*HEADER    ANTIBIOTIC                              05-FEB-10   2KTO              
*TITLE     SPATIAL STRUCTURE OF LCH-BETA PEPTIDE FROM TWO-COMPONENT LANTIBIOTIC  
*TITLE    2 LICHENICIDIN VK21                                                    
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: LCHB;                                                      
*COMPND   3 CHAIN: A                                                             
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: BACILLUS LICHENIFORMIS;                         
*SOURCE   3 ORGANISM_TAXID: 279010;                                              
*SOURCE   4 STRAIN: VK21                                                         
*KEYWDS    LICHENICIDIN VK21, LANTIBIOTICS, LCHB, ANTIBIOTIC, LANTHIONINE,       
*KEYWDS   2 THIOESTER                                                            
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    20                                                                    
*AUTHOR    K.S.MINEEV, Z.O.SHENKAREV, T.V.OVCHINNIKOVA, A.S.ARSENIEV             
*REVDAT   1   21-JUL-10 2KTO    0                                                


117 VAL  QG1   114 GLY  HA3     3.50
117 VAL  HB    114 GLY  HA3     3.50
111 ILE  QG2   111 ILE  QD1     2.85            #peak     5
111 ILE  HG13  111 ILE  QD1     2.84            #peak     7
111 ILE  HG12  111 ILE  QD1     2.92            #peak    11
111 ILE  HG12  111 ILE  HG13    2.40            #peak    14
119 ALA  QB    125 DHB  QG      3.26            #peak    15
111 ILE  HB    111 ILE  HG12    3.04            #peak    17
111 ILE  HB    111 ILE  HG13    3.41            #peak    19
111 ILE  HB    111 ILE  QD1     3.21            #peak    21
111 ILE  QG2   111 ILE  HB      2.68            #peak    23
115 VAL  QG2   116 DHB  QG      3.19            #peak    26
117 VAL  HB    117 VAL  QG2     2.83            #peak    28
117 VAL  QG1   117 VAL  HB      2.78            #peak    30
117 VAL  QG2   118 DAL  HB3     3.67            #peak    32
111 ILE  HA    111 ILE  QD1     3.77            #peak    34
108 TRP  HA    111 ILE  QD1     3.54            #peak    35
121 LEU  HA    121 LEU  QD1     3.79            #peak    38
121 LEU  HA    121 LEU  QD2     2.96            #peak    39
109 THR  HB    109 THR  QG2     2.90            #peak    41
111 ILE  HA    111 ILE  HG12    3.20            #peak    43
115 VAL  HA    115 VAL  QG2     3.32            #peak    55
115 VAL  HA    115 VAL  QG1     3.04            #peak    58
117 VAL  QG2   118 DAL  HA      4.42            #peak    59
117 VAL  QG2   118 DAL  HB2     3.97            #peak    61
111 ILE  HA    111 ILE  QG2     3.17            #peak    64
111 ILE  HA    111 ILE  HG13    3.07            #peak    65
117 VAL  HA    117 VAL  QG2     3.06            #peak    68
117 VAL  HA    117 VAL  QG1     2.87            #peak    69
109 THR  HA    109 THR  QG2     3.16            #peak    71
124 ABA  QG    127 CYS  HB3     3.85            #peak    73
124 ABA  QG    127 CYS  HB2     3.77            #peak    76
128 ABA  HB    128 ABA  QG      2.90            #peak    78
124 ABA  HB    124 ABA  QG      2.74            #peak    80
128 ABA  HA    128 ABA  QG      2.91            #peak    82
124 ABA  HA    124 ABA  QG      2.85            #peak    84
119 ALA  HA    119 ALA  QB      2.72            #peak    85
103 ALA  HA    103 ALA  QB      3.51            #peak    87
113 ALA  HA    113 ALA  QB      2.69            #peak    89
110 CYS  HA    113 ALA  QB      3.11            #peak    92
120 SER  HB3   121 LEU  HG      3.65            #peak    94
120 SER  HB2   121 LEU  HG      3.65            #peak    96
122 CYS  HB3   125 DHB  QG      3.48            #peak    98
116 DHB  HB    116 DHB  QG      2.65            #peak    99
104 DHB  HB    104 DHB  QG      2.97            #peak   101
105 DHB  HB    105 DHB  QG      2.76            #peak   103
119 ALA  HA    125 DHB  QG      3.22            #peak   105
125 DHB  QG    122 CYSS HB2     2.94            #peak   108
102 PRO  HD3   102 PRO  HG3     3.62            #peak   110
117 VAL  HA    117 VAL  HB      3.28            #peak   112
115 VAL  HA    115 VAL  HB      3.47            #peak   113
123 PRO  HA    123 PRO  HB3     3.86            #peak   116
123 PRO  HD3   123 PRO  HB3     3.20            #peak   118
123 PRO  HD3   123 PRO  HG3     3.32            #peak   120
123 PRO  HD2   123 PRO  HB3     4.51            #peak   121
123 PRO  HD2   123 PRO  HG3     3.00            #peak   123
123 PRO  HA    123 PRO  HG3     4.03            #peak   126
123 PRO  HA    123 PRO  HG2     4.52            #peak   128
123 PRO  HA    123 PRO  HB2     2.90            #peak   130
123 PRO  HB2   123 PRO  HD3     4.32            #peak   131
123 PRO  HD2   123 PRO  HB2     3.84            #peak   133
123 PRO  HD2   123 PRO  HG2     3.20            #peak   135
123 PRO  HD3   123 PRO  HG2     2.97            #peak   138
123 PRO  HD2   122 CYS  HB3     4.33            #peak   139
118 DAL  HA    118 DAL  HB3     2.58            #peak   141
118 DAL  HB2   118 DAL  HB3     2.40            #peak   143
122 CYS  HB3   123 PRO  HD3     3.06            #peak   146
122 CYS  HB3   122 CYS  HB2     2.40            #peak   148
127 CYS  HB2   127 CYS  HB3     2.40            #peak   150
124 ABA  HB    127 CYS  HB3     3.77            #peak   151
110 CYS  HA    110 CYS  HB3     3.38            #peak   154
110 CYS  HA    110 CYS  HB2     3.20            #peak   156
131 CYS  HB3   131 CYS  HB2     2.41            #peak   158
128 ABA  HB    131 CYS  HB3     2.73            #peak   160
131 CYS  HA    131 CYS  HB3     3.62            #peak   161
121 LEU  HA    121 LEU  HB2     2.80            #peak   163
130 ARG  HA    130 ARG  HB3     3.33            #peak   165
121 LEU  HA    121 LEU  HB3     3.06            #peak   167
108 TRP  HA    111 ILE  HB      2.82            #peak   169
130 ARG  HA    130 ARG  HB2     3.31            #peak   171
102 PRO  HA    102 PRO  QB      3.42            #peak   173
102 PRO  HA    102 PRO  HG2     3.20            #peak   175
126 LYS  HA    126 LYS  HB2     3.29            #peak   178
127 CYS  HA    127 CYS  HB2     3.11            #peak   179
131 CYS  H     131 CYS  HB2     4.12            #peak   181
122 CYS  H     118 DAL  HB2     2.80            #peak   183
123 PRO  HB2   124 ABA  H       3.85            #peak   184
129 SER  H     130 ARG  H       3.04            #peak   187
128 ABA  H     129 SER  H       2.81            #peak   191
109 THR  HA    112 DHB  H       4.02            #peak   193
109 THR  H     109 THR  HA      3.10            #peak   194
130 ARG  H     131 CYS  H       2.95            #peak   198
112 DHB  H     112 DHB  HB      4.28            #peak   204
126 LYS  H     126 LYS  HB3     3.06            #peak   211
126 LYS  HB3   127 CYS  H       4.42            #peak   212
111 ILE  H     111 ILE  HG13    4.24            #peak   213
112 DHB  HB    115 VAL  HB      3.72            #peak   214
115 VAL  HB    116 DHB  H       2.99            #peak   215
115 VAL  H     115 VAL  HB      2.88            #peak   216
119 ALA  HA    121 LEU  H       4.35            #peak   217
118 DAL  H     118 DAL  HA      2.63            #peak   218
127 CYS  HA    129 SER  H       3.94            #peak   220
127 CYS  H     129 SER  H       3.30
129 SER  H     131 CYS  H       4.00
127 CYS  HA    127 CYS  HB3     2.87            #peak   221
126 LYS  H     127 CYS  HA      4.66            #peak   222
127 CYS  H     127 CYS  HA      3.12            #peak   223
127 CYS  HA    128 ABA  H       2.57            #peak   224
106 DAL  H     106 DAL  HA      3.26            #peak   225
106 DAL  HA    107 DHA  H       4.27            #peak   226
106 DAL  HA    106 DAL  HB3     3.26            #peak   227
121 LEU  H     121 LEU  HA      3.08            #peak   228
121 LEU  HA    122 CYS  H       3.55            #peak   229
106 DAL  H     106 DAL  HB2     2.80            #peak   230
120 SER  H     121 LEU  H       2.73            #peak   234
127 CYS  H     127 CYS  HB3     3.63            #peak   242
127 CYS  HB3   128 ABA  H       4.74            #peak   243
115 VAL  H     115 VAL  QG1     2.82            #peak   244
111 ILE  QG2   112 DHB  H       3.79            #peak   251
111 ILE  H     111 ILE  QG2     5.11            #peak   252
108 TRP  HE3   111 ILE  QG2     4.12            #peak   253
108 TRP  HZ3   111 ILE  QG2     4.03            #peak   254
111 ILE  QG2   115 VAL  H       4.53            #peak   255
121 LEU  H     121 LEU  HG      3.40            #peak   256
113 ALA  HA    116 DHB  H       3.92            #peak   257
113 ALA  H     113 ALA  HA      3.01            #peak   258
119 ALA  HA    120 SER  H       3.85            #peak   259
119 ALA  H     119 ALA  HA      2.76            #peak   260
119 ALA  HA    122 CYS  H       3.81            #peak   261
118 DAL  HA    122 CYSS H       0.00
122 CYS  HB2   125 DHB  H       4.52            #peak   262
122 CYS  H     122 CYS  HB2     2.86            #peak   264
112 DHB  HB    116 DHB  QG      3.84            #peak   268
120 SER  H     120 SER  HA      3.17            #peak   269
120 SER  HA    120 SER  HB3     3.11            #peak   270
120 SER  HA    120 SER  HB2     3.26            #peak   271
110 CYS  H     110 CYS  HA      3.28            #peak   272
106 DAL  H     107 DHA  H       3.04            #peak   274
131 CYS  H     131 CYS  HA      3.71            #peak   282
117 VAL  H     119 ALA  H       4.58            #peak   283
117 VAL  H     118 DAL  H       3.07            #peak   285
116 DHB  H     117 VAL  H       3.17            #peak   286
111 ILE  H     112 DHB  H       3.42            #peak   290
113 ALA  H     113 ALA  QB      2.61            #peak   300
119 ALA  QB    120 SER  H       5.50            #peak   301
119 ALA  H     119 ALA  QB      2.81            #peak   302
116 DHB  HB    119 ALA  QB      3.81            #peak   303
101 DHB  H     101 DHB  QG      4.61            #peak   304
103 ALA  HA    104 DHB  H       4.00            #peak   305
103 ALA  H     103 ALA  HA      4.11            #peak   306
126 LYS  H     126 LYS  HG3     3.71            #peak   319
111 ILE  HA    112 DHB  H       4.11            #peak   320
111 ILE  H     111 ILE  HA      3.74            #peak   321
111 ILE  HA    114 GLY  H       3.87            #peak   322
111 ILE  HA    115 VAL  H       4.12            #peak   323
125 DHB  H     125 DHB  HB      4.28            #peak   331
125 DHB  H     126 LYS  H       3.26            #peak   336
124 ABA  H     126 LYS  H       3.99            #peak   338
118 DAL  HB2   121 LEU  H       3.71            #peak   341
118 DAL  HB2   119 ALA  H       4.37            #peak   342
118 DAL  H     118 DAL  HB2     3.96            #peak   343
108 TRP  H     108 TRP  HD1     4.31            #peak   345
122 CYS  H     122 CYS  HB3     3.80            #peak   350
130 ARG  HA    131 CYS  H       3.45            #peak   351
119 ALA  H     120 SER  H       3.30            #peak   352
126 LYS  H     126 LYS  HB2     3.76            #peak   361
102 PRO  HA    103 ALA  H       4.37            #peak   362
125 DHB  H     125 DHB  QG      2.85            #peak   363
122 CYS  H     125 DHB  QG      3.66            #peak   364
125 DHB  HB    125 DHB  QG      2.69            #peak   365
120 SER  H     120 SER  HB3     3.46            #peak   366
120 SER  HB3   121 LEU  H       3.92            #peak   368
124 ABA  HB    125 DHB  H       4.50            #peak   370
124 ABA  H     124 ABA  HB      3.97            #peak   371
124 ABA  HB    127 CYS  H       3.64  100          #peak   372
123 PRO  HA    125 DHB  H       3.85            #peak   374
123 PRO  HA    124 ABA  H       2.42            #peak   375
107 DHA  H     110 CYS  HB3     4.40            #peak   377
110 CYS  HB3   111 ILE  H       3.65            #peak   378
110 CYS  H     110 CYS  HB3     2.77            #peak   379
128 ABA  H     130 ARG  H       3.69            #peak   387
117 VAL  H     117 VAL  QG2     3.96            #peak   390
117 VAL  QG2   121 LEU  H       4.07   100         #peak   391
117 VAL  QG2   122 CYS  H       5.22            #peak   392
117 VAL  QG2   118 DAL  H       3.73            #peak   393
112 DHB  H     112 DHB  QG      3.00            #peak   394
112 DHB  HB    112 DHB  QG      3.13            #peak   395
108 TRP  HE3   112 DHB  QG      4.24            #peak   396
114 GLY  HA2   115 VAL  H       3.50            #peak   397
120 SER  H     120 SER  HB2     3.20            #peak   398
120 SER  HB2   121 LEU  H       3.62            #peak   400
108 TRP  QB    108 TRP  HD1     3.20            #peak   401
108 TRP  H     108 TRP  QB      2.68            #peak   402
108 TRP  QB    109 THR  H       3.17            #peak   403
124 ABA  H     125 DHB  H       2.87            #peak   405
130 ARG  H     130 ARG  HB3     3.33            #peak   411
122 CYS  HA    123 PRO  HD2     2.78            #peak   412
122 CYS  HA    118 DAL  HB2     0.00
122 CYS  HA    122 CYS  HB2     3.42            #peak   413
122 CYS  HA    122 CYS  HB3     3.06            #peak   414
122 CYS  H     122 CYS  HA      3.38            #peak   415
118 DAL  HB3   122 CYS  HA      5.34            #peak   416
122 CYS  HA    123 PRO  HD3     3.07            #peak   417
101 DHB  HB    101 DHB  QG      3.57            #peak   418
109 THR  HB    110 CYS  H       2.97            #peak   420
109 THR  H     109 THR  HB      3.07            #peak   421
120 SER  H     122 CYS  H       4.43            #peak   430
121 LEU  H     122 CYS  H       2.87            #peak   433
128 ABA  H     128 ABA  QG      5.50            #peak   439
108 TRP  HA    112 DHB  H       3.99            #peak   442
108 TRP  HA    111 ILE  H       4.23            #peak   443
108 TRP  H     108 TRP  HA      3.23            #peak   444
121 LEU  H     121 LEU  HB3     2.90            #peak   445
118 DAL  H     120 SER  H       4.55            #peak   447
118 DAL  H     119 ALA  H       2.87            #peak   450
107 DHA  H     107 DHA  HB3     4.43            #peak   456
107 DHA  HB3   108 TRP  H       3.03            #peak   457
105 DHB  H     105 DHB  QG      3.05            #peak   459
116 DHB  H     116 DHB  HB      4.08            #peak   463
129 SER  H     129 SER  HA      3.38            #peak   469
129 SER  HA    130 ARG  H       3.74            #peak   470
116 DHB  QG    119 ALA  H       5.24            #peak   472
116 DHB  H     116 DHB  QG      3.08            #peak   473
104 DHB  H     104 DHB  HB      4.84            #peak   478
117 VAL  H     117 VAL  HB      2.83            #peak   480
117 VAL  HB    118 DAL  H       3.07            #peak   481
111 ILE  H     111 ILE  QD1     4.83            #peak   482
108 TRP  HE3   111 ILE  QD1     4.09            #peak   483
115 VAL  HA    119 ALA  H       4.15            #peak   484
115 VAL  HA    116 DHB  H       3.56            #peak   485
115 VAL  H     115 VAL  HA      3.19            #peak   486
109 THR  QG2   110 CYS  H       5.50            #peak   487
109 THR  H     109 THR  QG2     5.50            #peak   488
105 DHB  H     106 DAL  H       3.29            #peak   489
104 DHB  H     105 DHB  H       4.38            #peak   491
125 DHB  H     127 CYS  H       4.32            #peak   496
126 LYS  H     127 CYS  H       2.75            #peak   497
127 CYS  H     128 ABA  H       3.55            #peak   501
128 ABA  HA    129 SER  H       3.55            #peak   503
128 ABA  H     128 ABA  HA      3.55            #peak   504
126 LYS  H     126 LYS  HA      3.46            #peak   506
126 LYS  HA    127 CYS  H       3.53            #peak   507
102 PRO  HD3   103 ALA  H       4.72            #peak   508
124 ABA  H     124 ABA  QG      5.50            #peak   509
124 ABA  QG    127 CYS  H       4.47            #peak   510
117 VAL  HA    120 SER  H       3.91            #peak   511
117 VAL  H     117 VAL  HA      3.00            #peak   512
117 VAL  HA    118 DAL  H       3.52            #peak   513
103 ALA  H     104 DHB  H       3.60            #peak   516
129 SER  H     129 SER  HB2     3.49            #peak   519
129 SER  HB2   130 ARG  H       4.44            #peak   520
114 GLY  HA3   115 VAL  H       3.76            #peak   528
117 VAL  H     117 VAL  QG1     2.95            #peak   529
117 VAL  QG1   118 DAL  H       4.37            #peak   530
116 DHB  H     117 VAL  QG1     4.67            #peak   531
107 DHA  H     107 DHA  HB2     3.21            #peak   533
107 DHA  HB2   108 TRP  H       3.82            #peak   535
130 ARG  H     130 ARG  HG2     4.15            #peak   537
112 DHB  H     113 ALA  H       3.37            #peak   547
106 DAL  H     106 DAL  HB3     2.74            #peak   551
106 DAL  HB3   107 DHA  H       4.00            #peak   552
103 ALA  QB    106 DAL  H       3.88            #peak   553
103 ALA  QB    107 DHA  H       3.91            #peak   554
103 ALA  QB    104 DHB  H       4.22            #peak   555
103 ALA  H     103 ALA  QB      3.50            #peak   556
115 VAL  QG2   119 ALA  H       4.24            #peak   557
115 VAL  QG2   116 DHB  H       3.38            #peak   558
108 TRP  HE1   108 TRP  HD1     3.02            #peak   559
108 TRP  HE1   108 TRP  HZ2     3.45            #peak   560
110 CYS  H     111 ILE  H       3.42            #peak   562
108 TRP  H     109 THR  H       3.18            #peak   571
104 DHB  HB    105 DHB  H       3.29            #peak   573
104 DHB  H     104 DHB  QG      3.49            #peak   574
131 CYS  H     131 CYS  HB3     5.50            #peak   575
130 ARG  H     130 ARG  HB2     4.11            #peak   576
101 DHB  HB    102 PRO  HD2     4.18            #peak   577
118 DAL  HB3   121 LEU  H       5.50            #peak   578
118 DAL  HB3   122 CYS  H       3.88            #peak   580
118 DAL  H     118 DAL  HB3     3.38            #peak   581
124 ABA  HA    125 DHB  H       3.45            #peak   584
124 ABA  H     124 ABA  HA      3.44            #peak   586
128 ABA  HB    131 CYS  H       4.48            #peak   588
128 ABA  H     128 ABA  HB      4.28            #peak   590
110 CYS  HB2   111 ILE  H       4.50            #peak   591
110 CYS  H     110 CYS  HB2     3.86            #peak   592
111 ILE  HB    112 DHB  H       2.92            #peak   593
111 ILE  H     111 ILE  HB      3.23            #peak   594
108 TRP  HE3   111 ILE  HB      4.01            #peak   595
129 SER  H     129 SER  HB3     3.21            #peak   596
129 SER  HB3   130 ARG  H       3.99            #peak   597
127 CYS  H     127 CYS  HB2     3.14            #peak   598
127 CYS  HB2   128 ABA  H       5.09            #peak   599
114 GLY  H     115 VAL  H       2.92            #peak   604
115 VAL  H     116 DHB  H       3.09            #peak   606
103 ALA  H  HA 6.9  0.1
106 DAL  H  HA 6.86 0.1
108 TRP  H  HA 4.47 0.1
110 CYSS  H  HA 5.24 0.5
111 ILE  H  HA 5.26 0.1
115 VAL  H  HA 3.17 1.0
117 VAL  H  HA 6.81 0.1
118 DAL  H  HA 7.03 0.1
119 ALA  H  HA 2.8  1.0
120 SER  H  HA 8.51 0.1
121 LEU  H  HA 9.47 0.1
122 CYSS  H  HA 2.5  2.5
124 ABA  H  HA 9.76 0.1
126 LYS  H  HA 9.73 0.3
127 CYSS  H  HA 6.73 0.1
128 ABA  H  HA 9.52 0.1
129 SER  H  HA 3.9  1.0
130 ARG  H  HA 9.43 0.1
131 CYSS  H  HA 7.12 0.5
118 DAL QB 121 LEU QB 3.5  100
 100 OXB   CHI1   -315.0   -45.0
 100 OXB   CHI1   -155.0   155.0
 101 DHB   PHI    -345.0   -15.0
 101 DHB   PHI    -125.0   125.0
 101 DHB   PSI      25.0   315.0
 101 DHB   PSI    -125.0   125.0
 102 PRO   PSI    -305.0    15.0
 102 PRO   PSI     -95.0   205.0
 102 PRO   PSI     -55.0   275.0
 103 ALA   PHI      35.0   285.0
 103 ALA   PHI    -165.0    85.0
 103 ALA   PHI     -85.0   205.0
 103 ALA   PSI    -105.0   215.0
 104 DHB   PHI    -345.0   -15.0
 104 DHB   PHI    -125.0   125.0
 104 DHB   PSI    -155.0   155.0
 105 DHB   PHI    -345.0   -15.0
 105 DHB   PHI    -125.0   125.0
 105 DHB   PSI    -165.0   165.0
 106 DAL   PHI    -285.0   -35.0
 106 DAL   PHI    -205.0    85.0
 106 DAL   PHI     -85.0   165.0
 106 DAL   PSI    -215.0    95.0
 106 DAL   CHI1   -210.0  -180.0
 107 DHA   PHI    -145.0   145.0
 107 DHA   PSI    -155.0   155.0
 108 TRP   PHI    -185.0   -55.0
 108 TRP   PHI     -65.0   185.0
 108 TRP   CHI1      5.0   345.0
 108 TRP   CHI1   -225.0   115.0
 108 TRP   PSI    -335.0    -5.0
 108 TRP   PSI    -105.0   225.0
 109 THR   PHI    -335.0   -25.0
 109 THR   PHI    -205.0    95.0
 109 THR   CHI1    -95.0   215.0
 109 THR   PSI    -105.0   215.0
 110 CYSS  PHI      25.0   305.0
 110 CYSS  PHI    -275.0    35.0
 110 CYSS  PHI    -175.0    95.0
 110 CYSS  PHI     -75.0   195.0
 110 CYSS  CHI1   -215.0   105.0
 110 CYSS  PSI    -105.0   225.0
 111 ILE   PHI      25.0   295.0
 111 ILE   PHI    -175.0    35.0
 111 ILE   PHI     -75.0   195.0
 111 ILE   CHI1   -215.0    95.0
 111 ILE   CHI1    -85.0   215.0
 111 ILE   PSI    -335.0     5.0
 111 ILE   PSI     -95.0   215.0
 112 DHB   PHI    -345.0   -15.0
 112 DHB   PHI    -125.0   125.0
 112 DHB   PSI    -165.0   165.0
 113 ALA   PHI    -335.0   -25.0
 113 ALA   PHI    -205.0    95.0
 113 ALA   PSI    -105.0   225.0
 114 GLY   PHI    -335.0   -25.0
 115 VAL   PHI    -205.0   -25.0
 115 VAL   PHI     -65.0   185.0
 115 VAL   CHI1   -335.0   -25.0
 115 VAL   CHI1   -215.0    95.0
 115 VAL   CHI1   -115.0   215.0
 115 VAL   PSI    -335.0    -5.0
 115 VAL   PSI     -95.0   205.0
 116 DHB   PHI    -345.0   -15.0
 116 DHB   PHI    -125.0   125.0
 116 DHB   PSI    -165.0   165.0
 117 VAL   PHI      35.0   285.0
 117 VAL   PHI    -165.0    85.0
 117 VAL   PHI     -85.0   205.0
 117 VAL   CHI1   -335.0   -25.0
 117 VAL   CHI1   -215.0    95.0
 117 VAL   PSI    -105.0   215.0
 118 DAL   PHI    -285.0   -35.0
 118 DAL   PHI    -205.0    85.0
 118 DAL   PHI     -85.0   165.0
 118 DAL   PSI    -225.0   105.0
 118 DAL   CHI1   -210.0  -150.0
 119 ALA   PHI    -205.0   -25.0
 119 ALA   PHI     -65.0   185.0
 119 ALA   PSI    -335.0    -5.0
 119 ALA   PSI    -105.0   225.0
 120 SER   PHI    -155.0   -85.0
 120 SER   PHI     -95.0   225.0
 120 SER   PSI    -105.0   225.0
 121 LEU   PHI    -145.0   -95.0
 121 LEU   PSI    -105.0   225.0
 121 LEU   CHI1    -80.0   -40.0
 121 LEU   CHI2   -210.0  -150.0
 122 CYSS  PHI    -205.0   -25.0
 122 CYSS  PHI     -75.0   195.0
 122 CYSS  CHI1    -90.0   -30.0
 124 ABA   PHI      95.0   145.0
 124 ABA   CHI1     30.0    90.0 
 124 ABA   PSI    -215.0    95.0
 125 DHB   PHI    -345.0   -15.0
 125 DHB   PHI    -125.0   125.0
 125 DHB   PSI    -165.0   165.0
 126 LYS   PHI    -145.0   -95.0
 126 LYS   PSI    -105.0   225.0
 127 CYSS  PHI     -85.0   -55.0
 127 CYSS  CHI1   -215.0   105.0
 127 CYSS  PSI    -105.0   225.0
 128 ABA   PHI      95.0   145.0
 128 ABA   CHI1    150.0   210.0
 128 ABA   PSI    -215.0   105.0
 129 SER   PHI    -195.0   -45.0
 129 SER   PHI     -65.0   195.0
 129 SER   PSI    -335.0    -5.0
 129 SER   PSI    -105.0   225.0
 130 ARG   PHI    -145.0   -95.0
 130 ARG   PSI    -105.0   225.0
 131 CYSS  PHI      35.0   285.0
 131 CYSS  PHI    -165.0    85.0
 131 CYSS  PHI     -85.0   215.0
 131 CYSS  CHI1   -215.0   105.0
106 DAL  SG    110 CYS  SG      0.01  9.00E+00
106 DAL  CB    110 CYS  CB      3.19  9.00E+00
118 DAL  SG    122 CYS  SG      0.01  9.00E+00
118 DAL  CB    122 CYS  CB      3.19  9.00E+00
124 ABA  SG    127 CYS  SG      0.01  9.00E+00
124 ABA  CB    127 CYS  CB      3.19  9.00E+00
128 ABA  SG    131 CYS  SG      0.01  9.00E+00
128 ABA  CB    131 CYS  CB      3.19  9.00E+00
106 DAL  CB    110 CYS  CB      3.18  9.00E+00
118 DAL  CB    122 CYS  CB      3.18  9.00E+00
124 ABA  CB    127 CYS  CB      3.18  9.00E+00
128 ABA  CB    131 CYS  CB      3.18  9.00E+00
atom swap "HD2 HD3 123"
atom stereo "HD2 HD3 123"
atom swap "HA2 114"
atom stereo "HA2 114"
atom stereo "HG2 HG3 123"
atom swap "HB2 HB3 106 110 118 121 123  127"
atom stereo "HB2 HB3 106 110 118 121 122 107 123 127 129"
atom swap "QG1 QG2 115 117"
atom stereo "QG1 QG2 115 117"
atom stereo "QD1 QD2 121"

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H41  2KT   1           2H4      2KT   1 -26.532  11.731  19.153
    2    H42  2KT   1           3H4      2KT   1 -27.878  11.640  18.498
    3    H43  2KT   1           1H4      2KT   1 -27.592  10.846  19.738
    4    H31  2KT   1           2H3      2KT   1 -27.478  10.094  17.436
    5    H32  2KT   1           3H3      2KT   1 -26.021  10.430  17.561
    6    H1   DBU   2           H        DBU   2 -26.177   7.394  16.944
    7    HB1  DBU   2           HB       DBU   2 -23.459   4.881  16.589
    8    HG1  DBU   2           3HG      DBU   2 -26.298   4.770  17.215
    9    HG2  DBU   2           1HG      DBU   2 -25.582   4.033  15.792
   10    HG3  DBU   2           2HG      DBU   2 -26.183   5.691  15.712
   11    HA   PRO   3           HA       PRO   3 -21.099   8.198  19.590
   12    HB2  PRO   3           2HB      PRO   3 -20.055   6.140  21.021
   13    HB3  PRO   3           3HB      PRO   3 -21.458   7.070  21.559
   14    HG2  PRO   3           2HG      PRO   3 -21.360   4.403  20.202
   15    HG3  PRO   3           3HG      PRO   3 -22.364   4.928  21.566
   16    HD2  PRO   3           2HD      PRO   3 -23.307   4.791  19.032
   17    HD3  PRO   3           3HD      PRO   3 -23.883   5.997  20.201
