.448
  107   2HB   MET  15          HB2       MET  15  -5.698   8.084  -0.686
  108   1HG   MET  15          HG1       MET  15  -3.971   6.342  -0.692
  109   2HG   MET  15          HG2       MET  15  -3.886   6.412  -2.465
  110   1HE   MET  15          HE1       MET  15  -2.246   9.679   0.343
  111   2HE   MET  15          HE2       MET  15  -3.997   9.433   0.161
  112   3HE   MET  15          HE3       MET  15  -2.985   8.160   0.895
  113    H    CYS  16           H        CYS  16  -5.364   4.221  -2.142
  114    HA   CYS  16           HA       CYS  16  -5.072   4.246  -5.014
  115   1HB   CYS  16          HB1       CYS  16  -4.768   2.171  -2.876
  116   2HB   CYS  16          HB2       CYS  16  -4.723   1.703  -4.610
  117    H    GLY  17           H        GLY  17  -7.797   3.276  -2.930
  118   1HA   GLY  17          HA1       GLY  17  -9.618   3.378  -4.862
  119   2HA   GLY  17          HA2       GLY  17  -9.123   1.827  -4.993
  120    H    LEU  18           H        LEU  18  -9.400   0.323  -3.260
  121    HA   LEU  18           HA       LEU  18 -11.659   0.981  -1.463
  122   1HB   LEU  18          HB1       LEU  18 -11.400  -1.048  -3.158
  123   2HB   LEU  18          HB2       LEU  18 -10.419  -1.786  -1.942
  124    HG   LEU  18           HG       LEU  18 -13.067  -0.566  -1.282
  125   1HD1  LEU  18          1HD1      LEU  18 -13.479  -2.000  -3.282
  126   2HD1  LEU  18          2HD1      LEU  18 -12.736  -3.373  -2.433
  127   3HD1  LEU  18          3HD1      LEU  18 -14.270  -2.684  -1.858
  128   1HD2  LEU  18          1HD2      LEU  18 -13.430  -2.464   0.291
  129   2HD2  LEU  18          2HD2      LEU  18 -11.709  -2.834   0.091
  130   3HD2  LEU  18          3HD2      LEU  18 -12.256  -1.226   0.699
  131    H    GLY  19           H        GLY  19 -10.514  -1.272   0.000
  132   1HA   GLY  19          HA1       GLY  19  -9.203   0.010   2.103
  133   2HA   GLY  19          HA2       GLY  19  -9.181  -1.609   1.886
  134    H    ILE  20           H        ILE  20  -7.829  -2.049  -0.335
  135    HA   ILE  20           HA       ILE  20  -5.712  -2.583  -0.914
  136    HB   ILE  20           HB       ILE  20  -5.311   0.432  -0.909
  137   1HG1  ILE  20          1HG1      ILE  20  -7.320   0.097  -2.061
  138   2HG1  ILE  20          2HG1      ILE  20  -6.050   0.283  -3.287
  139   1HG2  ILE  20          1HG2      ILE  20  -3.221  -0.721  -1.281
  140   2HG2  ILE  20          2HG2      ILE  20  -3.994  -1.850  -2.407
  141   3HG2  ILE  20          3HG2      ILE  20  -3.827  -0.126  -2.824
  142   1HD1  ILE  20          1HD1      ILE  20  -7.393  -2.299  -2.463
  143   2HD1  ILE  20          2HD1      ILE  20  -7.524  -1.440  -4.006
  144   3HD1  ILE  20          3HD1      ILE  20  -5.982  -2.188  -3.542
  145    H    SER  21           H        SER  21  -5.560  -3.611   1.131
  146    HA   SER  21           HA       SER  21  -4.498  -2.455   3.393
  147   1HB   SER  21          HB1       SER  21  -5.709  -4.623   3.283
  148   2HB   SER  21          HB2       SER  21  -4.288  -5.383   2.534
  149    HG   SER  21           HG       SER  21  -4.429  -4.194   5.120
  150    H    CYS  22           H        CYS  22  -2.406  -2.743   4.530
  151    HA   CYS  22           HA       CYS  22  -0.161  -2.875   2.604
  152   1HB   CYS  22          HB1       CYS  22  -0.694  -0.556   3.081
  153   2HB   CYS  22          HB2       CYS  22  -0.412  -0.759   4.809
  154    H    LYS  23           H        LYS  23   1.787  -3.719   3.093
  155    HA   LYS  23           HA       LYS  23   1.861  -5.540   5.423
  156   1HB   LYS  23          HB1       LYS  23   3.054  -5.515   2.707
  157   2HB   LYS  23          HB2       LYS  23   3.770  -6.459   4.020
  158   1HG   LYS  23          HG1       LYS  23   0.896  -6.757   4.163