   18    H    ALA   4           H        ALA   4 -20.694   7.683  17.002
   19    HA   ALA   4           HA       ALA   4 -18.500   5.827  16.637
   20    HB1  ALA   4           1HB      ALA   4 -18.567   6.574  14.288
   21    HB2  ALA   4           2HB      ALA   4 -20.138   6.021  14.870
   22    HB3  ALA   4           3HB      ALA   4 -19.813   7.747  14.718
   23    H1   DBU   5           H        DBU   5 -17.384   7.183  18.363
   24    HB1  DBU   5           HB       DBU   5 -14.997   9.891  19.259
   25    HG1  DBU   5           3HG      DBU   5 -17.682   9.091  20.094
   26    HG2  DBU   5           1HG      DBU   5 -16.298   9.178  21.170
   27    HG3  DBU   5           2HG      DBU   5 -16.651   7.674  20.316
   28    H1   DBU   6           H        DBU   6 -13.844   7.793  17.222
   29    HB1  DBU   6           HB       DBU   6 -12.069  10.424  14.698
   30    HG1  DBU   6           3HG      DBU   6 -13.520  10.634  17.397
   31    HG2  DBU   6           1HG      DBU   6 -14.081  11.674  16.098
   32    HG3  DBU   6           2HG      DBU   6 -12.430  11.839  16.703
   33    H    DAL   7           H        DAL   7 -14.615   7.428  14.088
   34    HA   DAL   7           HA       DAL   7 -12.494   6.449  12.403
   35    HB2  DAL   7           2HB      DAL   7 -15.005   6.956  11.832
   36    HB3  DAL   7           3HB      DAL   7 -15.260   5.305  12.394
   37    H    DHA   8           H        DHA   8 -14.994   4.732  14.182
   38    HB1  DHA   8           2HB      DHA   8 -13.585   3.961  16.744
   39    HB2  DHA   8           3HB      DHA   8 -13.574   2.096  16.710
   40    H    TRP   9           H        TRP   9 -15.483   1.202  15.578
   41    HA   TRP   9           HA       TRP   9 -14.508  -0.874  14.017
   42    HB2  TRP   9           2HB      TRP   9 -17.239  -0.307  15.149
   43    HB3  TRP   9           3HB      TRP   9 -16.926  -1.759  14.202
   44    HD1  TRP   9           HD1      TRP   9 -16.979  -0.650  17.663
   45    HE1  TRP   9           HE1      TRP   9 -15.664  -2.254  19.187
   46    HE3  TRP   9           HE3      TRP   9 -14.437  -3.270  14.083
   47    HZ2  TRP   9           HZ2      TRP   9 -13.796  -4.352  18.908
   48    HZ3  TRP   9           HZ3      TRP   9 -12.906  -5.059  14.796
   49    HH2  TRP   9           HH2      TRP   9 -12.593  -5.587  17.159
   50    H    THR  10           H        THR  10 -17.101   1.438  13.266
   51    HA   THR  10           HA       THR  10 -17.964   0.485  10.847
   52    HB   THR  10           HB       THR  10 -17.533   3.394  11.552
   53    HG1  THR  10           HG1      THR  10 -19.794   3.208  12.148
   54   HG21  THR  10          3HG2      THR  10 -19.433   3.737   9.945
   55   HG22  THR  10          1HG2      THR  10 -19.225   2.060   9.441
   56   HG23  THR  10          2HG2      THR  10 -17.920   3.222   9.199
   57    H    CYS  11           H        CYS  11 -15.382   2.918  11.258
   58    HA   CYS  11           HA       CYS  11 -14.582   3.057   8.605
   59    HB2  CYS  11           2HB      CYS  11 -12.931   3.392  11.117
   60    HB3  CYS  11           3HB      CYS  11 -12.394   3.857   9.505
   61    H    ILE  12           H        ILE  12 -13.663   0.771  11.117
   62    HA   ILE  12           HA       ILE  12 -11.535  -0.471   9.765
   63    HB   ILE  12           HB       ILE  12 -13.356  -1.317  11.981
   64   HG12  ILE  12          2HG1      ILE  12 -10.456  -1.597  12.262
   65   HG13  ILE  12          3HG1      ILE  12 -10.954   0.041  11.850
   66   HG21  ILE  12          1HG2      ILE  12 -11.844  -3.408  12.092
   67   HG22  ILE  12          2HG2      ILE  12 -13.195  -3.394  10.959
   68   HG23  ILE  12          3HG2      ILE  12 -11.556  -3.094  10.381
   69   HD11  ILE  12          3HD1      ILE  12 -10.823  -0.943  14.361
   70   HD12  ILE  12          1HD1      ILE  12 -11.847   0.404  13.868
   71   HD13  ILE  12          2HD1      ILE  12 -12.521  -1.222  13.979
   72    H1   DBU  13           H        DBU  13 -14.703  -1.908  10.325
   73    HB1  DBU  13           HB       DBU  13 -15.963  -4.843   8.321
   74    HG1  DBU  13           3HG      DBU  13 -14.255  -5.047  10.525
   75    HG2  DBU  13           1HG      DBU  13 -15.983  -5.266  10.743
   76    HG3  DBU  13           2HG      DBU  13 -15.253  -3.688  11.052
   77    H    ALA  14           H        ALA  14 -15.651  -0.700   7.726
   78    HA   ALA  14           HA       ALA  14 -16.598  -1.386   5.157
   79    HB1  ALA  14           1HB      ALA  14 -17.410   0.614   6.111
   80    HB2  ALA  14           2HB      ALA  14 -15.782   1.237   6.380
   81    HB3  ALA  14           3HB      ALA  14 -16.415   1.104   4.740
   82    H    GLY  15           H        GLY  15 -13.496  -0.068   6.275
   83    HA2  GLY  15           2HA      GLY  15 -12.375   0.170   3.666
   84    HA3  GLY  15           3HA      GLY  15 -11.490   0.219   5.183
   85    H    VAL  16           H        VAL  16 -11.976  -2.251   6.242
   86    HA   VAL  16           HA       VAL  16 -10.083  -3.872   5.080
   87    HB   VAL  16           HB       VAL  16 -12.460  -4.659   6.765
   88   HG11  VAL  16          1HG1      VAL  16 -10.301  -6.293   5.552
   89   HG12  VAL  16          2HG1      VAL  16 -10.769  -6.659   7.214
   90   HG13  VAL  16          3HG1      VAL  16 -11.972  -6.718   5.924
   91   HG21  VAL  16          3HG2      VAL  16 -10.459  -3.124   7.545
   92   HG22  VAL  16          1HG2      VAL  16 -11.131  -4.365   8.603
   93   HG23  VAL  16          2HG2      VAL  16  -9.640  -4.677   7.715
   94    H1   DBU  17           H        DBU  17 -13.565  -3.976   4.632
   95    HB1  DBU  17           HB       DBU  17 -15.320  -6.445   2.372
   96    HG1  DBU  17           3HG      DBU  17 -16.317  -6.069   4.666
   97    HG2  DBU  17           1HG      DBU  17 -14.802  -5.383   5.227
   98    HG3  DBU  17           2HG      DBU  17 -14.925  -7.121   4.944
   99    H    VAL  18           H        VAL  18 -12.915  -3.009   1.891
  100    HA   VAL  18           HA       VAL  18 -13.188  -3.737  -0.852
  101    HB   VAL  18           HB       VAL  18 -11.882  -1.395   0.517
  102   HG11  VAL  18          1HG1      VAL  18 -11.308  -2.373  -2.089
  103   HG12  VAL  18          2HG1      VAL  18 -12.231  -0.877  -2.249
  104   HG13  VAL  18          3HG1      VAL  18 -10.734  -0.896  -1.315
  105   HG21  VAL  18          3HG2      VAL  18 -13.804  -0.379  -1.062
  106   HG22  VAL  18          1HG2      VAL  18 -14.491  -1.970  -0.737
  107   HG23  VAL  18          2HG2      VAL  18 -14.086  -0.894   0.600
  108    H    DAL  19           H        DAL  19 -10.422  -3.395   1.341
  109    HA   DAL  19           HA       DAL  19  -8.304  -4.195   1.243
  110    HB2  DAL  19           2HB      DAL  19  -8.190  -2.579  -0.631
  111    HB3  DAL  19           3HB      DAL  19  -8.650  -3.867  -1.743
  112    H    ALA  20           H        ALA  20 -10.007  -6.180   1.659
  113    HA   ALA  20           HA       ALA  20  -8.664  -8.464   0.698
  114    HB1  ALA  20           1HB      ALA  20 -11.347  -8.246   2.058
  115    HB2  ALA  20           2HB      ALA  20 -10.436  -9.739   1.828
  116    HB3  ALA  20           3HB      ALA  20  -9.784  -8.457   2.849
  117    H    SER  21           H        SER  21 -10.709  -6.490  -0.941
  118    HA   SER  21           HA       SER  21 -12.171  -8.531  -2.390
  119    HB2  SER  21           2HB      SER  21 -12.556  -5.794  -1.897
  120    HB3  SER  21           3HB      SER  21 -12.245  -5.917  -3.629
  121    HG   SER  21           HG       SER  21 -14.452  -6.600  -2.249
  122    H    LEU  22           H        LEU  22  -9.613  -6.163  -3.076
  123    HA   LEU  22           HA       LEU  22  -8.895  -7.762  -5.445
  124    HB2  LEU  22           2HB      LEU  22  -8.246  -4.853  -5.213
  125    HB3  LEU  22           3HB      LEU  22  -8.371  -5.855  -6.658
  126    HG   LEU  22           HG       LEU  22 -10.666  -4.844  -4.980
  127   HD11  LEU  22          1HD1      LEU  22 -11.190  -3.699  -7.207
  128   HD12  LEU  22          2HD1      LEU  22  -9.508  -4.027  -7.622
  129   HD13  LEU  22          3HD1      LEU  22  -9.891  -3.026  -6.222
  130   HD21  LEU  22          3HD2      LEU  22 -12.027  -6.272  -6.014
  131   HD22  LEU  22          1HD2      LEU  22 -10.578  -7.148  -6.508
  132   HD23  LEU  22          2HD2      LEU  22 -11.295  -5.950  -7.587
  133    H    CYS  23           H        CYS  23  -7.623  -5.518  -2.994
  134    HA   CYS  23           HA       CYS  23  -5.015  -5.468  -3.216
  135    HB2  CYS  23           2HB      CYS  23  -6.352  -6.453  -0.687
  136    HB3  CYS  23           3HB      CYS  23  -4.744  -5.744  -0.785
  137    HA   PRO  24           HA       PRO  24  -3.472  -9.474  -4.329
  138    HB2  PRO  24           2HB      PRO  24  -1.030  -8.327  -3.054
  139    HB3  PRO  24           3HB      PRO  24  -1.217  -9.106  -4.630
  140    HG2  PRO  24           2HG      PRO  24  -0.998  -6.444  -4.404
  141    HG3  PRO  24           3HG      PRO  24  -2.039  -7.192  -5.628
  142    HD2  PRO  24           2HD      PRO  24  -2.761  -5.785  -3.133
  143    HD3  PRO  24           3HD      PRO  24  -3.662  -5.941  -4.655
  144    HN2  DB2  25           H        DB2  25  -3.460 -11.347  -3.260
  145    HA   DB2  25           HA       DB2  25  -2.592 -11.444  -0.470
  146   HB2C  DB2  25          HB        DB2  25  -2.879 -13.389  -2.668
  147   HG1C  DB2  25          3HG       DB2  25  -0.684 -12.931  -2.295
  148   HG2C  DB2  25          1HG       DB2  25  -0.857 -14.267  -1.154
  149   HG3C  DB2  25          2HG       DB2  25  -0.928 -12.602  -0.579
  150    H1   DBU  26           H        DBU  26  -5.333 -10.772  -2.003
  151    HB1  DBU  26           HB       DBU  26  -8.361 -10.374   0.365
  152    HG1  DBU  26           3HG      DBU  26  -6.645  -8.760   1.208
  153    HG2  DBU  26           1HG      DBU  26  -6.741  -8.360  -0.499
  154    HG3  DBU  26           2HG      DBU  26  -5.449  -9.414   0.083
  155    H    LYS  27           H        LYS  27  -6.763 -12.930  -2.702
  156    HA   LYS  27           HA       LYS  27  -9.101 -14.492  -1.837
  157    HB2  LYS  27           2HB      LYS  27  -9.531 -15.006  -4.099
  158    HB3  LYS  27           3HB      LYS  27  -9.108 -13.298  -4.089
  159    HG2  LYS  27           2HG      LYS  27  -6.762 -14.003  -4.698
  160    HG3  LYS  27           3HG      LYS  27  -7.418 -15.618  -4.976
  161    HD2  LYS  27           2HD      LYS  27  -8.730 -13.277  -6.278
  162    HD3  LYS  27           3HD      LYS  27  -7.213 -13.887  -6.943
  163    HE2  LYS  27           2HE      LYS  27  -8.721 -15.138  -8.130
  164    HE3  LYS  27           3HE      LYS  27  -8.436 -16.203  -6.755
  165    HZ1  LYS  27           3HZ      LYS  27 -10.506 -15.887  -5.966
  166    HZ2  LYS  27           1HZ      LYS  27 -10.857 -15.499  -7.575
  167    HZ3  LYS  27           2HZ      LYS  27 -10.582 -14.268  -6.449
  168    H    CYS  28           H        CYS  28  -5.882 -14.634  -1.599
  169    HA   CYS  28           HA       CYS  28  -5.477 -17.382  -2.422
  170    HB2  CYS  28           2HB      CYS  28  -3.194 -16.991  -1.338
  171    HB3  CYS  28           3HB      CYS  28  -3.581 -16.015  -2.751
  172    HN2  DB2  29           H        DB2  29  -7.420 -17.767  -0.842
  173    HA   DB2  29           HA       DB2  29  -6.248 -18.880   1.595
  174   HB2C  DB2  29          HB        DB2  29  -7.805 -20.098  -0.114
  175   HG1C  DB2  29          3HG       DB2  29  -6.800 -20.985   1.966
  176   HG2C  DB2  29          1HG       DB2  29  -8.403 -21.649   1.641
  177   HG3C  DB2  29          2HG       DB2  29  -8.198 -20.398   2.866
  178    H    SER  30           H        SER  30  -7.034 -15.971   1.074
  179    HA   SER  30           HA       SER  30  -7.862 -15.389   3.700
  180    HB2  SER  30           2HB      SER  30  -6.865 -13.508   2.944
  181    HB3  SER  30           3HB      SER  30  -7.247 -13.875   1.262
  182    HG   SER  30           HG       SER  30  -9.222 -12.940   1.502
  183    H    ARG  31           H        ARG  31  -9.627 -15.711   0.680
  184    HA   ARG  31           HA       ARG  31 -12.134 -15.565   2.208
  185    HB2  ARG  31           2HB      ARG  31 -11.274 -13.762   0.162
  186    HB3  ARG  31           3HB      ARG  31 -12.648 -14.680  -0.440
  187    HG2  ARG  31           2HG      ARG  31 -12.682 -13.300   2.225
  188    HG3  ARG  31           3HG      ARG  31 -13.153 -12.493   0.728
  189    HD2  ARG  31           2HD      ARG  31 -14.456 -14.805   2.121
  190    HD3  ARG  31           3HD      ARG  31 -15.169 -13.277   1.603
  191    HE   ARG  31           HE       ARG  31 -14.831 -15.655   0.028
  192   HH11  ARG  31          1HH1      ARG  31 -15.173 -12.192  -0.061
  193   HH12  ARG  31          2HH1      ARG  31 -15.797 -12.164  -1.677
  194   HH21  ARG  31          1HH2      ARG  31 -15.652 -15.632  -2.100
  195   HH22  ARG  31          2HH2      ARG  31 -16.070 -14.121  -2.836
  196    H    CYS  32           H        CYS  32 -10.530 -16.635  -0.763
  197    HA   CYS  32           HA       CYS  32 -11.178 -18.236  -2.305
  198    HB2  CYS  32           2HB      CYS  32 -11.641 -20.310  -0.364
  199    HB3  CYS  32           3HB      CYS  32 -10.260 -20.078  -1.431
  Start of MODEL    2
    1    H41  2KT   1           2H4      2KT   1 -21.259   1.917  14.012
    2    H42  2KT   1           3H4      2KT   1 -22.669   1.683  13.556
    3    H43  2KT   1           1H4      2KT   1 -21.552   1.711  12.555
    4    H31  2KT   1           2H3      2KT   1 -21.242   3.813  13.684
    5    H32  2KT   1           3H3      2KT   1 -21.701   3.739  12.258
    6    H1   DBU   2           H        DBU   2 -24.494   3.568  15.549
    7    HB1  DBU   2           HB       DBU   2 -25.539   6.192  18.016
    8    HG1  DBU   2           3HG      DBU   2 -26.530   3.714  16.944
    9    HG2  DBU   2           1HG      DBU   2 -26.608   4.808  15.573
   10    HG3  DBU   2           2HG      DBU   2 -27.512   5.180  17.044
   11    HA   PRO   3           HA       PRO   3 -21.518   7.313  19.123
   12    HB2  PRO   3           2HB      PRO   3 -20.246   5.441  20.623
   13    HB3  PRO   3           3HB      PRO   3 -21.820   6.117  21.061
   14    HG2  PRO   3           2HG      PRO   3 -21.182   3.521  19.713
   15    HG3  PRO   3           3HG      PRO   3 -22.352   3.854  21.004
   16    HD2  PRO   3           2HD      PRO   3 -23.080   3.592  18.409
   17    HD3  PRO   3           3HD      PRO   3 -23.929   4.670  19.535
   18    H    ALA   4           H        ALA   4 -20.854   6.904  16.569
   19    HA   ALA   4           HA       ALA   4 -18.359   5.445  16.360
   20    HB1  ALA   4           1HB      ALA   4 -20.150   6.871  14.458
   21    HB2  ALA   4           2HB      ALA   4 -18.464   6.617  14.005
   22    HB3  ALA   4           3HB      ALA   4 -19.493   5.236  14.383
   23    H1   DBU   5           H        DBU   5 -17.609   6.948  18.161
   24    HB1  DBU   5           HB       DBU   5 -15.785  10.011  19.221
   25    HG1  DBU   5           3HG      DBU   5 -18.349   8.621  19.779
   26    HG2  DBU   5           1HG      DBU   5 -17.213   9.187  20.992
   27    HG3  DBU   5           2HG      DBU   5 -17.007   7.585  20.278
   28    H1   DBU   6           H        DBU   6 -14.154   8.135  17.279
   29    HB1  DBU   6           HB       DBU   6 -12.646  11.045  14.888
   30    HG1  DBU   6           3HG      DBU   6 -14.931  11.940  16.129
   31    HG2  DBU   6           1HG      DBU   6 -13.392  12.369  16.856
   32    HG3  DBU   6           2HG      DBU   6 -14.299  10.986  17.475
   33    H    DAL   7           H        DAL   7 -14.622   7.721  14.060
   34    HA   DAL   7           HA       DAL   7 -12.240   7.093  12.569
   35    HB2  DAL   7           2HB      DAL   7 -14.670   7.261  11.706
   36    HB3  DAL   7           3HB      DAL   7 -14.856   5.629  12.345
   37    H    DHA   8           H        DHA   8 -14.600   5.014  14.142
   38    HB1  DHA   8           2HB      DHA   8 -12.695   4.438  16.628
   39    HB2  DHA   8           3HB      DHA   8 -12.688   2.573  16.651
   40    H    TRP   9           H        TRP   9 -15.090   1.825  15.719
   41    HA   TRP   9           HA       TRP   9 -14.332  -0.427  14.280
   42    HB2  TRP   9           2HB      TRP   9 -17.023   0.440  15.336
   43    HB3  TRP   9           3HB      TRP   9 -16.760  -1.131  14.584
   44    HD1  TRP   9           HD1      TRP   9 -16.900   0.342  17.879
   45    HE1  TRP   9           HE1      TRP   9 -15.666  -1.094  19.622
   46    HE3  TRP   9           HE3      TRP   9 -14.246  -2.672  14.715
   47    HZ2  TRP   9           HZ2      TRP   9 -13.812  -3.222  19.652
   48    HZ3  TRP   9           HZ3      TRP   9 -12.765  -4.383  15.682
   49    HH2  TRP   9           HH2      TRP   9 -12.553  -4.650  18.100
   50    H    THR  10           H        THR  10 -16.750   2.041  13.433
   51    HA   THR  10           HA       THR  10 -17.676   1.002  11.056
   52    HB   THR  10           HB       THR  10 -17.125   3.947  11.349
   53    HG1  THR  10           HG1      THR  10 -18.767   4.111  12.774
   54   HG21  THR  10          3HG2      THR  10 -19.102   2.237   9.894
   55   HG22  THR  10          1HG2      THR  10 -18.143   3.592   9.300
   56   HG23  THR  10          2HG2      THR  10 -19.534   3.887  10.342
   57    H    CYS  11           H        CYS  11 -14.975   3.306  11.424
   58    HA   CYS  11           HA       CYS  11 -14.185   3.401   8.768
   59    HB2  CYS  11           2HB      CYS  11 -12.541   3.647  11.292
   60    HB3  CYS  11           3HB      CYS  11 -11.918   4.010   9.686
   61    H    ILE  12           H        ILE  12 -13.382   1.056  11.269
   62    HA   ILE  12           HA       ILE  12 -11.356  -0.317   9.886
   63    HB   ILE  12           HB       ILE  12 -13.267  -1.227  12.030
   64   HG12  ILE  12          2HG1      ILE  12 -10.344  -0.456  12.007
   65   HG13  ILE  12          3HG1      ILE  12 -11.665   0.409  12.786
   66   HG21  ILE  12          1HG2      ILE  12 -11.051  -2.740  10.677
   67   HG22  ILE  12          2HG2      ILE  12 -11.644  -3.158  12.283
   68   HG23  ILE  12          3HG2      ILE  12 -12.732  -3.224  10.897
   69   HD11  ILE  12          3HD1      ILE  12 -10.293  -2.101  13.612
   70   HD12  ILE  12          1HD1      ILE  12 -10.687  -0.666  14.559
   71   HD13  ILE  12          2HD1      ILE  12 -11.957  -1.807  14.116
   72    H1   DBU  13           H        DBU  13 -14.585  -1.581  10.505
   73    HB1  DBU  13           HB       DBU  13 -16.059  -4.420   8.514
   74    HG1  DBU  13           3HG      DBU  13 -15.937  -5.004  10.869
   75    HG2  DBU  13           1HG      DBU  13 -15.460  -3.362  11.265
   76    HG3  DBU  13           2HG      DBU  13 -14.243  -4.524  10.730
   77    H    ALA  14           H        ALA  14 -15.503  -0.304   7.916
   78    HA   ALA  14           HA       ALA  14 -16.531  -0.925   5.363
   79    HB1  ALA  14           1HB      ALA  14 -16.225   1.539   4.937
   80    HB2  ALA  14           2HB      ALA  14 -17.187   1.124   6.356
   81    HB3  ALA  14           3HB      ALA  14 -15.514   1.647   6.548
   82    H    GLY  15           H        GLY  15 -13.337   0.207   6.425
   83    HA2  GLY  15           2HA      GLY  15 -12.244   0.372   3.800
   84    HA3  GLY  15           3HA      GLY  15 -11.333   0.361   5.303
   85    H    VAL  16           H        VAL  16 -11.945  -2.071   6.369
   86    HA   VAL  16           HA       VAL  16 -10.183  -3.808   5.175
   87    HB   VAL  16           HB       VAL  16 -12.577  -4.443   6.898
   88   HG11  VAL  16          1HG1      VAL  16 -10.308  -6.248   6.064
   89   HG12  VAL  16          2HG1      VAL  16 -11.504  -6.624   7.305
   90   HG13  VAL  16          3HG1      VAL  16 -12.007  -6.425   5.626
   91   HG21  VAL  16          3HG2      VAL  16  -9.645  -4.367   7.594
   92   HG22  VAL  16          1HG2      VAL  16 -10.761  -3.027   7.858
   93   HG23  VAL  16          2HG2      VAL  16 -11.004  -4.556   8.702
   94    H1   DBU  17           H        DBU  17 -13.674  -3.707   4.792
   95    HB1  DBU  17           HB       DBU  17 -15.614  -6.050   2.552
   96    HG1  DBU  17           3HG      DBU  17 -16.137  -6.613   4.866
   97    HG2  DBU  17           1HG      DBU  17 -16.014  -4.879   5.109
   98    HG3  DBU  17           2HG      DBU  17 -14.609  -5.907   5.401
   99    H    VAL  18           H        VAL  18 -13.022  -2.766   2.032
  100    HA   VAL  18           HA       VAL  18 -13.371  -3.485  -0.706
  101    HB   VAL  18           HB       VAL  18 -11.920  -1.210   0.632
  102   HG11  VAL  18          1HG1      VAL  18 -11.433  -2.221  -1.966
  103   HG12  VAL  18          2HG1      VAL  18 -12.323  -0.707  -2.140
  104   HG13  VAL  18          3HG1      VAL  18 -10.811  -0.743  -1.232
  105   HG21  VAL  18          3HG2      VAL  18 -14.081  -0.571   0.762
  106   HG22  VAL  18          1HG2      VAL  18 -13.832  -0.115  -0.923
  107   HG23  VAL  18          2HG2      VAL  18 -14.591  -1.658  -0.530
  108    H    DAL  19           H        DAL  19 -10.529  -3.191   1.408
  109    HA   DAL  19           HA       DAL  19  -8.468  -4.132   1.301
  110    HB2  DAL  19           2HB      DAL  19  -8.349  -2.508  -0.594
  111    HB3  DAL  19           3HB      DAL  19  -8.801  -3.815  -1.687
  112    H    ALA  20           H        ALA  20 -10.276  -6.033   1.715
  113    HA   ALA  20           HA       ALA  20  -9.048  -8.378   0.769
  114    HB1  ALA  20           1HB      ALA  20 -11.737  -7.999   2.079
  115    HB2  ALA  20           2HB      ALA  20 -10.943  -9.555   1.832
  116    HB3  ALA  20           3HB      ALA  20 -10.207  -8.347   2.885
  117    H    SER  21           H        SER  21 -10.959  -6.298  -0.909
  118    HA   SER  21           HA       SER  21 -12.485  -8.253  -2.403
  119    HB2  SER  21           2HB      SER  21 -12.134  -5.340  -3.107
  120    HB3  SER  21           3HB      SER  21 -13.466  -6.412  -3.539
  121    HG   SER  21           HG       SER  21 -13.535  -6.510  -1.011
  122    H    LEU  22           H        LEU  22  -9.798  -6.016  -3.039
  123    HA   LEU  22           HA       LEU  22  -9.091  -7.677  -5.368
  124    HB2  LEU  22           2HB      LEU  22  -8.346  -4.787  -5.157
  125    HB3  LEU  22           3HB      LEU  22  -8.447  -5.807  -6.591
  126    HG   LEU  22           HG       LEU  22 -10.699  -4.539  -5.051
  127   HD11  LEU  22          1HD1      LEU  22 -11.226  -3.762  -7.422
  128   HD12  LEU  22          2HD1      LEU  22  -9.593  -4.287  -7.829
  129   HD13  LEU  22          3HD1      LEU  22  -9.838  -3.029  -6.618
  130   HD21  LEU  22          3HD2      LEU  22 -11.788  -5.838  -7.243
  131   HD22  LEU  22          1HD2      LEU  22 -11.960  -6.304  -5.551
  132   HD23  LEU  22          2HD2      LEU  22 -10.688  -7.024  -6.539
  133    H    CYS  23           H        CYS  23  -7.785  -5.437  -2.931
  134    HA   CYS  23           HA       CYS  23  -5.178  -5.485  -3.078
  135    HB2  CYS  23           2HB      CYS  23  -6.614  -6.410  -0.581
  136    HB3  CYS  23           3HB      CYS  23  -4.976  -5.767  -0.639
  137    HA   PRO  24           HA       PRO  24  -3.739  -9.544  -4.138
  138    HB2  PRO  24           2HB      PRO  24  -1.296  -8.475  -2.802
  139    HB3  PRO  24           3HB      PRO  24  -1.467  -9.252  -4.380
  140    HG2  PRO  24           2HG      PRO  24  -1.164  -6.599  -4.155
  141    HG3  PRO  24           3HG      PRO  24  -2.198  -7.316  -5.405
  142    HD2  PRO  24           2HD      PRO  24  -2.937  -5.877  -2.933
  143    HD3  PRO  24           3HD      PRO  24  -3.803  -6.007  -4.477
  144    HN2  DB2  25           H        DB2  25  -3.811 -11.414  -3.066
  145    HA   DB2  25           HA       DB2  25  -3.027 -11.528  -0.251
  146   HB2C  DB2  25          HB        DB2  25  -3.308 -13.472  -2.451
  147   HG1C  DB2  25          3HG       DB2  25  -1.210 -12.417  -1.321
  148   HG2C  DB2  25          1HG       DB2  25  -1.190 -14.118  -1.791
  149   HG3C  DB2  25          2HG       DB2  25  -1.458 -13.672  -0.107
  150    H1   DBU  26           H        DBU  26  -5.699 -10.771  -1.857
  151    HB1  DBU  26           HB       DBU  26  -8.786 -10.277   0.409
  152    HG1  DBU  26           3HG      DBU  26  -5.844  -9.385   0.189
  153    HG2  DBU  26           1HG      DBU  26  -7.033  -8.714   1.293
  154    HG3  DBU  26           2HG      DBU  26  -7.107  -8.313  -0.425
  155    H    LYS  27           H        LYS  27  -7.220 -12.862  -2.622
  156    HA   LYS  27           HA       LYS  27  -9.610 -14.360  -1.801
  157    HB2  LYS  27           2HB      LYS  27  -9.746 -15.077  -4.153
  158    HB3  LYS  27           3HB      LYS  27  -9.770 -13.325  -3.998
  159    HG2  LYS  27           2HG      LYS  27  -7.673 -13.078  -4.914
  160    HG3  LYS  27           3HG      LYS  27  -7.181 -14.721  -4.495
  161    HD2  LYS  27           2HD      LYS  27  -9.390 -14.248  -6.462
  162    HD3  LYS  27           3HD      LYS  27  -7.702 -14.147  -6.969
  163    HE2  LYS  27           2HE      LYS  27  -8.131 -16.358  -7.389
  164    HE3  LYS  27           3HE      LYS  27  -7.530 -16.459  -5.735
  165    HZ1  LYS  27           3HZ      LYS  27  -9.926 -17.409  -6.653
  166    HZ2  LYS  27           1HZ      LYS  27 -10.343 -16.001  -5.812
  167    HZ3  LYS  27           2HZ      LYS  27  -9.476 -17.226  -5.033
  168    H    CYS  28           H        CYS  28  -6.396 -14.599  -1.475
  169    HA   CYS  28           HA       CYS  28  -6.073 -17.380  -2.224
  170    HB2  CYS  28           2HB      CYS  28  -3.793 -17.053  -1.142
  171    HB3  CYS  28           3HB      CYS  28  -4.133 -16.057  -2.554
  172    HN2  DB2  29           H        DB2  29  -8.019 -17.748  -0.703
  173    HA   DB2  29           HA       DB2  29  -6.928 -18.717   1.838
  174   HB2C  DB2  29          HB        DB2  29  -8.290 -20.120   0.133
  175   HG1C  DB2  29          3HG       DB2  29  -7.457 -20.789   2.373
  176   HG2C  DB2  29          1HG       DB2  29  -8.979 -21.568   1.932
  177   HG3C  DB2  29          2HG       DB2  29  -8.974 -20.223   3.072
  178    H    SER  30           H        SER  30  -7.586 -15.885   1.348
  179    HA   SER  30           HA       SER  30  -8.872 -15.368   3.819
  180    HB2  SER  30           2HB      SER  30  -7.349 -13.900   1.958
  181    HB3  SER  30           3HB      SER  30  -8.895 -13.061   2.087
  182    HG   SER  30           HG       SER  30  -6.868 -13.057   3.808
  183    H    ARG  31           H        ARG  31  -9.897 -14.688   0.471
  184    HA   ARG  31           HA       ARG  31 -12.687 -14.767   1.419
  185    HB2  ARG  31           2HB      ARG  31 -11.280 -12.679   0.037
  186    HB3  ARG  31           3HB      ARG  31 -12.573 -13.288  -0.989
  187    HG2  ARG  31           2HG      ARG  31 -13.420 -12.868   1.761
  188    HG3  ARG  31           3HG      ARG  31 -12.825 -11.398   0.986
  189    HD2  ARG  31           2HD      ARG  31 -14.500 -11.375  -0.568
  190    HD3  ARG  31           3HD      ARG  31 -14.686 -13.128  -0.552
  191    HE   ARG  31           HE       ARG  31 -16.338 -12.851   0.986
  192   HH11  ARG  31          1HH1      ARG  31 -14.213 -10.099   1.160
  193   HH12  ARG  31          2HH1      ARG  31 -15.160  -9.280   2.358
  194   HH21  ARG  31          1HH2      ARG  31 -17.593 -11.783   2.562
  195   HH22  ARG  31          2HH2      ARG  31 -17.081 -10.239   3.155
  196    H    CYS  32           H        CYS  32 -11.355 -17.059   0.578
  197    HA   CYS  32           HA       CYS  32 -11.982 -17.555  -2.198
  198    HB2  CYS  32           2HB      CYS  32 -11.359 -19.982  -1.391
  199    HB3  CYS  32           3HB      CYS  32 -10.107 -18.762  -1.603
  Start of MODEL    3
    1    H41  2KT   1           2H4      2KT   1 -23.866   4.338  24.885
    2    H42  2KT   1           3H4      2KT   1 -23.899   5.510  25.820
    3    H43  2KT   1           1H4      2KT   1 -24.528   5.616  24.463
    4    H31  2KT   1           2H3      2KT   1 -22.186   6.117  25.234
    5    H32  2KT   1           3H3      2KT   1 -21.957   4.928  24.347
    6    H1   DBU   2           H        DBU   2 -22.254   4.571  21.895
    7    HB1  DBU   2           HB       DBU   2 -18.654   5.214  20.206
    8    HG1  DBU   2           3HG      DBU   2 -17.960   5.151  22.539
    9    HG2  DBU   2           1HG      DBU   2 -19.604   4.797  23.041
   10    HG3  DBU   2           2HG      DBU   2 -19.125   6.466  22.722
   11    HA   PRO   3           HA       PRO   3 -22.998   5.059  17.190
   12    HB2  PRO   3           2HB      PRO   3 -23.608   7.608  16.484
   13    HB3  PRO   3           3HB      PRO   3 -24.548   6.688  17.664
   14    HG2  PRO   3           2HG      PRO   3 -22.429   8.752  18.125
   15    HG3  PRO   3           3HG      PRO   3 -23.984   8.541  18.952
   16    HD2  PRO   3           2HD      PRO   3 -21.642   7.698  20.017
   17    HD3  PRO   3           3HD      PRO   3 -23.179   6.858  20.305
   18    H    ALA   4           H        ALA   4 -20.350   4.771  17.007
   19    HA   ALA   4           HA       ALA   4 -18.815   4.730  15.282
   20    HB1  ALA   4           1HB      ALA   4 -20.840   5.626  13.895
   21    HB2  ALA   4           2HB      ALA   4 -19.979   7.162  14.005
   22    HB3  ALA   4           3HB      ALA   4 -19.198   5.765  13.264
   23    H1   DBU   5           H        DBU   5 -19.700   8.114  15.766
   24    HB1  DBU   5           HB       DBU   5 -17.242  10.151  18.002
   25    HG1  DBU   5           3HG      DBU   5 -18.449   8.749  19.643
   26    HG2  DBU   5           1HG      DBU   5 -19.087   7.733  18.361
   27    HG3  DBU   5           2HG      DBU   5 -19.802   9.319  18.660
   28    H1   DBU   6           H        DBU   6 -15.478   8.520  16.215
   29    HB1  DBU   6           HB       DBU   6 -13.807  11.496  14.032
   30    HG1  DBU   6           3HG      DBU   6 -15.696  11.368  16.442
   31    HG2  DBU   6           1HG      DBU   6 -16.276  12.253  15.041
   32    HG3  DBU   6           2HG      DBU   6 -14.816  12.792  15.876
   33    H    DAL   7           H        DAL   7 -15.575   7.999  13.074
   34    HA   DAL   7           HA       DAL   7 -13.046   7.529  11.766
   35    HB2  DAL   7           2HB      DAL   7 -15.384   7.528  10.692
   36    HB3  DAL   7           3HB      DAL   7 -15.554   5.912  11.375
   37    H    DHA   8           H        DHA   8 -15.382   5.380  13.287
   38    HB1  DHA   8           2HB      DHA   8 -13.436   4.957  15.806
   39    HB2  DHA   8           3HB      DHA   8 -13.405   3.096  15.909
   40    H    TRP   9           H        TRP   9 -15.992   2.393  14.878
   41    HA   TRP   9           HA       TRP   9 -15.182   0.024  13.645
   42    HB2  TRP   9           2HB      TRP   9 -17.822   1.059  14.618
   43    HB3  TRP   9           3HB      TRP   9 -17.754  -0.463  13.734
   44    HD1  TRP   9           HD1      TRP   9 -17.431   0.905  17.149
   45    HE1  TRP   9           HE1      TRP   9 -16.525  -0.886  18.759
   46    HE3  TRP   9           HE3      TRP   9 -15.880  -2.557  13.722
   47    HZ2  TRP   9           HZ2      TRP   9 -15.312  -3.430  18.598
   48    HZ3  TRP   9           HZ3      TRP   9 -14.856  -4.643  14.532
   49    HH2  TRP   9           HH2      TRP   9 -14.578  -5.068  16.921
   50    H    THR  10           H        THR  10 -17.495   2.475  12.498
   51    HA   THR  10           HA       THR  10 -18.249   1.321  10.112
   52    HB   THR  10           HB       THR  10 -17.706   4.270  10.228
   53    HG1  THR  10           HG1      THR  10 -19.369   4.564  11.611
   54   HG21  THR  10          3HG2      THR  10 -19.501   2.425   8.779
   55   HG22  THR  10          1HG2      THR  10 -18.769   3.940   8.253
   56   HG23  THR  10          2HG2      THR  10 -20.207   3.963   9.274
   57    H    CYS  11           H        CYS  11 -15.572   3.638  10.569
   58    HA   CYS  11           HA       CYS  11 -14.586   3.602   7.977
   59    HB2  CYS  11           2HB      CYS  11 -13.124   3.966  10.598
   60    HB3  CYS  11           3HB      CYS  11 -12.398   4.266   9.022
   61    H    ILE  12           H        ILE  12 -13.984   1.383  10.643
   62    HA   ILE  12           HA       ILE  12 -11.864  -0.056   9.487
   63    HB   ILE  12           HB       ILE  12 -13.868  -0.674  11.617
   64   HG12  ILE  12          2HG1      ILE  12 -10.872  -0.882  11.756
   65   HG13  ILE  12          3HG1      ILE  12 -11.672   0.682  11.862
   66   HG21  ILE  12          1HG2      ILE  12 -12.329  -2.639  10.050
   67   HG22  ILE  12          2HG2      ILE  12 -12.262  -2.824  11.802
   68   HG23  ILE  12          3HG2      ILE  12 -13.818  -2.836  10.974
   69   HD11  ILE  12          3HD1      ILE  12 -11.616   0.236  14.060
   70   HD12  ILE  12          1HD1      ILE  12 -13.078  -0.680  13.696
   71   HD13  ILE  12          2HD1      ILE  12 -11.526  -1.508  13.815
   72    H1   DBU  13           H        DBU  13 -15.134  -1.291   9.922
   73    HB1  DBU  13           HB       DBU  13 -16.464  -4.223   7.966
   74    HG1  DBU  13           3HG      DBU  13 -15.840  -2.991  10.688
   75    HG2  DBU  13           1HG      DBU  13 -14.910  -4.423  10.284
   76    HG3  DBU  13           2HG      DBU  13 -16.669  -4.523  10.393
   77    H    ALA  14           H        ALA  14 -15.844  -0.141   7.210
   78    HA   ALA  14           HA       ALA  14 -16.679  -0.887   4.620
   79    HB1  ALA  14           1HB      ALA  14 -17.394   1.210   5.475
   80    HB2  ALA  14           2HB      ALA  14 -15.733   1.743   5.737
   81    HB3  ALA  14           3HB      ALA  14 -16.348   1.547   4.096
   82    H    GLY  15           H        GLY  15 -13.570   0.297   5.863
   83    HA2  GLY  15           2HA      GLY  15 -12.281   0.328   3.324
   84    HA3  GLY  15           3HA      GLY  15 -11.487   0.394   4.890
   85    H    VAL  16           H        VAL  16 -12.188  -1.981   6.030
   86    HA   VAL  16           HA       VAL  16 -10.345  -3.776   5.065
   87    HB   VAL  16           HB       VAL  16 -12.866  -4.319   6.631
   88   HG11  VAL  16          1HG1      VAL  16 -10.545  -6.175   6.115
   89   HG12  VAL  16          2HG1      VAL  16 -11.895  -6.486   7.208
   90   HG13  VAL  16          3HG1      VAL  16 -12.176  -6.354   5.471
   91   HG21  VAL  16          3HG2      VAL  16 -10.626  -4.758   8.208
   92   HG22  VAL  16          1HG2      VAL  16 -10.228  -3.315   7.276
   93   HG23  VAL  16          2HG2      VAL  16 -11.690  -3.353   8.261
   94    H1   DBU  17           H        DBU  17 -13.795  -3.692   4.406
   95    HB1  DBU  17           HB       DBU  17 -15.567  -6.147   2.147
   96    HG1  DBU  17           3HG      DBU  17 -15.566  -6.765   4.699
   97    HG2  DBU  17           1HG      DBU  17 -16.634  -5.409   4.381
   98    HG3  DBU  17           2HG      DBU  17 -15.013  -5.117   5.016
   99    H    VAL  18           H        VAL  18 -12.928  -2.896   1.661
  100    HA   VAL  18           HA       VAL  18 -13.066  -3.756  -1.055
  101    HB   VAL  18           HB       VAL  18 -11.714  -1.415   0.273
  102   HG11  VAL  18          1HG1      VAL  18 -11.899  -1.060  -2.545
  103   HG12  VAL  18          2HG1      VAL  18 -10.462  -1.044  -1.521
  104   HG13  VAL  18          3HG1      VAL  18 -11.029  -2.559  -2.223
  105   HG21  VAL  18          3HG2      VAL  18 -13.498  -0.408  -1.488
  106   HG22  VAL  18          1HG2      VAL  18 -14.289  -1.924  -1.059
  107   HG23  VAL  18          2HG2      VAL  18 -13.872  -0.761   0.199
  108    H    DAL  19           H        DAL  19 -10.396  -3.353   1.256
  109    HA   DAL  19           HA       DAL  19  -8.336  -4.298   1.359
  110    HB2  DAL  19           2HB      DAL  19  -8.065  -2.776  -0.605
  111    HB3  DAL  19           3HB      DAL  19  -8.434  -4.140  -1.658
  112    H    ALA  20           H        ALA  20 -10.178  -6.175   1.730
  113    HA   ALA  20           HA       ALA  20  -8.890  -8.567   1.005
  114    HB1  ALA  20           1HB      ALA  20 -10.208  -8.424   3.020
  115    HB2  ALA  20           2HB      ALA  20 -11.671  -8.120   2.082
  116    HB3  ALA  20           3HB      ALA  20 -10.866  -9.686   1.978
  117    H    SER  21           H        SER  21 -10.655  -6.576  -0.923
  118    HA   SER  21           HA       SER  21 -12.069  -8.607  -2.427
  119    HB2  SER  21           2HB      SER  21 -11.653  -5.735  -3.253
  120    HB3  SER  21           3HB      SER  21 -12.953  -6.828  -3.729
  121    HG   SER  21           HG       SER  21 -13.848  -5.608  -2.172
  122    H    LEU  22           H        LEU  22  -9.333  -6.405  -2.969
  123    HA   LEU  22           HA       LEU  22  -8.453  -8.186  -5.146
  124    HB2  LEU  22           2HB      LEU  22  -7.718  -5.288  -5.029
  125    HB3  LEU  22           3HB      LEU  22  -7.710  -6.382  -6.411
  126    HG   LEU  22           HG       LEU  22 -10.072  -5.038  -5.120
  127   HD11  LEU  22          1HD1      LEU  22  -8.759  -4.934  -7.817
  128   HD12  LEU  22          2HD1      LEU  22  -9.079  -3.613  -6.693
  129   HD13  LEU  22          3HD1      LEU  22 -10.413  -4.378  -7.556
  130   HD21  LEU  22          3HD2      LEU  22 -11.013  -6.437  -7.305
  131   HD22  LEU  22          1HD2      LEU  22 -11.276  -6.849  -5.610
  132   HD23  LEU  22          2HD2      LEU  22  -9.947  -7.590  -6.502
  133    H    CYS  23           H        CYS  23  -7.330  -5.816  -2.740
  134    HA   CYS  23           HA       CYS  23  -4.722  -5.868  -2.678
  135    HB2  CYS  23           2HB      CYS  23  -6.351  -6.671  -0.258
  136    HB3  CYS  23           3HB      CYS  23  -4.711  -6.034  -0.218
  137    HA   PRO  24           HA       PRO  24  -3.189  -9.960  -3.412
  138    HB2  PRO  24           2HB      PRO  24  -0.878  -8.829  -1.901
  139    HB3  PRO  24           3HB      PRO  24  -0.903  -9.672  -3.454
  140    HG2  PRO  24           2HG      PRO  24  -0.620  -7.011  -3.314
  141    HG3  PRO  24           3HG      PRO  24  -1.534  -7.783  -4.623
  142    HD2  PRO  24           2HD      PRO  24  -2.498  -6.243  -2.293
  143    HD3  PRO  24           3HD      PRO  24  -3.216  -6.441  -3.905
  144    HN2  DB2  25           H        DB2  25  -3.391 -11.776  -2.272
  145    HA   DB2  25           HA       DB2  25  -2.852 -11.779   0.602
  146   HB2C  DB2  25          HB        DB2  25  -2.964 -13.810  -1.532
  147   HG1C  DB2  25          3HG       DB2  25  -0.954 -12.737  -0.291
  148   HG2C  DB2  25          1HG       DB2  25  -0.928 -14.468  -0.640
  149   HG3C  DB2  25          2HG       DB2  25  -1.331 -13.901   0.979
  150    H1   DBU  26           H        DBU  26  -5.371 -11.093  -1.278
  151    HB1  DBU  26           HB       DBU  26  -8.630 -10.477   0.714
  152    HG1  DBU  26           3HG      DBU  26  -5.668  -9.641   0.770
  153    HG2  DBU  26           1HG      DBU  26  -6.960  -8.896   1.696
  154    HG3  DBU  26           2HG      DBU  26  -6.824  -8.574  -0.034
  155    H    LYS  27           H        LYS  27  -6.724 -13.279  -1.982
  156    HA   LYS  27           HA       LYS  27  -9.224 -14.709  -1.361
  157    HB2  LYS  27           2HB      LYS  27  -9.295 -15.399  -3.687
  158    HB3  LYS  27           3HB      LYS  27  -9.172 -13.648  -3.590
  159    HG2  LYS  27           2HG      LYS  27  -6.643 -14.024  -3.878
  160    HG3  LYS  27           3HG      LYS  27  -7.101 -15.636  -4.432
  161    HD2  LYS  27           2HD      LYS  27  -8.476 -13.261  -5.601
  162    HD3  LYS  27           3HD      LYS  27  -6.837 -13.646  -6.131
  163    HE2  LYS  27           2HE      LYS  27  -8.079 -14.841  -7.649
  164    HE3  LYS  27           3HE      LYS  27  -7.816 -16.058  -6.401
  165    HZ1  LYS  27           3HZ      LYS  27  -9.980 -15.889  -5.659
  166    HZ2  LYS  27           1HZ      LYS  27 -10.174 -15.711  -7.330
  167    HZ3  LYS  27           2HZ      LYS  27 -10.216 -14.352  -6.325
  168    H    CYS  28           H        CYS  28  -6.102 -14.944  -0.711
  169    HA   CYS  28           HA       CYS  28  -5.649 -17.702  -1.485
  170    HB2  CYS  28           2HB      CYS  28  -3.533 -17.334  -0.052
  171    HB3  CYS  28           3HB      CYS  28  -3.677 -16.438  -1.561
  172    HN2  DB2  29           H        DB2  29  -7.741 -18.158  -0.220
  173    HA   DB2  29           HA       DB2  29  -6.951 -19.070   2.460
  174   HB2C  DB2  29          HB        DB2  29  -7.884 -20.598   0.570
  175   HG1C  DB2  29          3HG       DB2  29  -7.323 -21.156   2.942
  176   HG2C  DB2  29          1HG       DB2  29  -8.617 -22.136   2.249
  177   HG3C  DB2  29          2HG       DB2  29  -9.003 -20.825   3.362
  178    H    SER  30           H        SER  30  -7.837 -16.322   1.768
  179    HA   SER  30           HA       SER  30  -9.514 -15.912   4.014
  180    HB2  SER  30           2HB      SER  30  -9.648 -13.600   2.422
  181    HB3  SER  30           3HB      SER  30  -8.561 -13.896   3.779
  182    HG   SER  30           HG       SER  30  -8.061 -14.540   1.058
  183    H    ARG  31           H        ARG  31 -10.131 -15.343   0.544
  184    HA   ARG  31           HA       ARG  31 -12.996 -15.773   1.090
  185    HB2  ARG  31           2HB      ARG  31 -13.543 -14.179  -0.625
  186    HB3  ARG  31           3HB      ARG  31 -12.420 -13.422   0.497
  187    HG2  ARG  31           2HG      ARG  31 -10.764 -13.270  -1.041
  188    HG3  ARG  31           3HG      ARG  31 -11.256 -14.744  -1.879
  189    HD2  ARG  31           2HD      ARG  31 -12.897 -12.229  -1.965
  190    HD3  ARG  31           3HD      ARG  31 -11.586 -12.530  -3.104
  191    HE   ARG  31           HE       ARG  31 -13.132 -14.773  -3.242
  192   HH11  ARG  31          1HH1      ARG  31 -13.709 -11.362  -3.635
  193   HH12  ARG  31          2HH1      ARG  31 -14.993 -11.578  -4.777
  194   HH21  ARG  31          1HH2      ARG  31 -14.822 -15.071  -4.744
  195   HH22  ARG  31          2HH2      ARG  31 -15.626 -13.688  -5.406
  196    H    CYS  32           H        CYS  32 -11.328 -17.909   0.517
  197    HA   CYS  32           HA       CYS  32 -11.485 -18.501  -2.309
  198    HB2  CYS  32           2HB      CYS  32 -10.701 -20.828  -1.357
  199    HB3  CYS  32           3HB      CYS  32  -9.583 -19.470  -1.431
  Start of MODEL    4
    1    H41  2KT   1           2H4      2KT   1 -18.175   8.300  23.601
    2    H42  2KT   1           3H4      2KT   1 -18.827   9.644  23.464
    3    H43  2KT   1           1H4      2KT   1 -19.668   8.403  23.504
    4    H31  2KT   1           2H3      2KT   1 -17.918   9.144  21.643
    5    H32  2KT   1           3H3      2KT   1 -18.426   7.735  21.568
    6    H1   DBU   2           H        DBU   2 -22.177   9.561  20.766
    7    HB1  DBU   2           HB       DBU   2 -24.978   7.105  20.485
    8    HG1  DBU   2           3HG      DBU   2 -24.572   9.842  21.250
    9    HG2  DBU   2           1HG      DBU   2 -23.698   8.951  22.485
   10    HG3  DBU   2           2HG      DBU   2 -25.429   8.681  22.268
   11    HA   PRO   3           HA       PRO   3 -23.274   4.894  17.173
   12    HB2  PRO   3           2HB      PRO   3 -23.249   6.237  14.813
   13    HB3  PRO   3           3HB      PRO   3 -24.718   5.995  15.765
   14    HG2  PRO   3           2HG      PRO   3 -22.939   8.397  15.604
   15    HG3  PRO   3           3HG      PRO   3 -24.710   8.315  15.614
   16    HD2  PRO   3           2HD      PRO   3 -23.269   8.942  17.819
   17    HD3  PRO   3           3HD      PRO   3 -24.812   8.068  17.903
   18    H    ALA   4           H        ALA   4 -20.910   5.274  18.354
   19    HA   ALA   4           HA       ALA   4 -18.736   4.622  17.930
   20    HB1  ALA   4           1HB      ALA   4 -19.739   3.933  15.618
   21    HB2  ALA   4           2HB      ALA   4 -18.919   5.389  15.053
   22    HB3  ALA   4           3HB      ALA   4 -17.994   4.097  15.818
   23    H1   DBU   5           H        DBU   5 -19.465   7.236  15.671
   24    HB1  DBU   5           HB       DBU   5 -18.385  10.815  16.162
   25    HG1  DBU   5           3HG      DBU   5 -20.801  10.751  16.082
   26    HG2  DBU   5           1HG      DBU   5 -20.761   9.204  16.911
   27    HG3  DBU   5           2HG      DBU   5 -20.635   9.258  15.151
   28    H1   DBU   6           H        DBU   6 -16.558   9.197  14.466
   29    HB1  DBU   6           HB       DBU   6 -12.883   9.905  16.046
   30    HG1  DBU   6           3HG      DBU   6 -14.188  11.749  17.072
   31    HG2  DBU   6           1HG      DBU   6 -14.842  10.364  17.929
   32    HG3  DBU   6           2HG      DBU   6 -15.701  11.015  16.531
   33    H    DAL   7           H        DAL   7 -15.626   7.442  13.598
   34    HA   DAL   7           HA       DAL   7 -13.207   6.841  12.177
   35    HB2  DAL   7           2HB      DAL   7 -15.648   6.878  11.306
   36    HB3  DAL   7           3HB      DAL   7 -15.745   5.247  11.969
   37    H    DHA   8           H        DHA   8 -15.493   4.698  13.772
   38    HB1  DHA   8           2HB      DHA   8 -13.662   4.274  16.325
   39    HB2  DHA   8           3HB      DHA   8 -13.544   2.414  16.387
   40    H    TRP   9           H        TRP   9 -15.809   1.479  15.413
   41    HA   TRP   9           HA       TRP   9 -14.866  -0.730  14.015
   42    HB2  TRP   9           2HB      TRP   9 -17.544  -0.017  15.168
   43    HB3  TRP   9           3HB      TRP   9 -17.347  -1.505  14.246
   44    HD1  TRP   9           HD1      TRP   9 -16.984  -0.159  17.670
   45    HE1  TRP   9           HE1      TRP   9 -15.796  -1.864  19.188
   46    HE3  TRP   9           HE3      TRP   9 -15.269  -3.379  14.088
   47    HZ2  TRP   9           HZ2      TRP   9 -14.325  -4.257  18.905
   48    HZ3  TRP   9           HZ3      TRP   9 -13.979  -5.351  14.795
   49    HH2  TRP   9           HH2      TRP   9 -13.518  -5.779  17.154
   50    H    THR  10           H        THR  10 -17.415   1.571  13.099
   51    HA   THR  10           HA       THR  10 -18.258   0.428  10.734
   52    HB   THR  10           HB       THR  10 -17.920   3.390  11.245
   53    HG1  THR  10           HG1      THR  10 -19.998   1.555  11.884
   54   HG21  THR  10          3HG2      THR  10 -19.311   3.806   9.465
   55   HG22  THR  10          1HG2      THR  10 -20.078   2.221   9.553
   56   HG23  THR  10          2HG2      THR  10 -18.462   2.381   8.867
   57    H    CYS  11           H        CYS  11 -15.710   2.903  11.085
   58    HA   CYS  11           HA       CYS  11 -14.899   2.998   8.434
   59    HB2  CYS  11           2HB      CYS  11 -13.303   3.399  10.969
   60    HB3  CYS  11           3HB      CYS  11 -12.686   3.768   9.362
   61    H    ILE  12           H        ILE  12 -13.981   0.756  10.988
   62    HA   ILE  12           HA       ILE  12 -11.854  -0.511   9.657
   63    HB   ILE  12           HB       ILE  12 -13.733  -1.512  11.789
   64   HG12  ILE  12          2HG1      ILE  12 -10.870  -0.539  11.809
   65   HG13  ILE  12          3HG1      ILE  12 -12.264   0.258  12.531
   66   HG21  ILE  12          1HG2      ILE  12 -13.053  -3.582  11.351
   67   HG22  ILE  12          2HG2      ILE  12 -11.914  -3.011  10.133
   68   HG23  ILE  12          3HG2      ILE  12 -11.430  -3.083  11.827
   69   HD11  ILE  12          3HD1      ILE  12 -11.707  -0.738  14.426
   70   HD12  ILE  12          1HD1      ILE  12 -12.232  -2.255  13.695
   71   HD13  ILE  12          2HD1      ILE  12 -10.536  -1.777  13.615
   72    H1   DBU  13           H        DBU  13 -15.003  -1.967  10.262
   73    HB1  DBU  13           HB       DBU  13 -16.266  -4.930   8.307
   74    HG1  DBU  13           3HG      DBU  13 -15.008  -3.813  10.912
   75    HG2  DBU  13           1HG      DBU  13 -14.906  -5.507  10.463
   76    HG3  DBU  13           2HG      DBU  13 -16.469  -4.806  10.890
   77    H    ALA  14           H        ALA  14 -15.964  -0.797   7.638
   78    HA   ALA  14           HA       ALA  14 -16.920  -1.528   5.086
   79    HB1  ALA  14           1HB      ALA  14 -17.755   0.482   5.923
   80    HB2  ALA  14           2HB      ALA  14 -16.149   1.091   6.325
   81    HB3  ALA  14           3HB      ALA  14 -16.655   0.984   4.639
   82    H    GLY  15           H        GLY  15 -13.817  -0.174   6.161
   83    HA2  GLY  15           2HA      GLY  15 -12.705   0.007   3.545
   84    HA3  GLY  15           3HA      GLY  15 -11.814   0.087   5.057
   85    H    VAL  16           H        VAL  16 -12.281  -2.357   6.170
   86    HA   VAL  16           HA       VAL  16 -10.395  -4.001   5.035
   87    HB   VAL  16           HB       VAL  16 -12.766  -4.751   6.743
   88   HG11  VAL  16          1HG1      VAL  16 -10.495  -6.415   5.714
   89   HG12  VAL  16          2HG1      VAL  16 -11.288  -6.799   7.243
   90   HG13  VAL  16          3HG1      VAL  16 -12.219  -6.785   5.745
   91   HG21  VAL  16          3HG2      VAL  16 -10.988  -3.197   7.644
   92   HG22  VAL  16          1HG2      VAL  16 -11.266  -4.670   8.573
   93   HG23  VAL  16          2HG2      VAL  16  -9.862  -4.547   7.512
   94    H1   DBU  17           H        DBU  17 -13.879  -4.130   4.604
   95    HB1  DBU  17           HB       DBU  17 -15.634  -6.640   2.392
   96    HG1  DBU  17           3HG      DBU  17 -14.918  -5.707   5.261
   97    HG2  DBU  17           1HG      DBU  17 -15.481  -7.330   4.902
   98    HG3  DBU  17           2HG      DBU  17 -16.579  -5.960   4.716
   99    H    VAL  18           H        VAL  18 -13.252  -3.208   1.832
  100    HA   VAL  18           HA       VAL  18 -13.513  -4.009  -0.893
  101    HB   VAL  18           HB       VAL  18 -12.233  -1.615   0.412
  102   HG11  VAL  18          1HG1      VAL  18 -12.629  -1.203  -2.377
  103   HG12  VAL  18          2HG1      VAL  18 -11.130  -1.116  -1.449
  104   HG13  VAL  18          3HG1      VAL  18 -11.643  -2.649  -2.156
  105   HG21  VAL  18          3HG2      VAL  18 -14.191  -0.684  -1.195
  106   HG22  VAL  18          1HG2      VAL  18 -14.851  -2.263  -0.770
  107   HG23  VAL  18          2HG2      VAL  18 -14.431  -1.113   0.499
  108    H    DAL  19           H        DAL  19 -10.729  -3.487   1.254