  159   2HG   LYS  23          HG2       LYS  23   1.434  -6.976   2.483
  160   1HD   LYS  23          HD1       LYS  23   1.492  -9.153   3.577
  161   2HD   LYS  23          HD2       LYS  23   3.158  -8.583   3.345
  162   1HE   LYS  23          HE1       LYS  23   3.053  -7.702   5.746
  163   2HE   LYS  23          HE2       LYS  23   1.479  -8.506   5.906
  164   1HZ   LYS  23          HZ1       LYS  23   2.620 -10.596   5.431
  165   2HZ   LYS  23          HZ2       LYS  23   4.067  -9.806   5.341
  166   3HZ   LYS  23          HZ3       LYS  23   3.246  -9.858   6.762
  167    H    ASN  24           H        ASN  24   4.489  -5.675   5.789
  168    HA   ASN  24           HA       ASN  24   5.341  -3.434   7.229
  169   1HB   ASN  24          HB1       ASN  24   7.515  -4.708   7.297
  170   2HB   ASN  24          HB2       ASN  24   6.053  -5.583   7.838
  171   1HD2  ASN  24          1HD2      ASN  24   8.263  -5.172   5.059
  172   2HD2  ASN  24          2HD2      ASN  24   8.068  -6.818   4.451
  173    H    GLY  25           H        GLY  25   4.868  -1.918   5.399
  174   1HA   GLY  25          HA1       GLY  25   6.443  -0.118   4.781
  175   2HA   GLY  25          HA2       GLY  25   7.116  -1.226   3.786
  176    H    TYR  26           H        TYR  26   4.424  -2.439   3.124
  177    HA   TYR  26           HA       TYR  26   4.302  -0.589   0.806
  178   1HB   TYR  26          HB1       TYR  26   5.201  -2.337  -0.554
  179   2HB   TYR  26          HB2       TYR  26   6.168  -2.224   0.946
  180    HD1  TYR  26           HD1      TYR  26   3.797  -4.351  -0.933
  181    HD2  TYR  26           HD2      TYR  26   6.399  -4.019   2.492
  182    HE1  TYR  26           HE1      TYR  26   3.657  -6.795  -0.588
  183    HE2  TYR  26           HE2      TYR  26   6.282  -6.474   2.810
  184    HH   TYR  26           HH       TYR  26   4.404  -8.593   0.638
  185    H    CYS  27           H        CYS  27   2.332  -0.635  -0.527
  186    HA   CYS  27           HA       CYS  27   0.300  -2.317   0.738
  187   1HB   CYS  27          HB1       CYS  27  -1.178  -0.640   0.471
  188   2HB   CYS  27          HB2       CYS  27   0.307   0.032   1.185
  189    H    GLN  28           H        GLN  28  -1.064  -3.538  -0.207
  190    HA   GLN  28           HA       GLN  28   0.041  -4.456  -2.832
  191   1HB   GLN  28          HB1       GLN  28  -0.231  -6.714  -1.842
  192   2HB   GLN  28          HB2       GLN  28   1.000  -5.674  -1.081
  193   1HG   GLN  28          HG1       GLN  28  -0.028  -5.737   0.913
  194   2HG   GLN  28          HG2       GLN  28  -1.637  -5.435   0.209
  195   1HE2  GLN  28          1HE2      GLN  28  -2.622  -7.230  -1.026
  196   2HE2  GLN  28          2HE2      GLN  28  -2.514  -8.838  -0.292
  197    H    GLY  29           H        GLY  29  -1.603  -3.636  -4.104
  198   1HA   GLY  29          HA1       GLY  29  -3.662  -5.124  -4.878
  199   2HA   GLY  29          HA2       GLY  29  -4.343  -4.288  -3.651
  200    H    CYS  30           H        CYS  30  -2.642  -1.937  -4.150
  201    HA   CYS  30           HA       CYS  30  -4.271  -0.239  -5.285
  202   1HB   CYS  30          HB1       CYS  30  -2.057   0.210  -4.243
  203   2HB   CYS  30          HB2       CYS  30  -1.274  -0.191  -5.781
  204    H    THR  31           H        THR  31  -1.870  -2.017  -7.284
  205    HA   THR  31           HA       THR  31  -3.725  -2.304  -9.399
  206    HB   THR  31           HB       THR  31  -3.085  -0.041  -9.970
  207    HG1  THR  31           HG1      THR  31  -2.466  -0.530 -12.067
  208   1HG2  THR  31          1HG2      THR  31  -0.868   0.055  -8.898
  209   2HG2  THR  31          2HG2      THR  31  -0.229  -1.094 -10.094
  210   3HG2  THR  31          3HG2      THR  31  -0.770   0.520 -10.607