  109    HA   DAL  19           HA       DAL  19  -8.610  -4.293   1.196
  110    HB2  DAL  19           2HB      DAL  19  -8.567  -2.705  -0.733
  111    HB3  DAL  19           3HB      DAL  19  -8.916  -4.062  -1.803
  112    H    ALA  20           H        ALA  20 -10.294  -6.300   1.627
  113    HA   ALA  20           HA       ALA  20  -8.903  -8.579   0.748
  114    HB1  ALA  20           1HB      ALA  20 -10.092  -8.578   2.848
  115    HB2  ALA  20           2HB      ALA  20 -11.630  -8.351   2.014
  116    HB3  ALA  20           3HB      ALA  20 -10.731  -9.855   1.812
  117    H    SER  21           H        SER  21 -10.918  -6.662  -1.001
  118    HA   SER  21           HA       SER  21 -12.293  -8.744  -2.471
  119    HB2  SER  21           2HB      SER  21 -12.123  -5.829  -3.234
  120    HB3  SER  21           3HB      SER  21 -13.376  -6.995  -3.659
  121    HG   SER  21           HG       SER  21 -14.328  -6.090  -1.996
  122    H    LEU  22           H        LEU  22  -9.747  -6.350  -3.119
  123    HA   LEU  22           HA       LEU  22  -8.900  -8.009  -5.403
  124    HB2  LEU  22           2HB      LEU  22  -8.347  -5.073  -5.245
  125    HB3  LEU  22           3HB      LEU  22  -8.364  -6.126  -6.658
  126    HG   LEU  22           HG       LEU  22 -10.714  -4.977  -5.171
  127   HD11  LEU  22          1HD1      LEU  22 -10.028  -3.424  -6.740
  128   HD12  LEU  22          2HD1      LEU  22 -11.234  -4.353  -7.631
  129   HD13  LEU  22          3HD1      LEU  22  -9.516  -4.658  -7.892
  130   HD21  LEU  22          3HD2      LEU  22 -11.784  -6.890  -5.616
  131   HD22  LEU  22          1HD2      LEU  22 -10.516  -7.456  -6.703
  132   HD23  LEU  22          2HD2      LEU  22 -11.757  -6.352  -7.296
  133    H    CYS  23           H        CYS  23  -7.783  -5.645  -2.990
  134    HA   CYS  23           HA       CYS  23  -5.174  -5.524  -3.105
  135    HB2  CYS  23           2HB      CYS  23  -6.587  -6.484  -0.607
  136    HB3  CYS  23           3HB      CYS  23  -4.991  -5.741  -0.656
  137    HA   PRO  24           HA       PRO  24  -3.456  -9.500  -4.050
  138    HB2  PRO  24           2HB      PRO  24  -1.112  -8.249  -2.693
  139    HB3  PRO  24           3HB      PRO  24  -1.202  -9.067  -4.258
  140    HG2  PRO  24           2HG      PRO  24  -1.075  -6.396  -4.083
  141    HG3  PRO  24           3HG      PRO  24  -2.037  -7.202  -5.335
  142    HD2  PRO  24           2HD      PRO  24  -2.914  -5.766  -2.907
  143    HD3  PRO  24           3HD      PRO  24  -3.740  -5.982  -4.464
  144    HN2  DB2  25           H        DB2  25  -3.430 -11.349  -2.940
  145    HA   DB2  25           HA       DB2  25  -2.690 -11.358  -0.111
  146   HB2C  DB2  25          HB        DB2  25  -2.830 -13.368  -2.271
  147   HG1C  DB2  25          3HG       DB2  25  -0.697 -14.009  -1.382
  148   HG2C  DB2  25          1HG       DB2  25  -0.991 -13.108   0.108
  149   HG3C  DB2  25          2HG       DB2  25  -0.765 -12.248  -1.414
  150    H1   DBU  26           H        DBU  26  -5.377 -10.807  -1.780
  151    HB1  DBU  26           HB       DBU  26  -8.523 -10.466   0.439
  152    HG1  DBU  26           3HG      DBU  26  -6.928  -8.417  -0.392
  153    HG2  DBU  26           1HG      DBU  26  -5.635  -9.405   0.268
  154    HG3  DBU  26           2HG      DBU  26  -6.900  -8.791   1.335
  155    H    LYS  27           H        LYS  27  -6.630 -13.082  -2.441
  156    HA   LYS  27           HA       LYS  27  -8.976 -14.688  -1.676
  157    HB2  LYS  27           2HB      LYS  27  -8.990 -15.452  -4.039
  158    HB3  LYS  27           3HB      LYS  27  -9.231 -13.718  -3.873
  159    HG2  LYS  27           2HG      LYS  27  -6.432 -14.401  -4.180
  160    HG3  LYS  27           3HG      LYS  27  -7.416 -14.979  -5.527
  161    HD2  LYS  27           2HD      LYS  27  -8.232 -12.788  -5.975
  162    HD3  LYS  27           3HD      LYS  27  -7.549 -12.159  -4.474
  163    HE2  LYS  27           2HE      LYS  27  -5.867 -13.331  -6.678
  164    HE3  LYS  27           3HE      LYS  27  -6.281 -11.619  -6.597
  165    HZ1  LYS  27           3HZ      LYS  27  -4.287 -13.050  -5.168
  166    HZ2  LYS  27           1HZ      LYS  27  -5.337 -12.270  -4.096
  167    HZ3  LYS  27           2HZ      LYS  27  -4.527 -11.380  -5.284
  168    H    CYS  28           H        CYS  28  -5.783 -14.706  -1.258
  169    HA   CYS  28           HA       CYS  28  -5.228 -17.448  -2.019
  170    HB2  CYS  28           2HB      CYS  28  -3.025 -16.941  -0.801
  171    HB3  CYS  28           3HB      CYS  28  -3.361 -16.039  -2.276
  172    HN2  DB2  29           H        DB2  29  -7.178 -18.004  -0.580
  173    HA   DB2  29           HA       DB2  29  -6.124 -18.790   2.050
  174   HB2C  DB2  29          HB        DB2  29  -7.066 -20.438   0.268
  175   HG1C  DB2  29          3HG       DB2  29  -6.296 -21.260   2.315
  176   HG2C  DB2  29          1HG       DB2  29  -7.963 -21.834   2.235
  177   HG3C  DB2  29          2HG       DB2  29  -7.559 -20.437   3.230
  178    H    SER  30           H        SER  30  -7.273 -16.139   1.357
  179    HA   SER  30           HA       SER  30  -8.811 -15.792   3.710
  180    HB2  SER  30           2HB      SER  30  -7.888 -13.772   3.303
  181    HB3  SER  30           3HB      SER  30  -7.738 -14.091   1.575
  182    HG   SER  30           HG       SER  30 -10.051 -13.219   2.967
  183    H    ARG  31           H        ARG  31  -9.723 -15.362   0.286
  184    HA   ARG  31           HA       ARG  31 -12.496 -16.003   1.053
  185    HB2  ARG  31           2HB      ARG  31 -11.480 -13.681  -0.216
  186    HB3  ARG  31           3HB      ARG  31 -12.392 -14.573  -1.426
  187    HG2  ARG  31           2HG      ARG  31 -13.456 -13.815   1.285
  188    HG3  ARG  31           3HG      ARG  31 -13.728 -12.892  -0.195
  189    HD2  ARG  31           2HD      ARG  31 -14.479 -15.791   0.134
  190    HD3  ARG  31           3HD      ARG  31 -15.585 -14.454   0.448
  191    HE   ARG  31           HE       ARG  31 -14.806 -15.481  -2.106
  192   HH11  ARG  31          1HH1      ARG  31 -15.869 -12.636  -0.405
  193   HH12  ARG  31          2HH1      ARG  31 -16.553 -11.891  -1.813
  194   HH21  ARG  31          1HH2      ARG  31 -15.702 -14.511  -3.966
  195   HH22  ARG  31          2HH2      ARG  31 -16.458 -12.959  -3.837
  196    H    CYS  32           H        CYS  32 -10.695 -18.012   0.400
  197    HA   CYS  32           HA       CYS  32 -11.013 -18.698  -2.390
  198    HB2  CYS  32           2HB      CYS  32  -9.980 -20.928  -1.450
  199    HB3  CYS  32           3HB      CYS  32  -8.982 -19.488  -1.626
  Start of MODEL    5
    1    H41  2KT   1           2H4      2KT   1 -27.957   9.941  13.201
    2    H42  2KT   1           3H4      2KT   1 -26.517   9.568  13.015
    3    H43  2KT   1           1H4      2KT   1 -27.596   8.708  12.426
    4    H31  2KT   1           2H3      2KT   1 -28.405   8.340  14.422
    5    H32  2KT   1           3H3      2KT   1 -27.199   7.506  14.107
    6    H1   DBU   2           H        DBU   2 -25.358   9.963  17.068
    7    HB1  DBU   2           HB       DBU   2 -21.657   9.782  17.376
    8    HG1  DBU   2           3HG      DBU   2 -24.101  11.262  18.186
    9    HG2  DBU   2           1HG      DBU   2 -23.597  11.821  16.600
   10    HG3  DBU   2           2HG      DBU   2 -22.494  11.964  17.971
   11    HA   PRO   3           HA       PRO   3 -22.587   5.459  14.813
   12    HB2  PRO   3           2HB      PRO   3 -20.616   5.983  13.020
   13    HB3  PRO   3           3HB      PRO   3 -22.330   6.231  12.664
   14    HG2  PRO   3           2HG      PRO   3 -20.258   8.228  13.490
   15    HG3  PRO   3           3HG      PRO   3 -21.515   8.369  12.248
   16    HD2  PRO   3           2HD      PRO   3 -21.768   9.473  14.707
   17    HD3  PRO   3           3HD      PRO   3 -23.158   8.864  13.787
   18    H    ALA   4           H        ALA   4 -21.607   5.899  17.257
   19    HA   ALA   4           HA       ALA   4 -20.024   4.888  18.600
   20    HB1  ALA   4           1HB      ALA   4 -18.499   3.497  17.717
   21    HB2  ALA   4           2HB      ALA   4 -19.354   3.807  16.206
   22    HB3  ALA   4           3HB      ALA   4 -17.890   4.711  16.592
   23    H1   DBU   5           H        DBU   5 -18.252   6.733  16.166
   24    HB1  DBU   5           HB       DBU   5 -17.150  10.255  17.588
   25    HG1  DBU   5           3HG      DBU   5 -19.453  10.646  16.867
   26    HG2  DBU   5           1HG      DBU   5 -19.804   9.423  18.076
   27    HG3  DBU   5           2HG      DBU   5 -19.613   8.954  16.385
   28    H1   DBU   6           H        DBU   6 -15.426   9.318  16.172
   29    HB1  DBU   6           HB       DBU   6 -11.889   8.819  17.948
   30    HG1  DBU   6           3HG      DBU   6 -14.462   9.154  19.370
   31    HG2  DBU   6           1HG      DBU   6 -14.110  10.646  18.514
   32    HG3  DBU   6           2HG      DBU   6 -12.974  10.039  19.722
   33    H    DAL   7           H        DAL   7 -14.664   6.765  15.311
   34    HA   DAL   7           HA       DAL   7 -12.408   6.554  13.526
   35    HB2  DAL   7           2HB      DAL   7 -14.909   6.411  12.925
   36    HB3  DAL   7           3HB      DAL   7 -14.818   4.754  13.518
   37    H    DHA   8           H        DHA   8 -14.254   4.140  15.299
   38    HB1  DHA   8           2HB      DHA   8 -11.902   3.760  17.435
   39    HB2  DHA   8           3HB      DHA   8 -11.689   1.908  17.396
   40    H    TRP   9           H        TRP   9 -14.221   0.954  16.798
   41    HA   TRP   9           HA       TRP   9 -13.445  -1.212  15.234
   42    HB2  TRP   9           2HB      TRP   9 -15.988  -0.576  16.711
   43    HB3  TRP   9           3HB      TRP   9 -15.819  -2.070  15.793
   44    HD1  TRP   9           HD1      TRP   9 -15.545  -0.981  19.187
   45    HE1  TRP   9           HE1      TRP   9 -13.963  -2.467  20.570
   46    HE3  TRP   9           HE3      TRP   9 -13.138  -3.379  15.366
   47    HZ2  TRP   9           HZ2      TRP   9 -11.959  -4.400  20.103
   48    HZ3  TRP   9           HZ3      TRP   9 -11.401  -5.031  15.920
   49    HH2  TRP   9           HH2      TRP   9 -10.825  -5.530  18.240
   50    H    THR  10           H        THR  10 -16.165   1.029  14.747
   51    HA   THR  10           HA       THR  10 -17.272  -0.068  12.473
   52    HB   THR  10           HB       THR  10 -16.976   2.892  13.015
   53    HG1  THR  10           HG1      THR  10 -18.349   2.570  14.583
   54   HG21  THR  10          3HG2      THR  10 -19.171   2.970  11.776
   55   HG22  THR  10          1HG2      THR  10 -18.879   1.296  11.305
   56   HG23  THR  10          2HG2      THR  10 -17.766   2.564  10.791
   57    H    CYS  11           H        CYS  11 -14.787   2.491  12.578
   58    HA   CYS  11           HA       CYS  11 -14.344   2.710   9.850
   59    HB2  CYS  11           2HB      CYS  11 -12.439   3.084  12.165
   60    HB3  CYS  11           3HB      CYS  11 -12.050   3.528  10.506
   61    H    ILE  12           H        ILE  12 -13.008   0.421  12.168
   62    HA   ILE  12           HA       ILE  12 -11.044  -0.717  10.510
   63    HB   ILE  12           HB       ILE  12 -12.551  -1.776  12.885
   64   HG12  ILE  12          2HG1      ILE  12  -9.696  -0.916  12.390
   65   HG13  ILE  12          3HG1      ILE  12 -10.893  -0.099  13.389
   66   HG21  ILE  12          1HG2      ILE  12 -12.108  -3.696  11.483
   67   HG22  ILE  12          2HG2      ILE  12 -10.425  -3.207  11.298
   68   HG23  ILE  12          3HG2      ILE  12 -11.027  -3.713  12.876
   69   HD11  ILE  12          3HD1      ILE  12 -10.907  -2.291  14.748
   70   HD12  ILE  12          1HD1      ILE  12  -9.373  -2.608  13.937
   71   HD13  ILE  12          2HD1      ILE  12  -9.561  -1.167  14.938
   72    H1   DBU  13           H        DBU  13 -14.028  -2.314  11.485
   73    HB1  DBU  13           HB       DBU  13 -15.448  -5.259   9.612
   74    HG1  DBU  13           3HG      DBU  13 -15.268  -5.382  12.153
   75    HG2  DBU  13           1HG      DBU  13 -14.038  -4.131  12.126
   76    HG3  DBU  13           2HG      DBU  13 -13.659  -5.746  11.521
   77    H    ALA  14           H        ALA  14 -15.382  -1.098   9.064
   78    HA   ALA  14           HA       ALA  14 -16.654  -1.782   6.640
   79    HB1  ALA  14           1HB      ALA  14 -16.153   0.894   6.394
   80    HB2  ALA  14           2HB      ALA  14 -17.534   0.187   7.235
   81    HB3  ALA  14           3HB      ALA  14 -16.097   0.661   8.142
   82    H    GLY  15           H        GLY  15 -13.480  -0.345   7.333
   83    HA2  GLY  15           2HA      GLY  15 -12.746  -0.032   4.599
   84    HA3  GLY  15           3HA      GLY  15 -11.658   0.028   5.978
   85    H    VAL  16           H        VAL  16 -11.886  -2.469   7.045
   86    HA   VAL  16           HA       VAL  16 -10.122  -3.999   5.597
   87    HB   VAL  16           HB       VAL  16 -12.207  -4.898   7.585
   88   HG11  VAL  16          1HG1      VAL  16  -9.910  -6.451   6.398
   89   HG12  VAL  16          2HG1      VAL  16 -10.853  -6.960   7.801
   90   HG13  VAL  16          3HG1      VAL  16 -11.629  -6.803   6.224
   91   HG21  VAL  16          3HG2      VAL  16  -9.666  -5.182   8.656
   92   HG22  VAL  16          1HG2      VAL  16  -9.594  -3.659   7.769
   93   HG23  VAL  16          2HG2      VAL  16 -10.819  -3.897   9.015
   94    H1   DBU  17           H        DBU  17 -13.627  -4.247   5.647
   95    HB1  DBU  17           HB       DBU  17 -15.589  -6.743   3.600
   96    HG1  DBU  17           3HG      DBU  17 -14.263  -6.510   6.317
   97    HG2  DBU  17           1HG      DBU  17 -15.725  -7.409   5.949
   98    HG3  DBU  17           2HG      DBU  17 -15.809  -5.664   6.204
   99    H    VAL  18           H        VAL  18 -13.422  -3.206   2.854
  100    HA   VAL  18           HA       VAL  18 -14.035  -3.918   0.161
  101    HB   VAL  18           HB       VAL  18 -12.662  -1.526   1.372
  102   HG11  VAL  18          1HG1      VAL  18 -12.400  -2.446  -1.291
  103   HG12  VAL  18          2HG1      VAL  18 -13.455  -1.031  -1.317
  104   HG13  VAL  18          3HG1      VAL  18 -11.847  -0.920  -0.601
  105   HG21  VAL  18          3HG2      VAL  18 -15.399  -2.229   0.539
  106   HG22  VAL  18          1HG2      VAL  18 -14.840  -1.107   1.780
  107   HG23  VAL  18          2HG2      VAL  18 -14.855  -0.613   0.088
  108    H    DAL  19           H        DAL  19 -10.995  -3.364   1.918
  109    HA   DAL  19           HA       DAL  19  -8.880  -4.088   1.535
  110    HB2  DAL  19           2HB      DAL  19  -9.163  -2.435  -0.319
  111    HB3  DAL  19           3HB      DAL  19  -9.610  -3.769  -1.381
  112    H    ALA  20           H        ALA  20 -10.424  -6.170   2.117
  113    HA   ALA  20           HA       ALA  20  -9.095  -8.364   0.966
  114    HB1  ALA  20           1HB      ALA  20  -9.977  -8.480   3.208
  115    HB2  ALA  20           2HB      ALA  20 -11.624  -8.281   2.607
  116    HB3  ALA  20           3HB      ALA  20 -10.715  -9.743   2.223
  117    H    SER  21           H        SER  21 -11.394  -6.466  -0.412
  118    HA   SER  21           HA       SER  21 -12.894  -8.547  -1.757
  119    HB2  SER  21           2HB      SER  21 -12.927  -5.604  -2.422
  120    HB3  SER  21           3HB      SER  21 -14.189  -6.801  -2.714
  121    HG   SER  21           HG       SER  21 -13.560  -6.686  -0.091
  122    H    LEU  22           H        LEU  22 -10.543  -6.038  -2.658
  123    HA   LEU  22           HA       LEU  22  -9.969  -7.585  -5.099
  124    HB2  LEU  22           2HB      LEU  22  -9.500  -4.637  -4.907
  125    HB3  LEU  22           3HB      LEU  22  -9.676  -5.642  -6.343
  126    HG   LEU  22           HG       LEU  22 -11.835  -4.635  -4.505
  127   HD11  LEU  22          1HD1      LEU  22 -11.320  -3.027  -6.132
  128   HD12  LEU  22          2HD1      LEU  22 -12.732  -3.875  -6.761
  129   HD13  LEU  22          3HD1      LEU  22 -11.129  -4.242  -7.397
  130   HD21  LEU  22          3HD2      LEU  22 -11.770  -7.049  -6.155
  131   HD22  LEU  22          1HD2      LEU  22 -13.127  -5.977  -6.502
  132   HD23  LEU  22          2HD2      LEU  22 -12.879  -6.583  -4.864
  133    H    CYS  23           H        CYS  23  -8.602  -5.249  -2.788
  134    HA   CYS  23           HA       CYS  23  -6.044  -5.021  -3.250
  135    HB2  CYS  23           2HB      CYS  23  -7.058  -6.137  -0.626
  136    HB3  CYS  23           3HB      CYS  23  -5.511  -5.330  -0.863
  137    HA   PRO  24           HA       PRO  24  -4.304  -8.866  -4.594
  138    HB2  PRO  24           2HB      PRO  24  -1.857  -7.589  -3.463
  139    HB3  PRO  24           3HB      PRO  24  -2.110  -8.330  -5.047
  140    HG2  PRO  24           2HG      PRO  24  -2.056  -5.668  -4.743
  141    HG3  PRO  24           3HG      PRO  24  -3.135  -6.451  -5.913
  142    HD2  PRO  24           2HD      PRO  24  -3.758  -5.175  -3.323
  143    HD3  PRO  24           3HD      PRO  24  -4.760  -5.347  -4.778
  144    HN2  DB2  25           H        DB2  25  -4.114 -10.761  -3.588
  145    HA   DB2  25           HA       DB2  25  -3.010 -10.889  -0.883
  146   HB2C  DB2  25          HB        DB2  25  -3.369 -12.784  -3.114
  147   HG1C  DB2  25          3HG       DB2  25  -1.251 -12.894  -1.002
  148   HG2C  DB2  25          1HG       DB2  25  -1.264 -11.571  -2.171
  149   HG3C  DB2  25          2HG       DB2  25  -1.139 -13.238  -2.728
  150    H1   DBU  26           H        DBU  26  -5.908 -10.360  -2.183
  151    HB1  DBU  26           HB       DBU  26  -8.740 -10.214   0.453
  152    HG1  DBU  26           3HG      DBU  26  -7.283  -8.089  -0.465
  153    HG2  DBU  26           1HG      DBU  26  -5.914  -9.080   0.008
  154    HG3  DBU  26           2HG      DBU  26  -7.068  -8.539   1.230
  155    H    LYS  27           H        LYS  27  -7.120 -12.659  -2.755
  156    HA   LYS  27           HA       LYS  27  -9.314 -14.376  -1.792
  157    HB2  LYS  27           2HB      LYS  27  -9.832 -14.891  -4.101
  158    HB3  LYS  27           3HB      LYS  27  -9.831 -13.147  -3.878
  159    HG2  LYS  27           2HG      LYS  27  -8.664 -13.286  -5.823
  160    HG3  LYS  27           3HG      LYS  27  -7.328 -13.396  -4.674
  161    HD2  LYS  27           2HD      LYS  27  -6.993 -15.630  -5.071
  162    HD3  LYS  27           3HD      LYS  27  -8.673 -15.910  -5.532
  163    HE2  LYS  27           2HE      LYS  27  -6.774 -14.288  -7.208
  164    HE3  LYS  27           3HE      LYS  27  -6.946 -16.033  -7.388
  165    HZ1  LYS  27           3HZ      LYS  27  -8.549 -15.488  -8.827
  166    HZ2  LYS  27           1HZ      LYS  27  -8.712 -13.913  -8.229
  167    HZ3  LYS  27           2HZ      LYS  27  -9.501 -15.195  -7.459
  168    H    CYS  28           H        CYS  28  -6.134 -14.319  -1.772
  169    HA   CYS  28           HA       CYS  28  -5.575 -16.925  -2.914
  170    HB2  CYS  28           2HB      CYS  28  -3.270 -16.433  -1.832
  171    HB3  CYS  28           3HB      CYS  28  -3.775 -15.470  -3.217
  172    HN2  DB2  29           H        DB2  29  -7.334 -17.720  -1.338
  173    HA   DB2  29           HA       DB2  29  -5.958 -18.741   1.054
  174   HB2C  DB2  29          HB        DB2  29  -7.008 -20.237  -0.802
  175   HG1C  DB2  29          3HG       DB2  29  -7.235 -21.991   0.825
  176   HG2C  DB2  29          1HG       DB2  29  -7.559 -20.821   2.107
  177   HG3C  DB2  29          2HG       DB2  29  -5.962 -20.895   1.364
  178    H    SER  30           H        SER  30  -7.322 -16.106   0.770
  179    HA   SER  30           HA       SER  30  -8.587 -16.090   3.301
  180    HB2  SER  30           2HB      SER  30  -9.349 -13.750   1.911
  181    HB3  SER  30           3HB      SER  30  -8.044 -13.928   3.084
  182    HG   SER  30           HG       SER  30  -6.776 -13.528   1.466
  183    H    ARG  31           H        ARG  31  -9.945 -15.381   0.077
  184    HA   ARG  31           HA       ARG  31 -12.550 -16.327   1.082
  185    HB2  ARG  31           2HB      ARG  31 -13.610 -14.748  -0.487
  186    HB3  ARG  31           3HB      ARG  31 -12.610 -13.927   0.704
  187    HG2  ARG  31           2HG      ARG  31 -10.885 -13.548  -0.895
  188    HG3  ARG  31           3HG      ARG  31 -11.683 -14.583  -2.080
  189    HD2  ARG  31           2HD      ARG  31 -12.746 -11.977  -0.995
  190    HD3  ARG  31           3HD      ARG  31 -12.030 -12.220  -2.588
  191    HE   ARG  31           HE       ARG  31 -13.978 -13.251  -3.290
  192   HH11  ARG  31          1HH1      ARG  31 -14.089 -12.636   0.135
  193   HH12  ARG  31          2HH1      ARG  31 -15.783 -12.971   0.273
  194   HH21  ARG  31          1HH2      ARG  31 -16.209 -13.694  -3.122
  195   HH22  ARG  31          2HH2      ARG  31 -16.988 -13.573  -1.580
  196    H    CYS  32           H        CYS  32 -10.723 -18.102  -0.012
  197    HA   CYS  32           HA       CYS  32 -11.314 -18.491  -2.811
  198    HB2  CYS  32           2HB      CYS  32 -10.081 -20.754  -2.230
  199    HB3  CYS  32           3HB      CYS  32  -9.183 -19.247  -2.376
  Start of MODEL    6
    1    H41  2KT   1           2H4      2KT   1 -23.427   3.354  14.113
    2    H42  2KT   1           3H4      2KT   1 -24.529   2.856  13.225
    3    H43  2KT   1           1H4      2KT   1 -23.103   2.785  12.763
    4    H31  2KT   1           2H3      2KT   1 -24.797   4.774  12.895
    5    H32  2KT   1           3H3      2KT   1 -23.438   5.251  13.313
    6    H1   DBU   2           H        DBU   2 -21.100   4.457  11.852
    7    HB1  DBU   2           HB       DBU   2 -19.231   7.094   9.438
    8    HG1  DBU   2           3HG      DBU   2 -21.263   4.795   9.100
    9    HG2  DBU   2           1HG      DBU   2 -20.101   5.306   7.888
   10    HG3  DBU   2           2HG      DBU   2 -21.513   6.310   8.226
   11    HA   PRO   3           HA       PRO   3 -18.322   9.121  13.213
   12    HB2  PRO   3           2HB      PRO   3 -20.215  10.742  14.289
   13    HB3  PRO   3           3HB      PRO   3 -19.596  10.947  12.646
   14    HG2  PRO   3           2HG      PRO   3 -22.123   9.633  13.568
   15    HG3  PRO   3           3HG      PRO   3 -21.868  10.732  12.199
   16    HD2  PRO   3           2HD      PRO   3 -22.052   8.047  11.898
   17    HD3  PRO   3           3HD      PRO   3 -21.038   9.058  10.849
   18    H    ALA   4           H        ALA   4 -18.620   6.693  14.283
   19    HA   ALA   4           HA       ALA   4 -20.006   6.835  16.824
   20    HB1  ALA   4           1HB      ALA   4 -19.719   4.765  15.285
   21    HB2  ALA   4           2HB      ALA   4 -18.145   4.620  16.069
   22    HB3  ALA   4           3HB      ALA   4 -19.620   4.565  17.035
   23    H1   DBU   5           H        DBU   5 -18.552   8.779  17.233
   24    HB1  DBU   5           HB       DBU   5 -16.072   9.098  20.236
   25    HG1  DBU   5           3HG      DBU   5 -18.125   7.503  20.847
   26    HG2  DBU   5           1HG      DBU   5 -18.977   8.296  19.533
   27    HG3  DBU   5           2HG      DBU   5 -18.505   9.225  20.958
   28    H1   DBU   6           H        DBU   6 -14.802   7.159  18.083
   29    HB1  DBU   6           HB       DBU   6 -11.602   9.467  17.138
   30    HG1  DBU   6           3HG      DBU   6 -13.861   9.621  19.215
   31    HG2  DBU   6           1HG      DBU   6 -13.609  11.027  18.194
   32    HG3  DBU   6           2HG      DBU   6 -12.324  10.491  19.280
   33    H    DAL   7           H        DAL   7 -14.624   6.628  15.707
   34    HA   DAL   7           HA       DAL   7 -12.510   6.063  13.822
   35    HB2  DAL   7           2HB      DAL   7 -15.046   6.256  13.353
   36    HB3  DAL   7           3HB      DAL   7 -15.134   4.606  13.966
   37    H    DHA   8           H        DHA   8 -14.616   3.935  15.664
   38    HB1  DHA   8           2HB      DHA   8 -12.632   3.291  17.972
   39    HB2  DHA   8           3HB      DHA   8 -12.504   1.433  17.883
   40    H    TRP   9           H        TRP   9 -14.777   0.530  17.020
   41    HA   TRP   9           HA       TRP   9 -13.935  -1.544  15.380
   42    HB2  TRP   9           2HB      TRP   9 -16.661  -1.022  16.580
   43    HB3  TRP   9           3HB      TRP   9 -16.194  -2.542  15.821
   44    HD1  TRP   9           HD1      TRP   9 -16.466  -1.094  19.119
   45    HE1  TRP   9           HE1      TRP   9 -14.998  -2.333  20.832
   46    HE3  TRP   9           HE3      TRP   9 -13.483  -3.707  15.892
   47    HZ2  TRP   9           HZ2      TRP   9 -12.858  -4.174  20.817
   48    HZ3  TRP   9           HZ3      TRP   9 -11.749  -5.184  16.823
   49    HH2  TRP   9           HH2      TRP   9 -11.445  -5.411  19.235
   50    H    THR  10           H        THR  10 -16.858   0.451  14.909
   51    HA   THR  10           HA       THR  10 -17.753  -0.434  12.521
   52    HB   THR  10           HB       THR  10 -17.538   2.531  12.754
   53    HG1  THR  10           HG1      THR  10 -19.537   1.540  14.314
   54   HG21  THR  10          3HG2      THR  10 -19.487   0.502  11.801
   55   HG22  THR  10          1HG2      THR  10 -19.005   2.036  11.076
   56   HG23  THR  10          2HG2      THR  10 -20.131   2.017  12.433
   57    H    CYS  11           H        CYS  11 -15.266   2.102  12.862
   58    HA   CYS  11           HA       CYS  11 -14.706   2.465  10.170
   59    HB2  CYS  11           2HB      CYS  11 -12.940   2.717  12.605
   60    HB3  CYS  11           3HB      CYS  11 -12.410   3.184  10.992
   61    H    ILE  12           H        ILE  12 -13.424   0.075  12.430
   62    HA   ILE  12           HA       ILE  12 -11.437  -1.000  10.759
   63    HB   ILE  12           HB       ILE  12 -13.003  -2.263  13.006
   64   HG12  ILE  12          2HG1      ILE  12 -10.203  -1.131  12.832
   65   HG13  ILE  12          3HG1      ILE  12 -11.566  -0.410  13.680
   66   HG21  ILE  12          1HG2      ILE  12 -12.304  -4.193  12.062
   67   HG22  ILE  12          2HG2      ILE  12 -11.012  -3.409  11.155
   68   HG23  ILE  12          3HG2      ILE  12 -10.791  -3.774  12.866
   69   HD11  ILE  12          3HD1      ILE  12 -10.678  -1.409  15.468
   70   HD12  ILE  12          1HD1      ILE  12 -11.464  -2.856  14.837
   71   HD13  ILE  12          2HD1      ILE  12  -9.759  -2.559  14.496
   72    H1   DBU  13           H        DBU  13 -14.438  -2.625  11.632
   73    HB1  DBU  13           HB       DBU  13 -15.830  -5.504   9.639
   74    HG1  DBU  13           3HG      DBU  13 -13.920  -5.864  11.582
   75    HG2  DBU  13           1HG      DBU  13 -15.603  -5.936  12.077
   76    HG3  DBU  13           2HG      DBU  13 -14.692  -4.438  12.284
   77    H    ALA  14           H        ALA  14 -15.765  -1.331   9.236
   78    HA   ALA  14           HA       ALA  14 -16.994  -1.932   6.769
   79    HB1  ALA  14           1HB      ALA  14 -16.052   0.731   7.826
   80    HB2  ALA  14           2HB      ALA  14 -17.164   0.491   6.478
   81    HB3  ALA  14           3HB      ALA  14 -17.634   0.002   8.105
   82    H    GLY  15           H        GLY  15 -13.833  -0.520   7.564
   83    HA2  GLY  15           2HA      GLY  15 -13.056  -0.108   4.854
   84    HA3  GLY  15           3HA      GLY  15 -11.991  -0.094   6.252
   85    H    VAL  16           H        VAL  16 -12.234  -2.629   7.227
   86    HA   VAL  16           HA       VAL  16 -10.443  -4.105   5.756
   87    HB   VAL  16           HB       VAL  16 -12.559  -5.075   7.676
   88   HG11  VAL  16          1HG1      VAL  16 -12.091  -7.161   7.076
   89   HG12  VAL  16          2HG1      VAL  16 -10.888  -6.598   5.913
   90   HG13  VAL  16          3HG1      VAL  16 -10.424  -6.898   7.588
   91   HG21  VAL  16          3HG2      VAL  16  -9.762  -4.103   7.912
   92   HG22  VAL  16          1HG2      VAL  16 -11.141  -3.861   8.985
   93   HG23  VAL  16          2HG2      VAL  16 -10.279  -5.400   8.990
   94    H1   DBU  17           H        DBU  17 -13.947  -4.357   5.737
   95    HB1  DBU  17           HB       DBU  17 -15.870  -6.783   3.572
   96    HG1  DBU  17           3HG      DBU  17 -15.595  -7.655   5.945
   97    HG2  DBU  17           1HG      DBU  17 -16.459  -6.134   6.094
   98    HG3  DBU  17           2HG      DBU  17 -14.717  -6.184   6.378
   99    H    VAL  18           H        VAL  18 -13.696  -3.218   2.988
  100    HA   VAL  18           HA       VAL  18 -14.264  -3.835   0.261
  101    HB   VAL  18           HB       VAL  18 -12.916  -1.486   1.579
  102   HG11  VAL  18          1HG1      VAL  18 -12.610  -2.310  -1.111
  103   HG12  VAL  18          2HG1      VAL  18 -13.663  -0.894  -1.103
  104   HG13  VAL  18          3HG1      VAL  18 -12.067  -0.812  -0.356
  105   HG21  VAL  18          3HG2      VAL  18 -15.104  -1.089   1.966
  106   HG22  VAL  18          1HG2      VAL  18 -15.086  -0.529   0.294
  107   HG23  VAL  18          2HG2      VAL  18 -15.637  -2.161   0.671
  108    H    DAL  19           H        DAL  19 -11.255  -3.341   2.087
  109    HA   DAL  19           HA       DAL  19  -9.133  -4.048   1.714
  110    HB2  DAL  19           2HB      DAL  19  -9.385  -2.331  -0.083
  111    HB3  DAL  19           3HB      DAL  19  -9.817  -3.625  -1.200
  112    H    ALA  20           H        ALA  20 -10.683  -6.151   2.196
  113    HA   ALA  20           HA       ALA  20  -9.331  -8.302   0.992
  114    HB1  ALA  20           1HB      ALA  20 -10.970  -9.726   2.170
  115    HB2  ALA  20           2HB      ALA  20 -10.253  -8.498   3.213
  116    HB3  ALA  20           3HB      ALA  20 -11.888  -8.280   2.589
  117    H    SER  21           H        SER  21 -11.613  -6.359  -0.356
  118    HA   SER  21           HA       SER  21 -13.084  -8.393  -1.800
  119    HB2  SER  21           2HB      SER  21 -13.110  -5.428  -2.361
  120    HB3  SER  21           3HB      SER  21 -14.365  -6.615  -2.718
  121    HG   SER  21           HG       SER  21 -15.103  -5.750  -0.899
  122    H    LEU  22           H        LEU  22 -10.724  -5.850  -2.573
  123    HA   LEU  22           HA       LEU  22 -10.107  -7.310  -5.057
  124    HB2  LEU  22           2HB      LEU  22  -9.641  -4.371  -4.750
  125    HB3  LEU  22           3HB      LEU  22  -9.793  -5.323  -6.225
  126    HG   LEU  22           HG       LEU  22 -11.982  -4.383  -4.387
  127   HD11  LEU  22          1HD1      LEU  22 -12.830  -3.583  -6.680
  128   HD12  LEU  22          2HD1      LEU  22 -11.172  -3.847  -7.221
  129   HD13  LEU  22          3HD1      LEU  22 -11.504  -2.703  -5.920
  130   HD21  LEU  22          3HD2      LEU  22 -13.125  -5.696  -6.569
  131   HD22  LEU  22          1HD2      LEU  22 -13.144  -6.210  -4.882
  132   HD23  LEU  22          2HD2      LEU  22 -11.879  -6.791  -5.966
  133    H    CYS  23           H        CYS  23  -8.780  -5.064  -2.637
  134    HA   CYS  23           HA       CYS  23  -6.213  -4.825  -3.052
  135    HB2  CYS  23           2HB      CYS  23  -7.270  -6.018  -0.480
  136    HB3  CYS  23           3HB      CYS  23  -5.721  -5.201  -0.668
  137    HA   PRO  24           HA       PRO  24  -4.493  -8.649  -4.494
  138    HB2  PRO  24           2HB      PRO  24  -2.040  -7.390  -3.354
  139    HB3  PRO  24           3HB      PRO  24  -2.301  -8.104  -4.950
  140    HG2  PRO  24           2HG      PRO  24  -2.247  -5.447  -4.599
  141    HG3  PRO  24           3HG      PRO  24  -3.332  -6.210  -5.777
  142    HD2  PRO  24           2HD      PRO  24  -3.942  -4.980  -3.161
  143    HD3  PRO  24           3HD      PRO  24  -4.951  -5.127  -4.614
  144    HN2  DB2  25           H        DB2  25  -4.257 -10.566  -3.534
  145    HA   DB2  25           HA       DB2  25  -3.166 -10.731  -0.825
  146   HB2C  DB2  25          HB        DB2  25  -3.482 -12.585  -3.097
  147   HG1C  DB2  25          3HG       DB2  25  -1.429 -11.840  -1.062
  148   HG2C  DB2  25          1HG       DB2  25  -1.323 -11.866  -2.824
  149   HG3C  DB2  25          2HG       DB2  25  -1.272 -13.376  -1.915
  150    H1   DBU  26           H        DBU  26  -6.059 -10.190  -2.102
  151    HB1  DBU  26           HB       DBU  26  -8.918 -10.143   0.492
  152    HG1  DBU  26           3HG      DBU  26  -7.260  -8.439   1.283
  153    HG2  DBU  26           1HG      DBU  26  -7.540  -7.968  -0.384
  154    HG3  DBU  26           2HG      DBU  26  -6.122  -8.937   0.027
  155    H    LYS  27           H        LYS  27  -7.427 -12.395  -2.830
  156    HA   LYS  27           HA       LYS  27  -9.551 -14.180  -1.861
  157    HB2  LYS  27           2HB      LYS  27  -9.881 -14.785  -4.218
  158    HB3  LYS  27           3HB      LYS  27 -10.036 -13.051  -3.971
  159    HG2  LYS  27           2HG      LYS  27  -7.721 -12.765  -4.783
  160    HG3  LYS  27           3HG      LYS  27  -7.656 -14.497  -5.117
  161    HD2  LYS  27           2HD      LYS  27  -9.752 -14.105  -6.541
  162    HD3  LYS  27           3HD      LYS  27  -9.348 -12.390  -6.431
  163    HE2  LYS  27           2HE      LYS  27  -7.063 -12.991  -7.303
  164    HE3  LYS  27           3HE      LYS  27  -7.692 -14.607  -7.622
  165    HZ1  LYS  27           3HZ      LYS  27  -8.421 -12.055  -8.905
  166    HZ2  LYS  27           1HZ      LYS  27  -9.501 -13.357  -8.919
  167    HZ3  LYS  27           2HZ      LYS  27  -7.973 -13.519  -9.625
  168    H    CYS  28           H        CYS  28  -6.312 -14.085  -1.881
  169    HA   CYS  28           HA       CYS  28  -5.789 -16.776  -2.821
  170    HB2  CYS  28           2HB      CYS  28  -3.451 -16.257  -1.958
  171    HB3  CYS  28           3HB      CYS  28  -4.041 -15.238  -3.268
  172    HN2  DB2  29           H        DB2  29  -7.521 -17.408  -1.127
  173    HA   DB2  29           HA       DB2  29  -6.068 -18.401   1.214
  174   HB2C  DB2  29          HB        DB2  29  -7.512 -19.819  -0.420
  175   HG1C  DB2  29          3HG       DB2  29  -6.451 -20.879   1.361
  176   HG2C  DB2  29          1HG       DB2  29  -8.154 -21.261   1.627
  177   HG3C  DB2  29          2HG       DB2  29  -7.377 -19.991   2.572
  178    H    SER  30           H        SER  30  -7.014 -15.616   0.975
  179    HA   SER  30           HA       SER  30  -8.039 -15.348   3.605
  180    HB2  SER  30           2HB      SER  30  -6.824 -13.664   1.734
  181    HB3  SER  30           3HB      SER  30  -8.431 -12.979   1.973
  182    HG   SER  30           HG       SER  30  -7.658 -12.201   3.755
  183    H    ARG  31           H        ARG  31  -9.498 -14.579   0.441
  184    HA   ARG  31           HA       ARG  31 -12.143 -14.944   1.689
  185    HB2  ARG  31           2HB      ARG  31 -11.926 -12.622   1.188
  186    HB3  ARG  31           3HB      ARG  31 -11.261 -12.961  -0.404
  187    HG2  ARG  31           2HG      ARG  31 -13.293 -13.338  -1.329
  188    HG3  ARG  31           3HG      ARG  31 -13.971 -13.998   0.161
  189    HD2  ARG  31           2HD      ARG  31 -13.377 -11.083  -0.332
  190    HD3  ARG  31           3HD      ARG  31 -14.967 -11.828  -0.480
  191    HE   ARG  31           HE       ARG  31 -13.683 -11.013   1.924
  192   HH11  ARG  31          1HH1      ARG  31 -15.828 -13.408   0.588
  193   HH12  ARG  31          2HH1      ARG  31 -16.625 -13.724   2.093
  194   HH21  ARG  31          1HH2      ARG  31 -14.725 -11.420   3.912
  195   HH22  ARG  31          2HH2      ARG  31 -15.997 -12.592   3.983
  196    H    CYS  32           H        CYS  32 -10.777 -17.092   0.609
  197    HA   CYS  32           HA       CYS  32 -11.693 -17.512  -2.106
  198    HB2  CYS  32           2HB      CYS  32 -10.747 -19.898  -1.532
  199    HB3  CYS  32           3HB      CYS  32  -9.650 -18.552  -1.822
  Start of MODEL    7
    1    H41  2KT   1           2H4      2KT   1 -23.991   2.642  24.533
    2    H42  2KT   1           3H4      2KT   1 -22.907   3.668  24.682
    3    H43  2KT   1           1H4      2KT   1 -24.293   3.964  25.174
    4    H31  2KT   1           2H3      2KT   1 -23.648   3.436  22.651
    5    H32  2KT   1           3H3      2KT   1 -25.071   3.758  22.999
    6    H1   DBU   2           H        DBU   2 -24.369   6.659  21.074
    7    HB1  DBU   2           HB       DBU   2 -21.320   8.446  19.447
    8    HG1  DBU   2           3HG      DBU   2 -23.612   9.198  21.141
    9    HG2  DBU   2           1HG      DBU   2 -22.085  10.062  21.076
   10    HG3  DBU   2           2HG      DBU   2 -22.287   8.723  22.209
   11    HA   PRO   3           HA       PRO   3 -22.352   4.133  17.044
   12    HB2  PRO   3           2HB      PRO   3 -22.596   5.530  14.729
   13    HB3  PRO   3           3HB      PRO   3 -23.986   5.010  15.688
   14    HG2  PRO   3           2HG      PRO   3 -22.649   7.687  15.586
   15    HG3  PRO   3           3HG      PRO   3 -24.380   7.301  15.612
   16    HD2  PRO   3           2HD      PRO   3 -23.032   8.099  17.821
   17    HD3  PRO   3           3HD      PRO   3 -24.401   6.971  17.893
   18    H    ALA   4           H        ALA   4 -20.069   4.878  18.211
   19    HA   ALA   4           HA       ALA   4 -17.823   4.623  17.743
   20    HB1  ALA   4           1HB      ALA   4 -18.808   3.931  15.368
   21    HB2  ALA   4           2HB      ALA   4 -18.055   5.460  14.912
   22    HB3  ALA   4           3HB      ALA   4 -17.084   4.182  15.644
   23    H1   DBU   5           H        DBU   5 -19.027   7.139  15.577
   24    HB1  DBU   5           HB       DBU   5 -18.571  10.835  16.219
   25    HG1  DBU   5           3HG      DBU   5 -20.491   8.532  15.631
   26    HG2  DBU   5           1HG      DBU   5 -20.900  10.239  15.670
   27    HG3  DBU   5           2HG      DBU   5 -20.718   9.346  17.182
   28    H1   DBU   6           H        DBU   6 -16.572   9.540  14.337
   29    HB1  DBU   6           HB       DBU   6 -13.021  10.943  15.665
   30    HG1  DBU   6           3HG      DBU   6 -14.972  11.259  17.581
   31    HG2  DBU   6           1HG      DBU   6 -15.979  11.592  16.183
   32    HG3  DBU   6           2HG      DBU   6 -14.604  12.639  16.541
   33    H    DAL   7           H        DAL   7 -15.373   8.118  13.259
   34    HA   DAL   7           HA       DAL   7 -12.820   7.651  12.054
   35    HB2  DAL   7           2HB      DAL   7 -15.154   7.558  10.967
   36    HB3  DAL   7           3HB      DAL   7 -15.261   5.938  11.654
   37    H    DHA   8           H        DHA   8 -15.094   5.433  13.570
   38    HB1  DHA   8           2HB      DHA   8 -13.165   5.100  16.115
   39    HB2  DHA   8           3HB      DHA   8 -13.068   3.242  16.232
   40    H    TRP   9           H        TRP   9 -15.604   2.430  15.187
   41    HA   TRP   9           HA       TRP   9 -14.684   0.097  13.946
   42    HB2  TRP   9           2HB      TRP   9 -17.468   0.935  14.770
   43    HB3  TRP   9           3HB      TRP   9 -17.074  -0.680  14.189
   44    HD1  TRP   9           HD1      TRP   9 -17.509   1.094  17.313
   45    HE1  TRP   9           HE1      TRP   9 -16.348  -0.116  19.265
   46    HE3  TRP   9           HE3      TRP   9 -14.534  -2.090  14.640
   47    HZ2  TRP   9           HZ2      TRP   9 -14.425  -2.151  19.625
   48    HZ3  TRP   9           HZ3      TRP   9 -13.063  -3.636  15.864
   49    HH2  TRP   9           HH2      TRP   9 -13.010  -3.664  18.304
   50    H    THR  10           H        THR  10 -17.073   2.486  12.840
   51    HA   THR  10           HA       THR  10 -17.856   1.292  10.475
   52    HB   THR  10           HB       THR  10 -17.438   4.257  10.899
   53    HG1  THR  10           HG1      THR  10 -19.169   4.181  12.114
   54   HG21  THR  10          3HG2      THR  10 -19.682   3.815   9.317
   55   HG22  THR  10          1HG2      THR  10 -18.477   2.689   8.694
   56   HG23  THR  10          2HG2      THR  10 -18.115   4.413   8.775
   57    H    CYS  11           H        CYS  11 -15.227   3.669  10.890
   58    HA   CYS  11           HA       CYS  11 -14.297   3.681   8.278
   59    HB2  CYS  11           2HB      CYS  11 -12.806   4.061  10.878
   60    HB3  CYS  11           3HB      CYS  11 -12.090   4.361   9.298
   61    H    ILE  12           H        ILE  12 -13.564   1.460  10.915
   62    HA   ILE  12           HA       ILE  12 -11.455   0.072   9.679
   63    HB   ILE  12           HB       ILE  12 -13.430  -0.768  11.791
   64   HG12  ILE  12          2HG1      ILE  12 -10.485  -0.076  11.875
   65   HG13  ILE  12          3HG1      ILE  12 -11.804   0.947  12.436
   66   HG21  ILE  12          1HG2      ILE  12 -11.447  -2.376  10.317
   67   HG22  ILE  12          2HG2      ILE  12 -11.451  -2.564  12.070
   68   HG23  ILE  12          3HG2      ILE  12 -12.922  -2.871  11.146
   69   HD11  ILE  12          3HD1      ILE  12 -11.659   0.021  14.432
   70   HD12  ILE  12          1HD1      ILE  12 -12.039  -1.554  13.736
   71   HD13  ILE  12          2HD1      ILE  12 -10.361  -1.026  13.860
   72    H1   DBU  13           H        DBU  13 -14.682  -1.232  10.222
   73    HB1  DBU  13           HB       DBU  13 -16.015  -4.189   8.305
   74    HG1  DBU  13           3HG      DBU  13 -16.050  -4.594  10.712
   75    HG2  DBU  13           1HG      DBU  13 -15.459  -2.970  11.020
   76    HG3  DBU  13           2HG      DBU  13 -14.322  -4.247  10.580
   77    H    ALA  14           H        ALA  14 -15.515  -0.094   7.540
   78    HA   ALA  14           HA       ALA  14 -16.419  -0.854   4.977
   79    HB1  ALA  14           1HB      ALA  14 -15.575   1.767   6.168
   80    HB2  ALA  14           2HB      ALA  14 -16.045   1.630   4.473
   81    HB3  ALA  14           3HB      ALA  14 -17.194   1.212   5.743
   82    H    GLY  15           H        GLY  15 -13.296   0.389   6.124
   83    HA2  GLY  15           2HA      GLY  15 -12.095   0.465   3.542
   84    HA3  GLY  15           3HA      GLY  15 -11.250   0.541   5.082
   85    H    VAL  16           H        VAL  16 -11.868  -1.858   6.228
   86    HA   VAL  16           HA       VAL  16 -10.017  -3.606   5.190
   87    HB   VAL  16           HB       VAL  16 -12.466  -4.205   6.846
   88   HG11  VAL  16          1HG1      VAL  16 -10.286  -6.004   5.868
   89   HG12  VAL  16          2HG1      VAL  16 -11.058  -6.305   7.425
   90   HG13  VAL  16          3HG1      VAL  16 -12.023  -6.294   5.949
   91   HG21  VAL  16          3HG2      VAL  16 -10.947  -4.236   8.706
   92   HG22  VAL  16          1HG2      VAL  16  -9.560  -4.048   7.632
   93   HG23  VAL  16          2HG2      VAL  16 -10.715  -2.728   7.821
   94    H1   DBU  17           H        DBU  17 -13.486  -3.581   4.645
   95    HB1  DBU  17           HB       DBU  17 -15.284  -6.070   2.440
   96    HG1  DBU  17           3HG      DBU  17 -16.154  -5.099   4.782
   97    HG2  DBU  17           1HG      DBU  17 -14.500  -5.303   5.332
   98    HG3  DBU  17           2HG      DBU  17 -15.455  -6.718   4.882
   99    H    VAL  18           H        VAL  18 -12.725  -2.759   1.886
  100    HA   VAL  18           HA       VAL  18 -12.955  -3.591  -0.831
  101    HB   VAL  18           HB       VAL  18 -11.587  -1.249   0.476
  102   HG11  VAL  18          1HG1      VAL  18 -11.847  -0.845  -2.321
  103   HG12  VAL  18          2HG1      VAL  18 -10.378  -0.865  -1.344
  104   HG13  VAL  18          3HG1      VAL  18 -10.980  -2.358  -2.065
  105   HG21  VAL  18          3HG2      VAL  18 -14.191  -1.774  -0.799
  106   HG22  VAL  18          1HG2      VAL  18 -13.757  -0.630   0.471
  107   HG23  VAL  18          2HG2      VAL  18 -13.430  -0.240  -1.217
  108    H    DAL  19           H        DAL  19 -10.239  -3.275   1.427
  109    HA   DAL  19           HA       DAL  19  -8.153  -4.162   1.422
  110    HB2  DAL  19           2HB      DAL  19  -7.919  -2.634  -0.513
  111    HB3  DAL  19           3HB      DAL  19  -8.406  -3.946  -1.585
  112    H    ALA  20           H        ALA  20  -9.938  -6.058   1.878
  113    HA   ALA  20           HA       ALA  20  -8.670  -8.432   1.046
  114    HB1  ALA  20           1HB      ALA  20  -9.832  -8.298   3.165
  115    HB2  ALA  20           2HB      ALA  20 -11.368  -8.041   2.336
  116    HB3  ALA  20           3HB      ALA  20 -10.529  -9.584   2.178
  117    H    SER  21           H        SER  21 -10.597  -6.449  -0.723
  118    HA   SER  21           HA       SER  21 -12.108  -8.489  -2.122
  119    HB2  SER  21           2HB      SER  21 -12.377  -5.713  -1.761
  120    HB3  SER  21           3HB      SER  21 -12.054  -5.940  -3.479
  121    HG   SER  21           HG       SER  21 -14.309  -6.423  -2.115
  122    H    LEU  22           H        LEU  22  -9.437  -6.261  -2.841
  123    HA   LEU  22           HA       LEU  22  -8.732  -7.988  -5.122
  124    HB2  LEU  22           2HB      LEU  22  -7.971  -5.100  -4.999
  125    HB3  LEU  22           3HB      LEU  22  -8.102  -6.158  -6.402
  126    HG   LEU  22           HG       LEU  22 -10.385  -4.964  -4.831
  127   HD11  LEU  22          1HD1      LEU  22 -10.819  -3.961  -7.156
  128   HD12  LEU  22          2HD1      LEU  22  -9.134  -4.362  -7.487
  129   HD13  LEU  22          3HD1      LEU  22  -9.536  -3.260  -6.170
  130   HD21  LEU  22          3HD2      LEU  22 -11.791  -6.398  -5.794
  131   HD22  LEU  22          1HD2      LEU  22 -10.374  -7.363  -6.208
  132   HD23  LEU  22          2HD2      LEU  22 -11.025  -6.208  -7.372
  133    H    CYS  23           H        CYS  23  -7.428  -5.694  -2.736
  134    HA   CYS  23           HA       CYS  23  -4.815  -5.753  -2.894
  135    HB2  CYS  23           2HB      CYS  23  -6.254  -6.580  -0.363
  136    HB3  CYS  23           3HB      CYS  23  -4.614  -5.946  -0.447
  137    HA   PRO  24           HA       PRO  24  -3.388  -9.850  -3.802
  138    HB2  PRO  24           2HB      PRO  24  -0.950  -8.754  -2.477
  139    HB3  PRO  24           3HB      PRO  24  -1.111  -9.580  -4.031
  140    HG2  PRO  24           2HG      PRO  24  -0.794  -6.922  -3.888
  141    HG3  PRO  24           3HG      PRO  24  -1.821  -7.673  -5.124
  142    HD2  PRO  24           2HD      PRO  24  -2.574  -6.152  -2.706
  143    HD3  PRO  24           3HD      PRO  24  -3.426  -6.325  -4.254
  144    HN2  DB2  25           H        DB2  25  -3.522 -11.675  -2.667
  145    HA   DB2  25           HA       DB2  25  -2.738 -11.717   0.151
  146   HB2C  DB2  25          HB        DB2  25  -3.056 -13.722  -1.987
  147   HG1C  DB2  25          3HG       DB2  25  -1.171 -13.200   0.298
  148   HG2C  DB2  25          1HG       DB2  25  -0.869 -13.089  -1.437
  149   HG3C  DB2  25          2HG       DB2  25  -1.074 -14.666  -0.677
  150    H1   DBU  26           H        DBU  26  -5.401 -10.990  -1.507
  151    HB1  DBU  26           HB       DBU  26  -8.466 -10.360   0.776
  152    HG1  DBU  26           3HG      DBU  26  -6.718  -8.805   1.633
  153    HG2  DBU  26           1HG      DBU  26  -6.676  -8.474  -0.090
  154    HG3  DBU  26           2HG      DBU  26  -5.497  -9.580   0.618
  155    H    LYS  27           H        LYS  27  -6.761 -13.211  -2.045
  156    HA   LYS  27           HA       LYS  27  -9.227 -14.616  -1.249
  157    HB2  LYS  27           2HB      LYS  27  -9.639 -15.161  -3.542
  158    HB3  LYS  27           3HB      LYS  27  -9.338 -13.430  -3.456
  159    HG2  LYS  27           2HG      LYS  27  -7.854 -13.704  -5.077
  160    HG3  LYS  27           3HG      LYS  27  -6.837 -14.552  -3.910
  161    HD2  LYS  27           2HD      LYS  27  -7.120 -15.921  -5.881
  162    HD3  LYS  27           3HD      LYS  27  -7.964 -16.667  -4.521
  163    HE2  LYS  27           2HE      LYS  27  -9.634 -16.835  -6.036
  164    HE3  LYS  27           3HE      LYS  27  -9.958 -15.181  -5.520
  165    HZ1  LYS  27           3HZ      LYS  27  -8.109 -15.685  -7.755
  166    HZ2  LYS  27           1HZ      LYS  27  -9.044 -14.313  -7.430
  167    HZ3  LYS  27           2HZ      LYS  27  -9.779 -15.716  -8.023
  168    H    CYS  28           H        CYS  28  -6.103 -14.887  -0.856
  169    HA   CYS  28           HA       CYS  28  -5.685 -17.583  -1.840
  170    HB2  CYS  28           2HB      CYS  28  -3.489 -17.260  -0.472
  171    HB3  CYS  28           3HB      CYS  28  -3.712 -16.362  -1.971
  172    HN2  DB2  29           H        DB2  29  -7.680 -18.151  -0.474
  173    HA   DB2  29           HA       DB2  29  -6.714 -19.168   2.114
  174   HB2C  DB2  29          HB        DB2  29  -7.645 -20.659   0.186
  175   HG1C  DB2  29          3HG       DB2  29  -8.665 -22.139   2.082
  176   HG2C  DB2  29          1HG       DB2  29  -8.106 -20.836   3.134
  177   HG3C  DB2  29          2HG       DB2  29  -6.955 -21.709   2.124
  178    H    SER  30           H        SER  30  -7.798 -16.449   1.554
  179    HA   SER  30           HA       SER  30  -9.387 -16.220   3.888
  180    HB2  SER  30           2HB      SER  30  -8.625 -14.123   3.689
  181    HB3  SER  30           3HB      SER  30  -8.078 -14.448   2.044
  182    HG   SER  30           HG       SER  30 -10.726 -13.729   2.775
  183    H    ARG  31           H        ARG  31 -10.214 -15.533   0.483
  184    HA   ARG  31           HA       ARG  31 -13.013 -16.180   1.142
  185    HB2  ARG  31           2HB      ARG  31 -12.795 -13.817   0.646
  186    HB3  ARG  31           3HB      ARG  31 -11.939 -14.176  -0.847
  187    HG2  ARG  31           2HG      ARG  31 -14.432 -15.541  -0.895
  188    HG3  ARG  31           3HG      ARG  31 -14.716 -13.859  -0.442
  189    HD2  ARG  31           2HD      ARG  31 -13.522 -13.094  -2.401
  190    HD3  ARG  31           3HD      ARG  31 -13.100 -14.752  -2.826
  191    HE   ARG  31           HE       ARG  31 -15.766 -14.872  -2.805
  192   HH11  ARG  31          1HH1      ARG  31 -13.585 -12.562  -4.229
  193   HH12  ARG  31          2HH1      ARG  31 -14.650 -12.166  -5.537
  194   HH21  ARG  31          1HH2      ARG  31 -17.177 -14.360  -4.523
  195   HH22  ARG  31          2HH2      ARG  31 -16.694 -13.189  -5.702
  196    H    CYS  32           H        CYS  32 -11.270 -18.196   0.423
  197    HA   CYS  32           HA       CYS  32 -11.535 -18.699  -2.417
  198    HB2  CYS  32           2HB      CYS  32 -10.535 -20.991  -1.605
  199    HB3  CYS  32           3HB      CYS  32  -9.521 -19.553  -1.676
  Start of MODEL    8
    1    H41  2KT   1           2H4      2KT   1  -9.775   4.502  25.509
    2    H42  2KT   1           3H4      2KT   1  -9.751   5.712  24.622
    3    H43  2KT   1           1H4      2KT   1  -9.535   5.860  26.099
    4    H31  2KT   1           2H3      2KT   1 -11.425   5.603  26.646
    5    H32  2KT   1           3H3      2KT   1 -11.620   6.540  25.490
    6    H1   DBU   2           H        DBU   2 -11.630   4.802  22.681
    7    HB1  DBU   2           HB       DBU   2 -14.393   7.079  20.901
    8    HG1  DBU   2           3HG      DBU   2 -12.182   7.461  22.964
    9    HG2  DBU   2           1HG      DBU   2 -13.802   7.806  23.545
   10    HG3  DBU   2           2HG      DBU   2 -13.138   8.735  22.198
   11    HA   PRO   3           HA       PRO   3 -15.465   2.231  20.182
   12    HB2  PRO   3           2HB      PRO   3 -18.082   2.931  20.001
   13    HB3  PRO   3           3HB      PRO   3 -17.361   2.280  21.478
   14    HG2  PRO   3           2HG      PRO   3 -17.944   5.125  20.749
   15    HG3  PRO   3           3HG      PRO   3 -18.207   4.288  22.291
   16    HD2  PRO   3           2HD      PRO   3 -16.088   5.918  21.861
   17    HD3  PRO   3           3HD      PRO   3 -16.002   4.501  22.926
   18    H    ALA   4           H        ALA   4 -14.077   3.834  18.558
   19    HA   ALA   4           HA       ALA   4 -13.912   4.116  16.272
   20    HB1  ALA   4           1HB      ALA   4 -15.500   3.300  14.915
   21    HB2  ALA   4           2HB      ALA   4 -16.239   2.716  16.406
   22    HB3  ALA   4           3HB      ALA   4 -16.782   4.232  15.688
   23    H1   DBU   5           H        DBU   5 -16.947   5.624  17.264
   24    HB1  DBU   5           HB       DBU   5 -17.061   9.412  17.847
   25    HG1  DBU   5           3HG      DBU   5 -17.650   7.079  19.419
   26    HG2  DBU   5           1HG      DBU   5 -16.749   8.446  20.053
   27    HG3  DBU   5           2HG      DBU   5 -15.886   7.084  19.335
   28    H1   DBU   6           H        DBU   6 -18.584   7.845  15.369
   29    HB1  DBU   6           HB       DBU   6 -18.619  10.347  12.398
   30    HG1  DBU   6           3HG      DBU   6 -18.594  10.325  15.488
   31    HG2  DBU   6           1HG      DBU   6 -20.082  10.701  14.635
   32    HG3  DBU   6           2HG      DBU   6 -18.686  11.771  14.477
   33    H    DAL   7           H        DAL   7 -18.655   6.409  12.976
   34    HA   DAL   7           HA       DAL   7 -16.542   6.012  11.031
   35    HB2  DAL   7           2HB      DAL   7 -18.684   7.081   9.964
   36    HB3  DAL   7           3HB      DAL   7 -19.329   5.445  10.093
   37    H    DHA   8           H        DHA   8 -19.509   4.724  12.379
   38    HB1  DHA   8           2HB      DHA   8 -19.474   3.342  14.702
   39    HB2  DHA   8           3HB      DHA   8 -19.514   1.507  14.373
   40    H    TRP   9           H        TRP   9 -20.594   0.813  12.607
   41    HA   TRP   9           HA       TRP   9 -19.079  -1.008  11.165
   42    HB2  TRP   9           2HB      TRP   9 -22.055  -0.590  11.373
   43    HB3  TRP   9           3HB      TRP   9 -21.370  -1.900  10.415
   44    HD1  TRP   9           HD1      TRP   9 -22.818  -1.453  13.645
   45    HE1  TRP   9           HE1      TRP   9 -21.968  -3.179  15.355
   46    HE3  TRP   9           HE3      TRP   9 -18.699  -3.130  11.125
   47    HZ2  TRP   9           HZ2      TRP   9 -19.833  -5.009  15.603
   48    HZ3  TRP   9           HZ3      TRP   9 -17.305  -4.869  12.168
   49    HH2  TRP   9           HH2      TRP   9 -17.862  -5.787  14.361
   50    H    THR  10           H        THR  10 -21.369   1.424   9.951
   51    HA   THR  10           HA       THR  10 -21.438   0.907   7.292
   52    HB   THR  10           HB       THR  10 -21.050   3.674   8.448
   53    HG1  THR  10           HG1      THR  10 -23.109   3.588   9.028
   54   HG21  THR  10          3HG2      THR  10 -22.733   3.108   6.063
   55   HG22  THR  10          1HG2      THR  10 -20.983   3.111   5.855
   56   HG23  THR  10          2HG2      THR  10 -21.800   4.547   6.471
   57    H    CYS  11           H        CYS  11 -19.061   3.195   8.657
   58    HA   CYS  11           HA       CYS  11 -17.458   3.403   6.403
   59    HB2  CYS  11           2HB      CYS  11 -16.580   3.575   9.294
   60    HB3  CYS  11           3HB      CYS  11 -15.704   4.221   7.910
   61    H    ILE  12           H        ILE  12 -17.416   1.010   8.980
   62    HA   ILE  12           HA       ILE  12 -14.973  -0.225   8.340
   63    HB   ILE  12           HB       ILE  12 -17.414  -1.090   9.825
   64   HG12  ILE  12          2HG1      ILE  12 -14.485  -1.025  10.580
   65   HG13  ILE  12          3HG1      ILE  12 -15.616   0.293  10.868
   66   HG21  ILE  12          1HG2      ILE  12 -17.087  -3.175   8.985
   67   HG22  ILE  12          2HG2      ILE  12 -15.389  -2.880   8.615
   68   HG23  ILE  12          3HG2      ILE  12 -15.884  -3.222  10.273
   69   HD11  ILE  12          3HD1      ILE  12 -16.089  -0.625  12.819
   70   HD12  ILE  12          1HD1      ILE  12 -16.807  -1.988  11.962
   71   HD13  ILE  12          2HD1      ILE  12 -15.110  -2.041  12.439
   72    H1   DBU  13           H        DBU  13 -18.186  -1.552   7.744
   73    HB1  DBU  13           HB       DBU  13 -18.751  -4.401   5.328
   74    HG1  DBU  13           3HG      DBU  13 -19.568  -4.910   7.591
   75    HG2  DBU  13           1HG      DBU  13 -18.964  -3.375   8.193
   76    HG3  DBU  13           2HG      DBU  13 -17.849  -4.723   7.955
   77    H    ALA  14           H        ALA  14 -18.197  -0.246   5.050
   78    HA   ALA  14           HA       ALA  14 -18.267  -0.812   2.284
   79    HB1  ALA  14           1HB      ALA  14 -19.320   1.169   2.901
   80    HB2  ALA  14           2HB      ALA  14 -17.949   1.710   3.871
   81    HB3  ALA  14           3HB      ALA  14 -17.841   1.719   2.111
   82    H    GLY  15           H        GLY  15 -15.684   0.372   4.411
   83    HA2  GLY  15           2HA      GLY  15 -13.769   0.672   2.316
   84    HA3  GLY  15           3HA      GLY  15 -13.429   0.660   4.040
   85    H    VAL  16           H        VAL  16 -14.268  -1.829   4.796
   86    HA   VAL  16           HA       VAL  16 -12.115  -3.457   4.270
   87    HB   VAL  16           HB       VAL  16 -14.924  -4.236   5.049
   88   HG11  VAL  16          1HG1      VAL  16 -13.830  -6.149   4.017
   89   HG12  VAL  16          2HG1      VAL  16 -12.427  -5.930   5.065
   90   HG13  VAL  16          3HG1      VAL  16 -13.985  -6.386   5.757
   91   HG21  VAL  16          3HG2      VAL  16 -12.777  -4.542   6.992
   92   HG22  VAL  16          1HG2      VAL  16 -12.986  -2.876   6.452
   93   HG23  VAL  16          2HG2      VAL  16 -14.346  -3.753   7.154
   94    H1   DBU  17           H        DBU  17 -15.253  -3.471   2.691
   95    HB1  DBU  17           HB       DBU  17 -16.189  -5.830  -0.108
   96    HG1  DBU  17           3HG      DBU  17 -16.255  -5.673   2.924
   97    HG2  DBU  17           1HG      DBU  17 -17.415  -6.503   1.901
   98    HG3  DBU  17           2HG      DBU  17 -17.537  -4.756   2.125
   99    H    VAL  18           H        VAL  18 -13.714  -2.443   0.352
  100    HA   VAL  18           HA       VAL  18 -13.057  -3.106  -2.345
  101    HB   VAL  18           HB       VAL  18 -12.275  -0.808  -0.563
  102   HG11  VAL  18          1HG1      VAL  18 -11.705  -0.273  -3.307
  103   HG12  VAL  18          2HG1      VAL  18 -10.615  -0.233  -1.919
  104   HG13  VAL  18          3HG1      VAL  18 -10.846  -1.734  -2.816
  105   HG21  VAL  18          3HG2      VAL  18 -13.569   0.223  -2.713
  106   HG22  VAL  18          1HG2      VAL  18 -14.360  -1.346  -2.562
  107   HG23  VAL  18          2HG2      VAL  18 -14.355  -0.226  -1.199
  108    H    DAL  19           H        DAL  19 -11.147  -2.742   0.630
  109    HA   DAL  19           HA       DAL  19  -9.139  -3.600   1.245
  110    HB2  DAL  19           2HB      DAL  19  -8.436  -1.924  -0.464
  111    HB3  DAL  19           3HB      DAL  19  -8.425  -3.212  -1.667
  112    H    ALA  20           H        ALA  20 -10.910  -5.578   0.944
  113    HA   ALA  20           HA       ALA  20  -9.317  -7.851   0.491
  114    HB1  ALA  20           1HB      ALA  20 -11.428  -9.121   0.759
  115    HB2  ALA  20           2HB      ALA  20 -11.159  -7.934   2.036
  116    HB3  ALA  20           3HB      ALA  20 -12.310  -7.594   0.744
  117    H    SER  21           H        SER  21 -10.578  -5.798  -1.746
  118    HA   SER  21           HA       SER  21 -11.364  -7.769  -3.717
  119    HB2  SER  21           2HB      SER  21 -10.913  -4.824  -4.201
  120    HB3  SER  21           3HB      SER  21 -11.935  -5.932  -5.117
  121    HG   SER  21           HG       SER  21 -13.485  -5.456  -3.799
  122    H    LEU  22           H        LEU  22  -8.736  -5.411  -3.310
  123    HA   LEU  22           HA       LEU  22  -7.156  -6.980  -5.241
  124    HB2  LEU  22           2HB      LEU  22  -6.656  -4.077  -4.720
  125    HB3  LEU  22           3HB      LEU  22  -6.192  -5.053  -6.113
  126    HG   LEU  22           HG       LEU  22  -8.898  -3.904  -5.467
  127   HD11  LEU  22          1HD1      LEU  22  -6.807  -3.464  -7.552
  128   HD12  LEU  22          2HD1      LEU  22  -7.717  -2.287  -6.605
  129   HD13  LEU  22          3HD1      LEU  22  -8.502  -3.150  -7.927
  130   HD21  LEU  22          3HD2      LEU  22  -9.056  -5.163  -7.936
  131   HD22  LEU  22          1HD2      LEU  22  -9.825  -5.680  -6.435
  132   HD23  LEU  22          2HD2      LEU  22  -8.254  -6.338  -6.893
  133    H    CYS  23           H        CYS  23  -6.934  -4.792  -2.445
  134    HA   CYS  23           HA       CYS  23  -4.427  -4.779  -1.653
  135    HB2  CYS  23           2HB      CYS  23  -6.636  -5.735   0.180
  136    HB3  CYS  23           3HB      CYS  23  -5.116  -5.004   0.685
  137    HA   PRO  24           HA       PRO  24  -2.762  -8.878  -2.178
  138    HB2  PRO  24           2HB      PRO  24  -0.787  -7.712  -0.270
  139    HB3  PRO  24           3HB      PRO  24  -0.512  -8.563  -1.795
  140    HG2  PRO  24           2HG      PRO  24  -0.290  -5.898  -1.622
  141    HG3  PRO  24           3HG      PRO  24  -0.935  -6.686  -3.073
  142    HD2  PRO  24           2HD      PRO  24  -2.334  -5.149  -0.973
  143    HD3  PRO  24           3HD      PRO  24  -2.737  -5.362  -2.689
  144    HN2  DB2  25           H        DB2  25  -2.894 -10.733  -1.034
  145    HA   DB2  25           HA       DB2  25  -3.078 -10.648   1.880
  146   HB2C  DB2  25          HB        DB2  25  -2.932 -12.952  -0.056
  147   HG1C  DB2  25          3HG       DB2  25  -0.672 -13.015   0.313
  148   HG2C  DB2  25          1HG       DB2  25  -0.805 -12.317   1.929
  149   HG3C  DB2  25          2HG       DB2  25  -0.958 -11.286   0.508
  150    H1   DBU  26           H        DBU  26  -5.163  -9.995  -0.340
  151    HB1  DBU  26           HB       DBU  26  -8.836  -9.766   0.615
  152    HG1  DBU  26           3HG      DBU  26  -7.511  -7.933   1.776
  153    HG2  DBU  26           1HG      DBU  26  -7.259  -7.681   0.057
  154    HG3  DBU  26           2HG      DBU  26  -6.032  -8.521   1.009
  155    H    LYS  27           H        LYS  27  -5.864 -12.850  -0.482
  156    HA   LYS  27           HA       LYS  27  -8.366 -14.404  -0.534
  157    HB2  LYS  27           2HB      LYS  27  -8.052 -14.429  -2.771
  158    HB3  LYS  27           3HB      LYS  27  -6.365 -13.953  -2.637
  159    HG2  LYS  27           2HG      LYS  27  -6.375 -16.095  -3.613
  160    HG3  LYS  27           3HG      LYS  27  -5.872 -16.323  -1.936
  161    HD2  LYS  27           2HD      LYS  27  -8.468 -16.674  -1.578
  162    HD3  LYS  27           3HD      LYS  27  -8.406 -17.104  -3.289
  163    HE2  LYS  27           2HE      LYS  27  -6.283 -18.490  -2.308
  164    HE3  LYS  27           3HE      LYS  27  -7.389 -18.538  -0.936
  165    HZ1  LYS  27           3HZ      LYS  27  -8.537 -19.133  -3.542
  166    HZ2  LYS  27           1HZ      LYS  27  -8.842 -19.841  -2.036
  167    HZ3  LYS  27           2HZ      LYS  27  -7.470 -20.288  -2.918
  168    H    CYS  28           H        CYS  28  -5.275 -14.096   0.716
  169    HA   CYS  28           HA       CYS  28  -4.770 -16.928   1.070
  170    HB2  CYS  28           2HB      CYS  28  -2.814 -16.079   2.439
  171    HB3  CYS  28           3HB      CYS  28  -2.821 -15.603   0.744
  172    HN2  DB2  29           H        DB2  29  -7.039 -16.906   2.139
  173    HA   DB2  29           HA       DB2  29  -6.587 -16.929   5.029
  174   HB2C  DB2  29          HB        DB2  29  -7.601 -18.849   3.579
  175   HG1C  DB2  29          3HG       DB2  29  -7.252 -18.641   6.086
  176   HG2C  DB2  29          1HG       DB2  29  -8.513 -19.759   5.557
  177   HG3C  DB2  29          2HG       DB2  29  -8.949 -18.170   6.185
  178    H    SER  30           H        SER  30  -7.207 -14.516   3.252
  179    HA   SER  30           HA       SER  30  -8.745 -13.115   5.154
  180    HB2  SER  30           2HB      SER  30  -7.387 -11.672   3.984
  181    HB3  SER  30           3HB      SER  30  -7.635 -12.510   2.452
  182    HG   SER  30           HG       SER  30  -9.613 -10.952   3.762
  183    H    ARG  31           H        ARG  31  -9.572 -14.737   2.160
  184    HA   ARG  31           HA       ARG  31 -12.410 -14.286   2.772
  185    HB2  ARG  31           2HB      ARG  31 -12.261 -12.825   0.999
  186    HB3  ARG  31           3HB      ARG  31 -10.957 -13.721   0.232
  187    HG2  ARG  31           2HG      ARG  31 -12.459 -15.349  -0.619
  188    HG3  ARG  31           3HG      ARG  31 -13.788 -14.721   0.358
  189    HD2  ARG  31           2HD      ARG  31 -14.253 -13.807  -1.707
  190    HD3  ARG  31           3HD      ARG  31 -13.336 -12.511  -0.941
  191    HE   ARG  31           HE       ARG  31 -11.510 -14.093  -2.297
  192   HH11  ARG  31          1HH1      ARG  31 -14.262 -12.101  -3.056
  193   HH12  ARG  31          2HH1      ARG  31 -13.684 -11.676  -4.633
  194   HH21  ARG  31          1HH2      ARG  31 -10.738 -13.540  -4.371
  195   HH22  ARG  31          2HH2      ARG  31 -11.679 -12.496  -5.380
  196    H    CYS  32           H        CYS  32 -10.037 -16.199   0.962
  197    HA   CYS  32           HA       CYS  32 -10.235 -18.314   0.039
  198    HB2  CYS  32           2HB      CYS  32 -11.196 -19.576   2.436
  199    HB3  CYS  32           3HB      CYS  32  -9.572 -19.584   1.756
  Start of MODEL    9
    1    H41  2KT   1           2H4      2KT   1 -21.060   1.482  13.832
    2    H42  2KT   1           3H4      2KT   1 -20.761   0.022  13.666
    3    H43  2KT   1           1H4      2KT   1 -22.135   0.464  14.075
    4    H31  2KT   1           2H3      2KT   1 -20.147  -0.156  15.464
    5    H32  2KT   1           3H3      2KT   1 -20.206   1.322  15.717
    6    H1   DBU   2           H        DBU   2 -20.543   1.322  18.243
    7    HB1  DBU   2           HB       DBU   2 -23.124   3.362  20.534
    8    HG1  DBU   2           3HG      DBU   2 -24.042   1.072  19.015
    9    HG2  DBU   2           1HG      DBU   2 -24.119   1.166  20.767
   10    HG3  DBU   2           2HG      DBU   2 -22.700   0.460  19.988
   11    HA   PRO   3           HA       PRO   3 -20.284   6.547  19.981
   12    HB2  PRO   3           2HB      PRO   3 -18.028   6.160  21.441
   13    HB3  PRO   3           3HB      PRO   3 -19.646   6.150  22.152
   14    HG2  PRO   3           2HG      PRO   3 -17.912   3.842  21.360
   15    HG3  PRO   3           3HG      PRO   3 -18.898   4.052  22.819
   16    HD2  PRO   3           2HD      PRO   3 -19.710   2.555  20.713
   17    HD3  PRO   3           3HD      PRO   3 -20.846   3.454  21.740
   18    H    ALA   4           H        ALA   4 -19.847   5.581  17.530
   19    HA   ALA   4           HA       ALA   4 -17.012   5.461  16.945
   20    HB1  ALA   4           1HB      ALA   4 -17.736   5.184  14.611
   21    HB2  ALA   4           2HB      ALA   4 -18.513   4.029  15.694
   22    HB3  ALA   4           3HB      ALA   4 -19.408   5.434  15.114
   23    H1   DBU   5           H        DBU   5 -16.945   7.682  18.006
   24    HB1  DBU   5           HB       DBU   5 -16.976  11.394  17.662
   25    HG1  DBU   5           3HG      DBU   5 -16.831   9.065  19.538
   26    HG2  DBU   5           1HG      DBU   5 -18.500   9.546  19.281
   27    HG3  DBU   5           2HG      DBU   5 -17.347  10.704  19.949
   28    H1   DBU   6           H        DBU   6 -14.743   9.883  15.981
   29    HB1  DBU   6           HB       DBU   6 -14.864  12.163  12.704
   30    HG1  DBU   6           3HG      DBU   6 -16.931  12.632  14.542
   31    HG2  DBU   6           1HG      DBU   6 -15.571  13.739  14.448
   32    HG3  DBU   6           2HG      DBU   6 -15.568  12.447  15.652
   33    H    DAL   7           H        DAL   7 -15.030   8.007  14.043
   34    HA   DAL   7           HA       DAL   7 -12.899   7.660  12.108
   35    HB2  DAL   7           2HB      DAL   7 -15.248   7.842  10.969
   36    HB3  DAL   7           3HB      DAL   7 -15.452   6.193  11.558
   37    H    DHA   8           H        DHA   8 -15.512   5.685  13.383
   38    HB1  DHA   8           2HB      DHA   8 -13.977   5.158  16.135
   39    HB2  DHA   8           3HB      DHA   8 -14.032   3.296  16.220
   40    H    TRP   9           H        TRP   9 -16.272   2.553  15.035
   41    HA   TRP   9           HA       TRP   9 -15.392   0.256  13.726
   42    HB2  TRP   9           2HB      TRP   9 -18.055   1.191  14.723
   43    HB3  TRP   9           3HB      TRP   9 -17.968  -0.276  13.753
   44    HD1  TRP   9           HD1      TRP   9 -18.277   0.478  17.166
   45    HE1  TRP   9           HE1      TRP   9 -17.119  -1.232  18.703
   46    HE3  TRP   9           HE3      TRP   9 -15.230  -1.769  13.730
   47    HZ2  TRP   9           HZ2      TRP   9 -15.172  -3.264  18.487
   48    HZ3  TRP   9           HZ3      TRP   9 -13.750  -3.587  14.477
   49    HH2  TRP   9           HH2      TRP   9 -13.722  -4.317  16.806
   50    H    THR  10           H        THR  10 -17.335   2.945  12.565
   51    HA   THR  10           HA       THR  10 -18.219   1.810  10.154
   52    HB   THR  10           HB       THR  10 -17.646   4.710  10.792
   53    HG1  THR  10           HG1      THR  10 -20.015   3.129  10.912
   54   HG21  THR  10          3HG2      THR  10 -19.360   5.067   8.934
   55   HG22  THR  10          1HG2      THR  10 -19.036   3.398   8.469
   56   HG23  THR  10          2HG2      THR  10 -17.736   4.590   8.440
   57    H    CYS  11           H        CYS  11 -15.480   4.035  10.703
   58    HA   CYS  11           HA       CYS  11 -14.439   3.995   8.134
   59    HB2  CYS  11           2HB      CYS  11 -13.003   4.279  10.780
   60    HB3  CYS  11           3HB      CYS  11 -12.266   4.609   9.216
   61    H    ILE  12           H        ILE  12 -13.975   1.726  10.783
   62    HA   ILE  12           HA       ILE  12 -11.862   0.243   9.671
   63    HB   ILE  12           HB       ILE  12 -13.994  -0.449  11.672
   64   HG12  ILE  12          2HG1      ILE  12 -10.993  -0.108  11.859
   65   HG13  ILE  12          3HG1      ILE  12 -12.201   1.056  12.392
   66   HG21  ILE  12          1HG2      ILE  12 -13.608  -2.530  10.610
   67   HG22  ILE  12          2HG2      ILE  12 -11.869  -2.250  10.538
   68   HG23  ILE  12          3HG2      ILE  12 -12.651  -2.543  12.091
   69   HD11  ILE  12          3HD1      ILE  12 -11.636   0.050  14.365
   70   HD12  ILE  12          1HD1      ILE  12 -13.023  -0.924  13.878
   71   HD13  ILE  12          2HD1      ILE  12 -11.386  -1.527  13.618
   72    H1   DBU  13           H        DBU  13 -15.182  -0.893   9.982
   73    HB1  DBU  13           HB       DBU  13 -16.525  -3.765   7.942
   74    HG1  DBU  13           3HG      DBU  13 -15.733  -2.613  10.688
   75    HG2  DBU  13           1HG      DBU  13 -15.158  -4.215  10.258
   76    HG3  DBU  13           2HG      DBU  13 -16.892  -3.917  10.408
   77    H    ALA  14           H        ALA  14 -15.768   0.317   7.279
   78    HA   ALA  14           HA       ALA  14 -16.561  -0.359   4.654
   79    HB1  ALA  14           1HB      ALA  14 -17.216   1.748   5.587
   80    HB2  ALA  14           2HB      ALA  14 -15.533   2.233   5.798
   81    HB3  ALA  14           3HB      ALA  14 -16.204   2.058   4.176
   82    H    GLY  15           H        GLY  15 -13.451   0.698   6.004
   83    HA2  GLY  15           2HA      GLY  15 -12.096   0.744   3.498
   84    HA3  GLY  15           3HA      GLY  15 -11.342   0.756   5.085
   85    H    VAL  16           H        VAL  16 -12.147  -1.620   6.157
   86    HA   VAL  16           HA       VAL  16 -10.333  -3.451   5.199
   87    HB   VAL  16           HB       VAL  16 -12.901  -3.945   6.702
   88   HG11  VAL  16          1HG1      VAL  16 -10.859  -5.830   5.678
   89   HG12  VAL  16          2HG1      VAL  16 -11.448  -6.092   7.322
   90   HG13  VAL  16          3HG1      VAL  16 -12.582  -6.071   5.971
   91   HG21  VAL  16          3HG2      VAL  16 -11.758  -3.495   8.576
   92   HG22  VAL  16          1HG2      VAL  16 -10.329  -4.368   8.023
   93   HG23  VAL  16          2HG2      VAL  16 -10.600  -2.703   7.508
   94    H1   DBU  17           H        DBU  17 -13.760  -3.236   4.460
   95    HB1  DBU  17           HB       DBU  17 -15.556  -5.600   2.121
   96    HG1  DBU  17           3HG      DBU  17 -15.898  -6.262   4.548
   97    HG2  DBU  17           1HG      DBU  17 -16.515  -4.623   4.421
   98    HG3  DBU  17           2HG      DBU  17 -14.893  -4.902   5.059
   99    H    VAL  18           H        VAL  18 -12.799  -2.424   1.761
  100    HA   VAL  18           HA       VAL  18 -12.916  -3.211  -0.977
  101    HB   VAL  18           HB       VAL  18 -11.504  -0.961   0.439
  102   HG11  VAL  18          1HG1      VAL  18 -10.173  -0.623  -1.304
  103   HG12  VAL  18          2HG1      VAL  18 -10.814  -2.072  -2.082
  104   HG13  VAL  18          3HG1      VAL  18 -11.580  -0.507  -2.360
  105   HG21  VAL  18          3HG2      VAL  18 -14.052  -1.329  -0.999
  106   HG22  VAL  18          1HG2      VAL  18 -13.639  -0.237   0.324
  107   HG23  VAL  18          2HG2      VAL  18 -13.188   0.172  -1.332
  108    H    DAL  19           H        DAL  19 -10.320  -3.066   1.435
  109    HA   DAL  19           HA       DAL  19  -8.288  -4.064   1.535
  110    HB2  DAL  19           2HB      DAL  19  -7.862  -2.528  -0.360
  111    HB3  DAL  19           3HB      DAL  19  -8.357  -3.798  -1.477
  112    H    ALA  20           H        ALA  20 -10.200  -5.866   1.857
  113    HA   ALA  20           HA       ALA  20  -9.012  -8.296   1.065
  114    HB1  ALA  20           1HB      ALA  20 -10.293  -8.116   3.114
  115    HB2  ALA  20           2HB      ALA  20 -11.761  -7.781   2.194
  116    HB3  ALA  20           3HB      ALA  20 -10.985  -9.360   2.074
  117    H    SER  21           H        SER  21 -10.722  -6.191  -0.783
  118    HA   SER  21           HA       SER  21 -12.253  -8.129  -2.300
  119    HB2  SER  21           2HB      SER  21 -12.401  -5.350  -1.910
  120    HB3  SER  21           3HB      SER  21 -11.979  -5.567  -3.609
  121    HG   SER  21           HG       SER  21 -14.241  -5.597  -3.283
  122    H    LEU  22           H        LEU  22  -9.431  -6.038  -2.828
  123    HA   LEU  22           HA       LEU  22  -8.684  -7.773  -5.090
  124    HB2  LEU  22           2HB      LEU  22  -7.774  -4.934  -4.875
  125    HB3  LEU  22           3HB      LEU  22  -7.881  -5.964  -6.301
  126    HG   LEU  22           HG       LEU  22 -10.184  -4.668  -4.844
  127   HD11  LEU  22          1HD1      LEU  22  -8.745  -4.092  -7.407
  128   HD12  LEU  22          2HD1      LEU  22  -9.167  -2.991  -6.096
  129   HD13  LEU  22          3HD1      LEU  22 -10.423  -3.604  -7.171
  130   HD21  LEU  22          3HD2      LEU  22 -10.719  -5.847  -7.446
  131   HD22  LEU  22          1HD2      LEU  22 -11.613  -5.988  -5.933
  132   HD23  LEU  22          2HD2      LEU  22 -10.235  -7.044  -6.244
  133    H    CYS  23           H        CYS  23  -7.402  -5.586  -2.595
  134    HA   CYS  23           HA       CYS  23  -4.790  -5.792  -2.602
  135    HB2  CYS  23           2HB      CYS  23  -6.416  -6.561  -0.168
  136    HB3  CYS  23           3HB      CYS  23  -4.743  -6.011  -0.152
  137    HA   PRO  24           HA       PRO  24  -3.573  -9.965  -3.487
  138    HB2  PRO  24           2HB      PRO  24  -1.132  -9.014  -2.059
  139    HB3  PRO  24           3HB      PRO  24  -1.277  -9.826  -3.622
  140    HG2  PRO  24           2HG      PRO  24  -0.814  -7.192  -3.454
  141    HG3  PRO  24           3HG      PRO  24  -1.831  -7.879  -4.734
  142    HD2  PRO  24           2HD      PRO  24  -2.594  -6.322  -2.342
  143    HD3  PRO  24           3HD      PRO  24  -3.390  -6.444  -3.924
  144    HN2  DB2  25           H        DB2  25  -3.818 -11.794  -2.369
  145    HA   DB2  25           HA       DB2  25  -3.178 -11.873   0.483
  146   HB2C  DB2  25          HB        DB2  25  -3.482 -13.860  -1.675
  147   HG1C  DB2  25          3HG       DB2  25  -1.664 -14.862   0.018
  148   HG2C  DB2  25          1HG       DB2  25  -1.631 -13.174   0.534
  149   HG3C  DB2  25          2HG       DB2  25  -1.290 -13.590  -1.145
  150    H1   DBU  26           H        DBU  26  -5.716 -10.997  -1.275
  151    HB1  DBU  26           HB       DBU  26  -8.865 -10.238   0.831
  152    HG1  DBU  26           3HG      DBU  26  -5.862  -9.553   0.750
  153    HG2  DBU  26           1HG      DBU  26  -7.062  -8.767   1.762
  154    HG3  DBU  26           2HG      DBU  26  -7.010  -8.417   0.033
  155    H    LYS  27           H        LYS  27  -7.303 -13.027  -2.037
  156    HA   LYS  27           HA       LYS  27  -9.835 -14.335  -1.312
  157    HB2  LYS  27           2HB      LYS  27  -9.973 -15.050  -3.634
  158    HB3  LYS  27           3HB      LYS  27  -9.760 -13.306  -3.548
  159    HG2  LYS  27           2HG      LYS  27  -8.261 -13.763  -5.181
  160    HG3  LYS  27           3HG      LYS  27  -7.207 -13.988  -3.783
  161    HD2  LYS  27           2HD      LYS  27  -7.219 -16.284  -3.976
  162    HD3  LYS  27           3HD      LYS  27  -8.769 -16.310  -4.821
  163    HE2  LYS  27           2HE      LYS  27  -7.343 -16.789  -6.550
  164    HE3  LYS  27           3HE      LYS  27  -7.415 -15.031  -6.673
  165    HZ1  LYS  27           3HZ      LYS  27  -5.360 -15.993  -4.900
  166    HZ2  LYS  27           1HZ      LYS  27  -5.273 -14.836  -6.131
  167    HZ3  LYS  27           2HZ      LYS  27  -5.148 -16.480  -6.506
  168    H    CYS  28           H        CYS  28  -6.667 -14.770  -0.818
  169    HA   CYS  28           HA       CYS  28  -6.478 -17.577  -1.509
  170    HB2  CYS  28           2HB      CYS  28  -4.249 -17.365  -0.282
  171    HB3  CYS  28           3HB      CYS  28  -4.440 -16.402  -1.744
  172    HN2  DB2  29           H        DB2  29  -8.551 -17.723  -0.072
  173    HA   DB2  29           HA       DB2  29  -7.670 -18.817   2.494
  174   HB2C  DB2  29          HB        DB2  29  -9.188 -19.985   0.720
  175   HG1C  DB2  29          3HG       DB2  29  -9.927 -20.127   3.642
  176   HG2C  DB2  29          1HG       DB2  29  -8.427 -20.773   2.971
  177   HG3C  DB2  29          2HG       DB2  29  -9.980 -21.425   2.450
  178    H    SER  30           H        SER  30  -8.135 -15.883   1.815
  179    HA   SER  30           HA       SER  30  -9.142 -15.126   4.336
  180    HB2  SER  30           2HB      SER  30  -7.892 -13.379   3.637
  181    HB3  SER  30           3HB      SER  30  -8.134 -13.774   1.936
  182    HG   SER  30           HG       SER  30  -9.496 -12.011   3.550
  183    H    ARG  31           H        ARG  31 -10.642 -15.484   1.196
  184    HA   ARG  31           HA       ARG  31 -13.251 -14.985   2.448
  185    HB2  ARG  31           2HB      ARG  31 -13.125 -13.004   1.285
  186    HB3  ARG  31           3HB      ARG  31 -12.097 -13.682   0.030
  187    HG2  ARG  31           2HG      ARG  31 -14.042 -14.900  -0.868
  188    HG3  ARG  31           3HG      ARG  31 -15.056 -14.129   0.353
  189    HD2  ARG  31           2HD      ARG  31 -14.433 -11.926  -0.555
  190    HD3  ARG  31           3HD      ARG  31 -13.476 -12.728  -1.801
  191    HE   ARG  31           HE       ARG  31 -15.950 -13.810  -2.089
  192   HH11  ARG  31          1HH1      ARG  31 -14.726 -10.553  -2.001
  193   HH12  ARG  31          2HH1      ARG  31 -15.953  -9.924  -3.050
  194   HH21  ARG  31          1HH2      ARG  31 -17.571 -12.995  -3.471
  195   HH22  ARG  31          2HH2      ARG  31 -17.571 -11.314  -3.885
  196    H    CYS  32           H        CYS  32 -11.498 -16.345  -0.315
  197    HA   CYS  32           HA       CYS  32 -12.162 -17.949  -1.846
  198    HB2  CYS  32           2HB      CYS  32 -12.986 -19.882   0.117
  199    HB3  CYS  32           3HB      CYS  32 -11.496 -19.821  -0.819
  Start of MODEL   10
    1    H41  2KT   1           2H4      2KT   1 -25.269   5.422  20.682
    2    H42  2KT   1           3H4      2KT   1 -26.643   5.296  21.271
    3    H43  2KT   1           1H4      2KT   1 -25.910   6.603  21.349
    4    H31  2KT   1           2H3      2KT   1 -26.083   5.241  23.176
    5    H32  2KT   1           3H3      2KT   1 -25.083   4.292  22.586
    6    H1   DBU   2           H        DBU   2 -23.739   7.938  21.649
    7    HB1  DBU   2           HB       DBU   2 -20.483   8.724  20.001
    8    HG1  DBU   2           3HG      DBU   2 -21.581  10.717  20.851
    9    HG2  DBU   2           1HG      DBU   2 -21.743   9.802  22.340
   10    HG3  DBU   2           2HG      DBU   2 -23.050   9.783  21.153
   11    HA   PRO   3           HA       PRO   3 -21.440   3.801  18.759
   12    HB2  PRO   3           2HB      PRO   3 -21.853   4.295  16.121
   13    HB3  PRO   3           3HB      PRO   3 -23.169   3.977  17.257
   14    HG2  PRO   3           2HG      PRO   3 -22.165   6.593  16.206
   15    HG3  PRO   3           3HG      PRO   3 -23.836   6.046  16.432
   16    HD2  PRO   3           2HD      PRO   3 -22.593   7.692  18.186
   17    HD3  PRO   3           3HD      PRO   3 -23.815   6.507  18.690
   18    H    ALA   4           H        ALA   4 -19.263   5.151  19.512
   19    HA   ALA   4           HA       ALA   4 -17.002   5.009  19.063
   20    HB1  ALA   4           1HB      ALA   4 -17.293   4.819  16.131
   21    HB2  ALA   4           2HB      ALA   4 -16.233   3.934  17.229
   22    HB3  ALA   4           3HB      ALA   4 -17.927   3.468  17.073
   23    H1   DBU   5           H        DBU   5 -18.503   6.489  16.230
   24    HB1  DBU   5           HB       DBU   5 -18.488  10.265  15.733
   25    HG1  DBU   5           3HG      DBU   5 -20.211   8.784  17.477
   26    HG2  DBU   5           1HG      DBU   5 -20.257   7.840  15.997
   27    HG3  DBU   5           2HG      DBU   5 -20.784   9.525  15.979
   28    H1   DBU   6           H        DBU   6 -16.896   9.626  14.240
   29    HB1  DBU   6           HB       DBU   6 -13.241  11.171  14.568
   30    HG1  DBU   6           3HG      DBU   6 -14.797  12.767  15.716
   31    HG2  DBU   6           1HG      DBU   6 -14.622  11.473  16.889
   32    HG3  DBU   6           2HG      DBU   6 -16.032  11.510  15.827
   33    H    DAL   7           H        DAL   7 -14.627   7.299  14.320
   34    HA   DAL   7           HA       DAL   7 -12.582   7.231  12.266
   35    HB2  DAL   7           2HB      DAL   7 -15.004   7.186  11.265
   36    HB3  DAL   7           3HB      DAL   7 -14.986   5.507  11.802
   37    H    DHA   8           H        DHA   8 -14.900   4.999  13.688
   38    HB1  DHA   8           2HB      DHA   8 -12.966   4.564  16.232
   39    HB2  DHA   8           3HB      DHA   8 -12.913   2.701  16.299
   40    H    TRP   9           H        TRP   9 -15.438   1.956  15.280
   41    HA   TRP   9           HA       TRP   9 -14.577  -0.336  13.907
   42    HB2  TRP   9           2HB      TRP   9 -16.092  -0.954  15.491
   43    HB3  TRP   9           3HB      TRP   9 -17.045   0.516  15.304
   44    HD1  TRP   9           HD1      TRP   9 -19.181   0.379  13.825
   45    HE1  TRP   9           HE1      TRP   9 -20.326  -1.503  12.494
   46    HE3  TRP   9           HE3      TRP   9 -15.480  -3.141  14.047
   47    HZ2  TRP   9           HZ2      TRP   9 -19.739  -4.132  11.650
   48    HZ3  TRP   9           HZ3      TRP   9 -15.851  -5.314  12.953
   49    HH2  TRP   9           HH2      TRP   9 -17.937  -5.797  11.780
   50    H    THR  10           H        THR  10 -16.482   2.399  12.900
   51    HA   THR  10           HA       THR  10 -17.624   1.233  10.579
   52    HB   THR  10           HB       THR  10 -17.022   4.167  10.927
   53    HG1  THR  10           HG1      THR  10 -19.271   2.714  11.911
   54   HG21  THR  10          3HG2      THR  10 -19.443   2.940   9.653
   55   HG22  THR  10          1HG2      THR  10 -17.944   3.132   8.745
   56   HG23  THR  10          2HG2      THR  10 -18.757   4.546   9.415
   57    H    CYS  11           H        CYS  11 -14.932   3.556  10.909
   58    HA   CYS  11           HA       CYS  11 -14.102   3.542   8.264
   59    HB2  CYS  11           2HB      CYS  11 -12.418   3.871  10.757
   60    HB3  CYS  11           3HB      CYS  11 -11.905   4.300   9.128
   61    H    ILE  12           H        ILE  12 -13.331   1.312  10.874
   62    HA   ILE  12           HA       ILE  12 -11.253  -0.090   9.602
   63    HB   ILE  12           HB       ILE  12 -13.197  -0.878  11.757
   64   HG12  ILE  12          2HG1      ILE  12 -10.220  -0.336  11.730
   65   HG13  ILE  12          3HG1      ILE  12 -11.464   0.736  12.363
   66   HG21  ILE  12          1HG2      ILE  12 -11.147  -2.734  11.832
   67   HG22  ILE  12          2HG2      ILE  12 -12.803  -3.021  11.298
   68   HG23  ILE  12          3HG2      ILE  12 -11.554  -2.616  10.120
   69   HD11  ILE  12          3HD1      ILE  12 -10.673  -0.237  14.276
   70   HD12  ILE  12          1HD1      ILE  12 -12.030  -1.296  13.891
   71   HD13  ILE  12          2HD1      ILE  12 -10.384  -1.793  13.498
   72    H1   DBU  13           H        DBU  13 -14.496  -1.346  10.169
   73    HB1  DBU  13           HB       DBU  13 -15.874  -4.287   8.252
   74    HG1  DBU  13           3HG      DBU  13 -14.181  -4.465  10.485
   75    HG2  DBU  13           1HG      DBU  13 -15.916  -4.653  10.678
   76    HG3  DBU  13           2HG      DBU  13 -15.169  -3.078  10.955
   77    H    ALA  14           H        ALA  14 -15.341  -0.182   7.521
   78    HA   ALA  14           HA       ALA  14 -16.309  -0.904   4.969
   79    HB1  ALA  14           1HB      ALA  14 -15.365   1.707   6.120
   80    HB2  ALA  14           2HB      ALA  14 -15.972   1.560   4.470
   81    HB3  ALA  14           3HB      ALA  14 -17.020   1.169   5.834
   82    H    GLY  15           H        GLY  15 -13.148   0.285   6.066
   83    HA2  GLY  15           2HA      GLY  15 -11.997   0.370   3.461
   84    HA3  GLY  15           3HA      GLY  15 -11.121   0.419   4.983
   85    H    VAL  16           H        VAL  16 -11.733  -1.978   6.122
   86    HA   VAL  16           HA       VAL  16  -9.934  -3.742   5.026
   87    HB   VAL  16           HB       VAL  16 -12.356  -4.334   6.724
   88   HG11  VAL  16          1HG1      VAL  16 -10.411  -6.139   5.468
   89   HG12  VAL  16          2HG1      VAL  16 -10.651  -6.390   7.198
   90   HG13  VAL  16          3HG1      VAL  16 -12.026  -6.467   6.096
   91   HG21  VAL  16          3HG2      VAL  16  -9.549  -3.548   7.240
   92   HG22  VAL  16          1HG2      VAL  16 -11.019  -3.163   8.135
   93   HG23  VAL  16          2HG2      VAL  16 -10.258  -4.743   8.325
   94    H1   DBU  17           H        DBU  17 -13.417  -3.680   4.567
   95    HB1  DBU  17           HB       DBU  17 -15.294  -6.119   2.376
   96    HG1  DBU  17           3HG      DBU  17 -14.603  -5.115   5.226
   97    HG2  DBU  17           1HG      DBU  17 -15.108  -6.769   4.925
   98    HG3  DBU  17           2HG      DBU  17 -16.246  -5.445   4.666
   99    H    VAL  18           H        VAL  18 -12.717  -2.834   1.790
  100    HA   VAL  18           HA       VAL  18 -13.005  -3.653  -0.927
  101    HB   VAL  18           HB       VAL  18 -11.599  -1.321   0.358
  102   HG11  VAL  18          1HG1      VAL  18 -11.051  -2.420  -2.192
  103   HG12  VAL  18          2HG1      VAL  18 -11.946  -0.919  -2.437
  104   HG13  VAL  18          3HG1      VAL  18 -10.453  -0.914  -1.497
  105   HG21  VAL  18          3HG2      VAL  18 -13.764  -0.689   0.419
  106   HG22  VAL  18          1HG2      VAL  18 -13.487  -0.302  -1.280
  107   HG23  VAL  18          2HG2      VAL  18 -14.243  -1.833  -0.836
  108    H    DAL  19           H        DAL  19 -10.208  -3.260   1.230
  109    HA   DAL  19           HA       DAL  19  -8.138  -4.187   1.198
  110    HB2  DAL  19           2HB      DAL  19  -7.994  -2.633  -0.754
  111    HB3  DAL  19           3HB      DAL  19  -8.414  -3.984  -1.805
  112    H    ALA  20           H        ALA  20  -9.940  -6.087   1.646
  113    HA   ALA  20           HA       ALA  20  -8.676  -8.455   0.811
  114    HB1  ALA  20           1HB      ALA  20 -10.581  -9.609   1.879
  115    HB2  ALA  20           2HB      ALA  20  -9.877  -8.355   2.901
  116    HB3  ALA  20           3HB      ALA  20 -11.393  -8.053   2.053
  117    H    SER  21           H        SER  21 -10.566  -6.453  -0.980
  118    HA   SER  21           HA       SER  21 -12.049  -8.474  -2.430
  119    HB2  SER  21           2HB      SER  21 -11.707  -5.585  -3.233
  120    HB3  SER  21           3HB      SER  21 -13.022  -6.683  -3.652
  121    HG   SER  21           HG       SER  21 -13.368  -6.726  -1.256
  122    H    LEU  22           H        LEU  22  -9.368  -6.238  -3.097
  123    HA   LEU  22           HA       LEU  22  -8.602  -7.976  -5.349
  124    HB2  LEU  22           2HB      LEU  22  -7.884  -5.075  -5.229
  125    HB3  LEU  22           3HB      LEU  22  -7.950  -6.146  -6.627
  126    HG   LEU  22           HG       LEU  22 -10.241  -4.842  -5.176
  127   HD11  LEU  22          1HD1      LEU  22 -10.701  -4.249  -7.667
  128   HD12  LEU  22          2HD1      LEU  22  -8.991  -4.622  -7.879
  129   HD13  LEU  22          3HD1      LEU  22  -9.483  -3.350  -6.761
  130   HD21  LEU  22          3HD2      LEU  22 -10.182  -7.374  -6.591
  131   HD22  LEU  22          1HD2      LEU  22 -11.293  -6.220  -7.329
  132   HD23  LEU  22          2HD2      LEU  22 -11.468  -6.646  -5.627
  133    H    CYS  23           H        CYS  23  -7.362  -5.638  -2.972
  134    HA   CYS  23           HA       CYS  23  -4.752  -5.668  -3.066
  135    HB2  CYS  23           2HB      CYS  23  -6.231  -6.517  -0.566
  136    HB3  CYS  23           3HB      CYS  23  -4.596  -5.865  -0.614
  137    HA   PRO  24           HA       PRO  24  -3.249  -9.743  -3.951
  138    HB2  PRO  24           2HB      PRO  24  -0.850  -8.609  -2.587
  139    HB3  PRO  24           3HB      PRO  24  -0.974  -9.438  -4.144
  140    HG2  PRO  24           2HG      PRO  24  -0.700  -6.776  -3.996
  141    HG3  PRO  24           3HG      PRO  24  -1.694  -7.542  -5.248
  142    HD2  PRO  24           2HD      PRO  24  -2.510  -6.032  -2.844
  143    HD3  PRO  24           3HD      PRO  24  -3.334  -6.219  -4.405
  144    HN2  DB2  25           H        DB2  25  -3.349 -11.575  -2.820
  145    HA   DB2  25           HA       DB2  25  -2.628 -11.596   0.014
  146   HB2C  DB2  25          HB        DB2  25  -2.852 -13.611  -2.128
  147   HG1C  DB2  25          3HG       DB2  25  -0.671 -13.123  -1.638
  148   HG2C  DB2  25          1HG       DB2  25  -0.918 -14.494  -0.553
  149   HG3C  DB2  25          2HG       DB2  25  -0.999 -12.849   0.073
  150    H1   DBU  26           H        DBU  26  -5.267 -10.915  -1.686
  151    HB1  DBU  26           HB       DBU  26  -8.403 -10.362   0.506
  152    HG1  DBU  26           3HG      DBU  26  -5.456  -9.478   0.358
  153    HG2  DBU  26           1HG      DBU  26  -6.686  -8.768   1.391
  154    HG3  DBU  26           2HG      DBU  26  -6.690  -8.423  -0.341
  155    H    LYS  27           H        LYS  27  -6.685 -13.081  -2.365
  156    HA   LYS  27           HA       LYS  27  -9.113 -14.551  -1.585
  157    HB2  LYS  27           2HB      LYS  27  -9.311 -15.243  -3.895
  158    HB3  LYS  27           3HB      LYS  27  -9.153 -13.492  -3.825
  159    HG2  LYS  27           2HG      LYS  27  -7.049 -13.507  -4.749
  160    HG3  LYS  27           3HG      LYS  27  -6.716 -15.161  -4.230
  161    HD2  LYS  27           2HD      LYS  27  -7.031 -15.383  -6.523
  162    HD3  LYS  27           3HD      LYS  27  -8.612 -15.809  -5.863
  163    HE2  LYS  27           2HE      LYS  27  -8.024 -12.981  -6.634
  164    HE3  LYS  27           3HE      LYS  27  -8.439 -14.162  -7.875
  165    HZ1  LYS  27           3HZ      LYS  27 -10.561 -13.917  -7.353
  166    HZ2  LYS  27           1HZ      LYS  27 -10.162 -12.771  -6.174
  167    HZ3  LYS  27           2HZ      LYS  27 -10.263 -14.408  -5.762
  168    H    CYS  28           H        CYS  28  -5.925 -14.757  -1.161
  169    HA   CYS  28           HA       CYS  28  -5.531 -17.532  -1.898
  170    HB2  CYS  28           2HB      CYS  28  -3.309 -17.153  -0.676
  171    HB3  CYS  28           3HB      CYS  28  -3.585 -16.229  -2.149
  172    HN2  DB2  29           H        DB2  29  -7.569 -17.839  -0.425
  173    HA   DB2  29           HA       DB2  29  -6.564 -18.915   2.102
  174   HB2C  DB2  29          HB        DB2  29  -8.043 -20.147   0.334
  175   HG1C  DB2  29          3HG       DB2  29  -7.253 -21.221   2.289
  176   HG2C  DB2  29          1HG       DB2  29  -8.996 -21.501   2.251
  177   HG3C  DB2  29          2HG       DB2  29  -8.321 -20.281   3.330
  178    H    SER  30           H        SER  30  -7.276 -16.006   1.454
  179    HA   SER  30           HA       SER  30  -8.241 -15.345   4.018
  180    HB2  SER  30           2HB      SER  30  -7.163 -13.960   1.792
  181    HB3  SER  30           3HB      SER  30  -8.699 -13.186   2.183
  182    HG   SER  30           HG       SER  30  -7.697 -13.459   4.479
  183    H    ARG  31           H        ARG  31  -9.825 -15.723   0.908
  184    HA   ARG  31           HA       ARG  31 -12.417 -15.474   2.271
  185    HB2  ARG  31           2HB      ARG  31 -11.394 -13.758   0.227
  186    HB3  ARG  31           3HB      ARG  31 -12.746 -14.669  -0.432
  187    HG2  ARG  31           2HG      ARG  31 -12.935 -13.224   2.189
  188    HG3  ARG  31           3HG      ARG  31 -13.256 -12.426   0.648
  189    HD2  ARG  31           2HD      ARG  31 -14.649 -14.917   1.622
  190    HD3  ARG  31           3HD      ARG  31 -15.298 -13.283   1.764
  191    HE   ARG  31           HE       ARG  31 -14.648 -13.776  -0.921
  192   HH11  ARG  31          1HH1      ARG  31 -16.932 -14.778   1.508
  193   HH12  ARG  31          2HH1      ARG  31 -18.181 -15.149   0.366
  194   HH21  ARG  31          1HH2      ARG  31 -16.284 -14.261  -2.434
  195   HH22  ARG  31          2HH2      ARG  31 -17.812 -14.856  -1.875
  196    H    CYS  32           H        CYS  32 -10.670 -16.665  -0.572
  197    HA   CYS  32           HA       CYS  32 -11.266 -18.302  -2.098
  198    HB2  CYS  32           2HB      CYS  32 -11.859 -20.312  -0.126
  199    HB3  CYS  32           3HB      CYS  32 -10.419 -20.127  -1.122
  Start of MODEL   11
    1    H41  2KT   1           2H4      2KT   1 -20.003   1.455  23.475
    2    H42  2KT   1           3H4      2KT   1 -19.689   2.498  22.443
    3    H43  2KT   1           1H4      2KT   1 -20.082   1.115  22.016
    4    H31  2KT   1           2H3      2KT   1 -17.823   2.115  22.748
    5    H32  2KT   1           3H3      2KT   1 -18.029   0.903  23.608
    6    H1   DBU   2           H        DBU   2 -15.640   1.402  21.409
    7    HB1  DBU   2           HB       DBU   2 -14.652   1.781  17.607
    8    HG1  DBU   2           3HG      DBU   2 -15.806  -0.551  19.156
    9    HG2  DBU   2           1HG      DBU   2 -14.076  -0.359  19.386
   10    HG3  DBU   2           2HG      DBU   2 -14.719  -0.646  17.767
   11    HA   PRO   3           HA       PRO   3 -16.281   6.131  20.113
   12    HB2  PRO   3           2HB      PRO   3 -14.069   7.111  21.344
   13    HB3  PRO   3           3HB      PRO   3 -15.384   6.320  22.220
   14    HG2  PRO   3           2HG      PRO   3 -12.750   5.201  21.342
   15    HG3  PRO   3           3HG      PRO   3 -13.596   4.991  22.886
   16    HD2  PRO   3           2HD      PRO   3 -13.635   3.112  20.937
   17    HD3  PRO   3           3HD      PRO   3 -15.001   3.371  22.040
   18    H    ALA   4           H        ALA   4 -15.567   5.325  17.670
   19    HA   ALA   4           HA       ALA   4 -13.145   6.654  16.797
   20    HB1  ALA   4           1HB      ALA   4 -13.356   5.508  14.845
   21    HB2  ALA   4           2HB      ALA   4 -14.323   4.457  15.882
   22    HB3  ALA   4           3HB      ALA   4 -15.115   5.632  14.831
   23    H1   DBU   5           H        DBU   5 -14.191   8.666  17.758
   24    HB1  DBU   5           HB       DBU   5 -16.117  11.809  17.281
   25    HG1  DBU   5           3HG      DBU   5 -16.155  11.087  19.602
   26    HG2  DBU   5           1HG      DBU   5 -14.507  10.565  19.294
   27    HG3  DBU   5           2HG      DBU   5 -15.841   9.424  19.098
   28    H1   DBU   6           H        DBU   6 -17.167   9.573  15.099
   29    HB1  DBU   6           HB       DBU   6 -17.377  11.622  11.742
   30    HG1  DBU   6           3HG      DBU   6 -18.390  11.989  14.493
   31    HG2  DBU   6           1HG      DBU   6 -18.137  13.280  13.330
   32    HG3  DBU   6           2HG      DBU   6 -16.810  12.771  14.378
   33    H    DAL   7           H        DAL   7 -17.352   7.857  13.109
   34    HA   DAL   7           HA       DAL   7 -15.346   7.096  11.159
   35    HB2  DAL   7           2HB      DAL   7 -17.594   7.894  10.050
   36    HB3  DAL   7           3HB      DAL   7 -18.156   6.293  10.525
   37    H    DHA   8           H        DHA   8 -18.377   5.756  12.333
   38    HB1  DHA   8           2HB      DHA   8 -17.939   4.918  15.130
   39    HB2  DHA   8           3HB      DHA   8 -18.044   3.056  15.112
   40    H    TRP   9           H        TRP   9 -19.462   2.194  13.523
   41    HA   TRP   9           HA       TRP   9 -18.171   0.065  12.299
   42    HB2  TRP   9           2HB      TRP   9 -21.009   0.746  12.879
   43    HB3  TRP   9           3HB      TRP   9 -20.711  -0.565  11.741
   44    HD1  TRP   9           HD1      TRP   9 -20.754   0.212  15.406
   45    HE1  TRP   9           HE1      TRP   9 -20.089  -1.881  16.748
   46    HE3  TRP   9           HE3      TRP   9 -19.071  -2.712  11.565
   47    HZ2  TRP   9           HZ2      TRP   9 -18.995  -4.434  16.245
   48    HZ3  TRP   9           HZ3      TRP   9 -18.231  -4.967  12.081
   49    HH2  TRP   9           HH2      TRP   9 -18.194  -5.808  14.372
   50    H    THR  10           H        THR  10 -20.370   2.455  10.861
   51    HA   THR  10           HA       THR  10 -20.606   1.494   8.309
   52    HB   THR  10           HB       THR  10 -20.189   4.405   9.015
   53    HG1  THR  10           HG1      THR  10 -22.559   2.818   8.961
   54   HG21  THR  10          3HG2      THR  10 -20.322   4.639   6.786
   55   HG22  THR  10          1HG2      THR  10 -22.034   4.270   6.992
   56   HG23  THR  10          2HG2      THR  10 -20.902   2.990   6.555
   57    H    CYS  11           H        CYS  11 -18.117   3.841   9.335
   58    HA   CYS  11           HA       CYS  11 -16.634   3.843   6.991
   59    HB2  CYS  11           2HB      CYS  11 -15.661   4.204   9.833
   60    HB3  CYS  11           3HB      CYS  11 -14.745   4.635   8.393
   61    H    ILE  12           H        ILE  12 -16.520   1.630   9.724
   62    HA   ILE  12           HA       ILE  12 -14.163   0.263   9.033
   63    HB   ILE  12           HB       ILE  12 -16.588  -0.642  10.578
   64   HG12  ILE  12          2HG1      ILE  12 -13.808   0.209  11.415
   65   HG13  ILE  12          3HG1      ILE  12 -15.288   1.137  11.630
   66   HG21  ILE  12          1HG2      ILE  12 -13.980  -2.075  10.113
   67   HG22  ILE  12          2HG2      ILE  12 -15.132  -2.505  11.376
   68   HG23  ILE  12          3HG2      ILE  12 -15.598  -2.625   9.679
   69   HD11  ILE  12          3HD1      ILE  12 -14.742   0.160  13.716
   70   HD12  ILE  12          1HD1      ILE  12 -16.131  -0.719  13.077
   71   HD13  ILE  12          2HD1      ILE  12 -14.519  -1.430  12.986
   72    H1   DBU  13           H        DBU  13 -17.430  -1.029   8.748
   73    HB1  DBU  13           HB       DBU  13 -18.230  -3.999   6.565
   74    HG1  DBU  13           3HG      DBU  13 -18.261  -2.775   9.353
   75    HG2  DBU  13           1HG      DBU  13 -17.173  -4.139   9.165
   76    HG3  DBU  13           2HG      DBU  13 -18.903  -4.354   8.891
   77    H    ALA  14           H        ALA  14 -17.581   0.106   5.962
   78    HA   ALA  14           HA       ALA  14 -17.837  -0.644   3.253
   79    HB1  ALA  14           1HB      ALA  14 -18.775   1.426   3.958
   80    HB2  ALA  14           2HB      ALA  14 -17.213   2.006   4.539
   81    HB3  ALA  14           3HB      ALA  14 -17.489   1.798   2.809
   82    H    GLY  15           H        GLY  15 -15.091   0.598   5.129
   83    HA2  GLY  15           2HA      GLY  15 -13.302   0.695   2.912
   84    HA3  GLY  15           3HA      GLY  15 -12.855   0.770   4.610
   85    H    VAL  16           H        VAL  16 -13.717  -1.636   5.568
   86    HA   VAL  16           HA       VAL  16 -11.659  -3.371   5.003
   87    HB   VAL  16           HB       VAL  16 -14.432  -3.997   6.014
   88   HG11  VAL  16          1HG1      VAL  16 -12.070  -5.765   5.561
   89   HG12  VAL  16          2HG1      VAL  16 -13.137  -6.070   6.933
   90   HG13  VAL  16          3HG1      VAL  16 -13.783  -6.086   5.291
   91   HG21  VAL  16          3HG2      VAL  16 -12.033  -2.898   7.190
   92   HG22  VAL  16          1HG2      VAL  16 -13.657  -3.034   7.865
   93   HG23  VAL  16          2HG2      VAL  16 -12.526  -4.380   8.009
   94    H1   DBU  17           H        DBU  17 -14.894  -3.359   3.636
   95    HB1  DBU  17           HB       DBU  17 -16.095  -5.851   1.060
   96    HG1  DBU  17           3HG      DBU  17 -17.632  -5.221   3.014
   97    HG2  DBU  17           1HG      DBU  17 -16.223  -4.784   3.965
   98    HG3  DBU  17           2HG      DBU  17 -16.535  -6.481   3.590
   99    H    VAL  18           H        VAL  18 -13.495  -2.526   1.145
  100    HA   VAL  18           HA       VAL  18 -13.059  -3.351  -1.549
  101    HB   VAL  18           HB       VAL  18 -12.058  -1.007   0.054
  102   HG11  VAL  18          1HG1      VAL  18 -10.852  -2.106  -2.270
  103   HG12  VAL  18          2HG1      VAL  18 -11.637  -0.591  -2.722
  104   HG13  VAL  18          3HG1      VAL  18 -10.447  -0.615  -1.420
  105   HG21  VAL  18          3HG2      VAL  18 -14.273  -1.538  -1.818
  106   HG22  VAL  18          1HG2      VAL  18 -14.169  -0.403  -0.472
  107   HG23  VAL  18          2HG2      VAL  18 -13.443   0.004  -2.026
  108    H    DAL  19           H        DAL  19 -10.972  -3.038   1.300
  109    HA   DAL  19           HA       DAL  19  -8.941  -3.914   1.795
  110    HB2  DAL  19           2HB      DAL  19  -8.253  -2.378  -0.021
  111    HB3  DAL  19           3HB      DAL  19  -8.464  -3.686  -1.183
  112    H    ALA  20           H        ALA  20 -10.777  -5.818   1.801
  113    HA   ALA  20           HA       ALA  20  -9.334  -8.185   1.292
  114    HB1  ALA  20           1HB      ALA  20 -12.267  -7.814   1.889
  115    HB2  ALA  20           2HB      ALA  20 -11.399  -9.349   1.946
  116    HB3  ALA  20           3HB      ALA  20 -10.977  -8.056   3.068
  117    H    SER  21           H        SER  21 -10.786  -6.202  -0.883
  118    HA   SER  21           HA       SER  21 -11.906  -8.243  -2.611
  119    HB2  SER  21           2HB      SER  21 -12.262  -5.465  -2.318
  120    HB3  SER  21           3HB      SER  21 -11.543  -5.692  -3.913
  121    HG   SER  21           HG       SER  21 -13.972  -6.688  -2.897
  122    H    LEU  22           H        LEU  22  -9.152  -6.000  -2.660
  123    HA   LEU  22           HA       LEU  22  -7.911  -7.714  -4.710
  124    HB2  LEU  22           2HB      LEU  22  -7.212  -4.825  -4.394
  125    HB3  LEU  22           3HB      LEU  22  -6.998  -5.876  -5.793
  126    HG   LEU  22           HG       LEU  22  -9.590  -4.683  -4.811
  127   HD11  LEU  22          1HD1      LEU  22  -9.467  -3.687  -7.171
  128   HD12  LEU  22          2HD1      LEU  22  -7.755  -4.105  -7.110
  129   HD13  LEU  22          3HD1      LEU  22  -8.433  -2.992  -5.922
  130   HD21  LEU  22          3HD2      LEU  22  -9.257  -7.091  -6.138
  131   HD22  LEU  22          1HD2      LEU  22  -9.623  -5.939  -7.422
  132   HD23  LEU  22          2HD2      LEU  22 -10.732  -6.126  -6.064
  133    H    CYS  23           H        CYS  23  -7.231  -5.433  -2.067
  134    HA   CYS  23           HA       CYS  23  -4.655  -5.487  -1.593
  135    HB2  CYS  23           2HB      CYS  23  -6.658  -6.322   0.516
  136    HB3  CYS  23           3HB      CYS  23  -5.048  -5.683   0.829
  137    HA   PRO  24           HA       PRO  24  -3.062  -9.588  -2.152
  138    HB2  PRO  24           2HB      PRO  24  -0.990  -8.486  -0.310
  139    HB3  PRO  24           3HB      PRO  24  -0.793  -9.317  -1.857
  140    HG2  PRO  24           2HG      PRO  24  -0.517  -6.659  -1.655
  141    HG3  PRO  24           3HG      PRO  24  -1.235  -7.414  -3.090
  142    HD2  PRO  24           2HD      PRO  24  -2.519  -5.886  -0.912
  143    HD3  PRO  24           3HD      PRO  24  -2.996  -6.066  -2.613
  144    HN2  DB2  25           H        DB2  25  -3.424 -11.416  -1.067
  145    HA   DB2  25           HA       DB2  25  -3.320 -11.439   1.855
  146   HB2C  DB2  25          HB        DB2  25  -3.113 -13.455  -0.287
  147   HG1C  DB2  25          3HG       DB2  25  -1.803 -12.846   2.343
  148   HG2C  DB2  25          1HG       DB2  25  -1.108 -12.856   0.720
  149   HG3C  DB2  25          2HG       DB2  25  -1.509 -14.377   1.517
  150    H1   DBU  26           H        DBU  26  -5.530 -10.724  -0.365
  151    HB1  DBU  26           HB       DBU  26  -9.049 -10.118   1.117
  152    HG1  DBU  26           3HG      DBU  26  -7.154  -8.209   0.656
  153    HG2  DBU  26           1HG      DBU  26  -6.124  -9.277   1.594
  154    HG3  DBU  26           2HG      DBU  26  -7.547  -8.549   2.345
  155    H    LYS  27           H        LYS  27  -6.812 -12.861  -1.340
  156    HA   LYS  27           HA       LYS  27  -9.369 -14.296  -1.086
  157    HB2  LYS  27           2HB      LYS  27  -9.285 -14.798  -3.364
  158    HB3  LYS  27           3HB      LYS  27  -8.668 -13.153  -3.292
  159    HG2  LYS  27           2HG      LYS  27  -7.125 -15.698  -3.684
  160    HG3  LYS  27           3HG      LYS  27  -7.267 -14.321  -4.779
  161    HD2  LYS  27           2HD      LYS  27  -6.083 -12.930  -3.093
  162    HD3  LYS  27           3HD      LYS  27  -5.847 -14.382  -2.117
  163    HE2  LYS  27           2HE      LYS  27  -4.811 -13.908  -4.910
  164    HE3  LYS  27           3HE      LYS  27  -3.858 -13.904  -3.427
  165    HZ1  LYS  27           3HZ      LYS  27  -4.947 -16.297  -3.245
  166    HZ2  LYS  27           1HZ      LYS  27  -3.495 -16.025  -4.070
  167    HZ3  LYS  27           2HZ      LYS  27  -4.945 -16.151  -4.931
  168    H    CYS  28           H        CYS  28  -6.350 -14.552   0.002
  169    HA   CYS  28           HA       CYS  28  -5.848 -17.330  -0.650
  170    HB2  CYS  28           2HB      CYS  28  -3.929 -16.987   1.016
  171    HB3  CYS  28           3HB      CYS  28  -3.874 -16.056  -0.477
  172    HN2  DB2  29           H        DB2  29  -8.141 -17.643   0.347
  173    HA   DB2  29           HA       DB2  29  -7.712 -18.706   3.039
  174   HB2C  DB2  29          HB        DB2  29  -8.754 -19.957   0.997
  175   HG1C  DB2  29          3HG       DB2  29  -9.686 -21.500   2.525
  176   HG2C  DB2  29          1HG       DB2  29 -10.112 -20.226   3.671
  177   HG3C  DB2  29          2HG       DB2  29  -8.421 -20.656   3.419
  178    H    SER  30           H        SER  30  -8.263 -15.804   2.254
  179    HA   SER  30           HA       SER  30  -9.779 -15.139   4.529
  180    HB2  SER  30           2HB      SER  30  -8.588 -13.284   4.046
  181    HB3  SER  30           3HB      SER  30  -8.464 -13.705   2.338
  182    HG   SER  30           HG       SER  30  -9.954 -11.839   3.379
  183    H    ARG  31           H        ARG  31 -10.640 -15.550   1.153
  184    HA   ARG  31           HA       ARG  31 -13.469 -15.324   1.912
  185    HB2  ARG  31           2HB      ARG  31 -13.353 -13.331   0.789
  186    HB3  ARG  31           3HB      ARG  31 -12.008 -13.853  -0.217
  187    HG2  ARG  31           2HG      ARG  31 -13.536 -15.220  -1.550
  188    HG3  ARG  31           3HG      ARG  31 -14.883 -14.685  -0.544
  189    HD2  ARG  31           2HD      ARG  31 -14.861 -13.377  -2.556
  190    HD3  ARG  31           3HD      ARG  31 -14.379 -12.347  -1.209
  191    HE   ARG  31           HE       ARG  31 -12.740 -13.182  -3.443
  192   HH11  ARG  31          1HH1      ARG  31 -12.833 -11.822  -0.240
  193   HH12  ARG  31          2HH1      ARG  31 -11.281 -11.064  -0.376
  194   HH21  ARG  31          1HH2      ARG  31 -10.696 -12.189  -3.634
  195   HH22  ARG  31          2HH2      ARG  31 -10.067 -11.273  -2.307
  196    H    CYS  32           H        CYS  32 -11.120 -16.480  -0.474
  197    HA   CYS  32           HA       CYS  32 -11.343 -18.109  -2.105
  198    HB2  CYS  32           2HB      CYS  32 -12.352 -20.139  -0.337
  199    HB3  CYS  32           3HB      CYS  32 -10.722 -19.933  -0.970
  Start of MODEL   12
    1    H41  2KT   1           2H4      2KT   1 -28.616   8.533  19.488
    2    H42  2KT   1           3H4      2KT   1 -29.100   9.483  18.433
    3    H43  2KT   1           1H4      2KT   1 -28.970   8.021  18.124
    4    H31  2KT   1           2H3      2KT   1 -27.415   9.640  17.458
    5    H32  2KT   1           3H3      2KT   1 -26.809   9.553  18.828
    6    H1   DBU   2           H        DBU   2 -24.438   8.455  16.833
    7    HB1  DBU   2           HB       DBU   2 -21.515   8.239  19.484
    8    HG1  DBU   2           3HG      DBU   2 -22.525  10.585  19.407
    9    HG2  DBU   2           1HG      DBU   2 -23.506   9.656  20.527
   10    HG3  DBU   2           2HG      DBU   2 -24.058   9.893  18.867
   11    HA   PRO   3           HA       PRO   3 -22.144   4.096  16.244
   12    HB2  PRO   3           2HB      PRO   3 -21.308   4.719  13.738
   13    HB3  PRO   3           3HB      PRO   3 -23.014   4.546  14.166
   14    HG2  PRO   3           2HG      PRO   3 -21.377   7.036  13.876
   15    HG3  PRO   3           3HG      PRO   3 -23.027   6.710  13.315
   16    HD2  PRO   3           2HD      PRO   3 -22.506   8.121  15.566
   17    HD3  PRO   3           3HD      PRO   3 -23.945   7.096  15.393
   18    H    ALA   4           H        ALA   4 -20.384   5.117  17.971
   19    HA   ALA   4           HA       ALA   4 -18.185   4.686  18.526
   20    HB1  ALA   4           1HB      ALA   4 -18.294   3.315  16.250
   21    HB2  ALA   4           2HB      ALA   4 -17.232   4.620  15.721
   22    HB3  ALA   4           3HB      ALA   4 -16.777   3.618  17.099
   23    H1   DBU   5           H        DBU   5 -18.130   6.444  15.464
   24    HB1  DBU   5           HB       DBU   5 -17.463  10.300  16.114
   25    HG1  DBU   5           3HG      DBU   5 -19.622  10.109  17.224
   26    HG2  DBU   5           1HG      DBU   5 -19.347   8.399  17.510
   27    HG3  DBU   5           2HG      DBU   5 -19.961   8.939  15.945
   28    H1   DBU   6           H        DBU   6 -15.115   8.370  17.338
   29    HB1  DBU   6           HB       DBU   6 -11.708   9.594  16.359
   30    HG1  DBU   6           3HG      DBU   6 -12.713  11.143  17.960
   31    HG2  DBU   6           1HG      DBU   6 -13.297   9.662  18.698
   32    HG3  DBU   6           2HG      DBU   6 -14.325  10.540  17.563
   33    H    DAL   7           H        DAL   7 -13.643   6.090  15.706
   34    HA   DAL   7           HA       DAL   7 -11.737   5.996  13.523
   35    HB2  DAL   7           2HB      DAL   7 -14.186   6.356  12.678
   36    HB3  DAL   7           3HB      DAL   7 -14.370   4.645  13.057
   37    H    DHA   8           H        DHA   8 -14.248   3.886  14.788
   38    HB1  DHA   8           2HB      DHA   8 -12.426   2.966  17.253
   39    HB2  DHA   8           3HB      DHA   8 -12.526   1.111  17.089
   40    H    TRP   9           H        TRP   9 -14.983   0.630  16.026
   41    HA   TRP   9           HA       TRP   9 -14.303  -1.505  14.355
   42    HB2  TRP   9           2HB      TRP   9 -16.936  -0.647  15.550
   43    HB3  TRP   9           3HB      TRP   9 -16.767  -2.121  14.602
   44    HD1  TRP   9           HD1      TRP   9 -16.917  -1.180  18.041
   45    HE1  TRP   9           HE1      TRP   9 -15.687  -2.844  19.572
   46    HE3  TRP   9           HE3      TRP   9 -14.155  -3.642  14.513
   47    HZ2  TRP   9           HZ2      TRP   9 -13.796  -4.924  19.318
   48    HZ3  TRP   9           HZ3      TRP   9 -12.660  -5.455  15.240
   49    HH2  TRP   9           HH2      TRP   9 -12.485  -6.081  17.593
   50    H    THR  10           H        THR  10 -16.307   1.336  13.773
   51    HA   THR  10           HA       THR  10 -17.423   0.577  11.322
   52    HB   THR  10           HB       THR  10 -16.644   3.422  11.897
   53    HG1  THR  10           HG1      THR  10 -19.083   2.578  12.881
   54   HG21  THR  10          3HG2      THR  10 -17.739   3.017   9.780
   55   HG22  THR  10          1HG2      THR  10 -18.857   3.852  10.858
   56   HG23  THR  10          2HG2      THR  10 -19.028   2.119  10.581
   57    H    CYS  11           H        CYS  11 -14.571   2.647  11.898
   58    HA   CYS  11           HA       CYS  11 -13.776   2.942   9.259
   59    HB2  CYS  11           2HB      CYS  11 -12.084   2.818  11.763
   60    HB3  CYS  11           3HB      CYS  11 -11.494   3.357  10.194
   61    H    ILE  12           H        ILE  12 -13.146   0.317  11.515
   62    HA   ILE  12           HA       ILE  12 -11.200  -1.044  10.010
   63    HB   ILE  12           HB       ILE  12 -13.115  -1.884  12.151
   64   HG12  ILE  12          2HG1      ILE  12 -10.145  -2.283  12.130
   65   HG13  ILE  12          3HG1      ILE  12 -10.800  -0.673  12.404
   66   HG21  ILE  12          1HG2      ILE  12 -13.173  -3.841  10.883
   67   HG22  ILE  12          2HG2      ILE  12 -11.487  -3.686  10.395
   68   HG23  ILE  12          3HG2      ILE  12 -11.887  -4.136  12.052
   69   HD11  ILE  12          3HD1      ILE  12 -11.584  -3.077  14.026
   70   HD12  ILE  12          1HD1      ILE  12 -10.270  -1.985  14.463
   71   HD13  ILE  12          2HD1      ILE  12 -11.925  -1.380  14.367
   72    H1   DBU  13           H        DBU  13 -14.509  -2.150  10.490
   73    HB1  DBU  13           HB       DBU  13 -16.139  -4.676   8.217
   74    HG1  DBU  13           3HG      DBU  13 -14.443  -5.308  10.353
   75    HG2  DBU  13           1HG      DBU  13 -16.183  -5.355  10.579
   76    HG3  DBU  13           2HG      DBU  13 -15.278  -3.910  11.039
   77    H    ALA  14           H        ALA  14 -15.304  -0.559   8.046
   78    HA   ALA  14           HA       ALA  14 -16.364  -0.845   5.445
   79    HB1  ALA  14           1HB      ALA  14 -15.056   1.591   6.649
   80    HB2  ALA  14           2HB      ALA  14 -16.163   1.556   5.275
   81    HB3  ALA  14           3HB      ALA  14 -16.741   1.125   6.884
   82    H    GLY  15           H        GLY  15 -13.106  -0.046   6.612
   83    HA2  GLY  15           2HA      GLY  15 -11.995   0.310   4.013
   84    HA3  GLY  15           3HA      GLY  15 -11.093   0.094   5.506
   85    H    VAL  16           H        VAL  16 -11.872  -2.388   6.329
   86    HA   VAL  16           HA       VAL  16 -10.215  -4.110   4.971
   87    HB   VAL  16           HB       VAL  16 -12.658  -4.757   6.620
   88   HG11  VAL  16          1HG1      VAL  16 -10.580  -6.562   5.418
   89   HG12  VAL  16          2HG1      VAL  16 -11.502  -7.019   6.852
   90   HG13  VAL  16          3HG1      VAL  16 -12.336  -6.693   5.332
   91   HG21  VAL  16          3HG2      VAL  16  -9.779  -5.080   7.405
   92   HG22  VAL  16          1HG2      VAL  16 -10.627  -3.548   7.613
   93   HG23  VAL  16          2HG2      VAL  16 -11.204  -4.996   8.439
   94    H1   DBU  17           H        DBU  17 -13.688  -3.738   4.594
   95    HB1  DBU  17           HB       DBU  17 -15.762  -5.721   2.136
   96    HG1  DBU  17           3HG      DBU  17 -16.326  -4.897   4.700
   97    HG2  DBU  17           1HG      DBU  17 -14.777  -5.648   5.046
   98    HG3  DBU  17           2HG      DBU  17 -16.105  -6.628   4.420
   99    H    VAL  18           H        VAL  18 -12.952  -2.582   1.943
  100    HA   VAL  18           HA       VAL  18 -13.327  -3.010  -0.854
  101    HB   VAL  18           HB       VAL  18 -11.751  -0.968   0.701
  102   HG11  VAL  18          1HG1      VAL  18 -12.105  -0.193  -2.020
  103   HG12  VAL  18          2HG1      VAL  18 -10.607  -0.377  -1.107
  104   HG13  VAL  18          3HG1      VAL  18 -11.289  -1.755  -1.972
  105   HG21  VAL  18          3HG2      VAL  18 -13.584   0.380  -0.759
  106   HG22  VAL  18          1HG2      VAL  18 -14.435  -1.142  -0.493
  107   HG23  VAL  18          2HG2      VAL  18 -13.863  -0.199   0.883
  108    H    DAL  19           H        DAL  19 -10.486  -3.087   1.282
  109    HA   DAL  19           HA       DAL  19  -8.488  -4.144   1.092
  110    HB2  DAL  19           2HB      DAL  19  -8.249  -2.353  -0.631
  111    HB3  DAL  19           3HB      DAL  19  -8.774  -3.512  -1.850
  112    H    ALA  20           H        ALA  20 -10.443  -5.952   1.289
  113    HA   ALA  20           HA       ALA  20  -9.343  -8.272   0.143
  114    HB1  ALA  20           1HB      ALA  20 -12.030  -7.836   1.439
  115    HB2  ALA  20           2HB      ALA  20 -11.347  -9.413   1.043
  116    HB3  ALA  20           3HB      ALA  20 -10.547  -8.378   2.226
  117    H    SER  21           H        SER  21 -11.076  -5.916  -1.357
  118    HA   SER  21           HA       SER  21 -12.685  -7.612  -3.066
  119    HB2  SER  21           2HB      SER  21 -12.130  -4.672  -3.463
  120    HB3  SER  21           3HB      SER  21 -13.510  -5.605  -4.041
  121    HG   SER  21           HG       SER  21 -13.505  -5.910  -1.453
  122    H    LEU  22           H        LEU  22  -9.850  -5.499  -3.433
  123    HA   LEU  22           HA       LEU  22  -9.193  -6.967  -5.902
  124    HB2  LEU  22           2HB      LEU  22  -8.254  -4.176  -5.384
  125    HB3  LEU  22           3HB      LEU  22  -8.398  -5.034  -6.916
  126    HG   LEU  22           HG       LEU  22 -10.585  -3.768  -5.283
  127   HD11  LEU  22          1HD1      LEU  22 -10.983  -2.803  -7.668
  128   HD12  LEU  22          2HD1      LEU  22  -9.303  -3.268  -7.931
  129   HD13  LEU  22          3HD1      LEU  22  -9.712  -2.132  -6.646
  130   HD21  LEU  22          3HD2      LEU  22 -10.710  -6.029  -7.142
  131   HD22  LEU  22          1HD2      LEU  22 -11.809  -4.704  -7.529
  132   HD23  LEU  22          2HD2      LEU  22 -11.881  -5.474  -5.944
  133    H    CYS  23           H        CYS  23  -7.804  -5.089  -3.219
  134    HA   CYS  23           HA       CYS  23  -5.193  -5.329  -3.348
  135    HB2  CYS  23           2HB      CYS  23  -6.729  -6.324  -0.938
  136    HB3  CYS  23           3HB      CYS  23  -5.061  -5.759  -0.940
  137    HA   PRO  24           HA       PRO  24  -4.201  -9.446  -4.726
  138    HB2  PRO  24           2HB      PRO  24  -1.601  -8.626  -3.515
  139    HB3  PRO  24           3HB      PRO  24  -1.932  -9.321  -5.106
  140    HG2  PRO  24           2HG      PRO  24  -1.405  -6.711  -4.804
  141    HG3  PRO  24           3HG      PRO  24  -2.569  -7.293  -6.008
  142    HD2  PRO  24           2HD      PRO  24  -3.035  -5.906  -3.442
  143    HD3  PRO  24           3HD      PRO  24  -4.003  -5.904  -4.930
  144    HN2  DB2  25           H        DB2  25  -4.140 -11.400  -3.759
  145    HA   DB2  25           HA       DB2  25  -3.329 -11.625  -0.961
  146   HB2C  DB2  25          HB        DB2  25  -4.086 -13.711  -2.999
  147   HG1C  DB2  25          3HG       DB2  25  -1.432 -12.772  -1.915
  148   HG2C  DB2  25          1HG       DB2  25  -2.032 -12.652  -3.571
  149   HG3C  DB2  25          2HG       DB2  25  -1.633 -14.228  -2.888
  150    H1   DBU  26           H        DBU  26  -5.961 -10.597  -2.285
  151    HB1  DBU  26           HB       DBU  26  -9.058 -10.217  -0.108
  152    HG1  DBU  26           3HG      DBU  26  -7.230  -8.630   0.679
  153    HG2  DBU  26           1HG      DBU  26  -7.558  -8.193  -0.989
  154    HG3  DBU  26           2HG      DBU  26  -6.173  -9.219  -0.609
  155    H    LYS  27           H        LYS  27  -6.921 -13.393  -2.325
  156    HA   LYS  27           HA       LYS  27  -9.448 -14.750  -1.661
  157    HB2  LYS  27           2HB      LYS  27  -9.565 -15.696  -3.870
  158    HB3  LYS  27           3HB      LYS  27  -9.422 -13.950  -4.022
  159    HG2  LYS  27           2HG      LYS  27  -7.011 -14.219  -4.472
  160    HG3  LYS  27           3HG      LYS  27  -7.222 -15.971  -4.408
  161    HD2  LYS  27           2HD      LYS  27  -7.368 -15.577  -6.674
  162    HD3  LYS  27           3HD      LYS  27  -9.069 -15.522  -6.203
  163    HE2  LYS  27           2HE      LYS  27  -9.188 -13.225  -6.413
  164    HE3  LYS  27           3HE      LYS  27  -7.451 -13.011  -6.196
  165    HZ1  LYS  27           3HZ      LYS  27  -7.419 -12.793  -8.403
  166    HZ2  LYS  27           1HZ      LYS  27  -8.954 -13.474  -8.605
  167    HZ3  LYS  27           2HZ      LYS  27  -7.598 -14.474  -8.462
  168    H    CYS  28           H        CYS  28  -6.112 -14.776  -1.528
  169    HA   CYS  28           HA       CYS  28  -5.788 -17.655  -1.634
  170    HB2  CYS  28           2HB      CYS  28  -3.412 -17.080  -0.945
  171    HB3  CYS  28           3HB      CYS  28  -3.943 -16.434  -2.494
  172    HN2  DB2  29           H        DB2  29  -7.528 -17.683   0.143
  173    HA   DB2  29           HA       DB2  29  -6.131 -17.885   2.722
  174   HB2C  DB2  29          HB        DB2  29  -7.409 -19.833   1.560
  175   HG1C  DB2  29          3HG       DB2  29  -6.352 -19.604   3.890
  176   HG2C  DB2  29          1HG       DB2  29  -7.542 -20.884   3.642
  177   HG3C  DB2  29          2HG       DB2  29  -8.004 -19.399   4.472
  178    H    SER  30           H        SER  30  -7.243 -15.397   1.538
  179    HA   SER  30           HA       SER  30  -8.387 -14.355   3.910
  180    HB2  SER  30           2HB      SER  30  -7.673 -12.460   2.956
  181    HB3  SER  30           3HB      SER  30  -7.359 -13.323   1.450
  182    HG   SER  30           HG       SER  30  -9.859 -12.230   2.238
  183    H    ARG  31           H        ARG  31  -9.790 -14.706   0.647
  184    HA   ARG  31           HA       ARG  31 -12.440 -14.908   1.922
  185    HB2  ARG  31           2HB      ARG  31 -11.522 -13.060  -0.026
  186    HB3  ARG  31           3HB      ARG  31 -12.661 -14.136  -0.824
  187    HG2  ARG  31           2HG      ARG  31 -13.346 -12.864   1.795
  188    HG3  ARG  31           3HG      ARG  31 -13.536 -11.981   0.279
  189    HD2  ARG  31           2HD      ARG  31 -15.614 -13.094   0.972
  190    HD3  ARG  31           3HD      ARG  31 -15.015 -13.701  -0.572
  191    HE   ARG  31           HE       ARG  31 -14.789 -15.760   0.383
  192   HH11  ARG  31          1HH1      ARG  31 -14.965 -13.370   2.908
  193   HH12  ARG  31          2HH1      ARG  31 -15.014 -14.537   4.188
  194   HH21  ARG  31          1HH2      ARG  31 -14.852 -17.306   2.060
  195   HH22  ARG  31          2HH2      ARG  31 -14.948 -16.775   3.705
  196    H    CYS  32           H        CYS  32 -10.857 -17.158   1.558
  197    HA   CYS  32           HA       CYS  32 -11.621 -18.471  -0.900
  198    HB2  CYS  32           2HB      CYS  32 -10.574 -20.485   0.435
  199    HB3  CYS  32           3HB      CYS  32  -9.544 -19.227  -0.240
  Start of MODEL   13
    1    H41  2KT   1           2H4      2KT   1 -17.037   7.560  26.361
    2    H42  2KT   1           3H4      2KT   1 -17.797   7.379  27.642
    3    H43  2KT   1           1H4      2KT   1 -16.392   6.866  27.524
    4    H31  2KT   1           2H3      2KT   1 -17.765   5.258  27.479
    5    H32  2KT   1           3H3      2KT   1 -18.677   5.843  26.441
    6    H1   DBU   2           H        DBU   2 -15.376   5.768  23.942
    7    HB1  DBU   2           HB       DBU   2 -17.262   7.440  20.870
    8    HG1  DBU   2           3HG      DBU   2 -18.111   7.910  23.608
    9    HG2  DBU   2           1HG      DBU   2 -17.563   9.180  22.526
   10    HG3  DBU   2           2HG      DBU   2 -16.401   8.356  23.569
   11    HA   PRO   3           HA       PRO   3 -16.812   2.601  19.859
   12    HB2  PRO   3           2HB      PRO   3 -18.909   2.937  18.169
   13    HB3  PRO   3           3HB      PRO   3 -19.092   2.327  19.817
   14    HG2  PRO   3           2HG      PRO   3 -19.537   5.092  18.761
   15    HG3  PRO   3           3HG      PRO   3 -20.522   4.158  19.902
   16    HD2  PRO   3           2HD      PRO   3 -18.797   6.085  20.705
   17    HD3  PRO   3           3HD      PRO   3 -19.146   4.647  21.685
   18    H    ALA   4           H        ALA   4 -14.980   4.450  19.268
   19    HA   ALA   4           HA       ALA   4 -13.566   4.847  17.485
   20    HB1  ALA   4           1HB      ALA   4 -13.959   3.907  15.484
   21    HB2  ALA   4           2HB      ALA   4 -15.318   3.143  16.309
   22    HB3  ALA   4           3HB      ALA   4 -15.574   4.606  15.357
   23    H1   DBU   5           H        DBU   5 -16.789   5.901  16.498
   24    HB1  DBU   5           HB       DBU   5 -17.129   9.828  16.993
   25    HG1  DBU   5           3HG      DBU   5 -15.995   8.796  19.177
   26    HG2  DBU   5           1HG      DBU   5 -16.726   7.274  18.695
   27    HG3  DBU   5           2HG      DBU   5 -17.755   8.636  19.149
   28    H1   DBU   6           H        DBU   6 -14.639   8.879  14.960
   29    HB1  DBU   6           HB       DBU   6 -15.240  11.050  11.830
   30    HG1  DBU   6           3HG      DBU   6 -14.625  12.451  13.795
   31    HG2  DBU   6           1HG      DBU   6 -14.900  11.101  14.884
   32    HG3  DBU   6           2HG      DBU   6 -16.277  11.968  14.196
   33    H    DAL   7           H        DAL   7 -16.638   7.195  12.896
   34    HA   DAL   7           HA       DAL   7 -15.247   6.222  10.548
   35    HB2  DAL   7           2HB      DAL   7 -17.318   7.702   9.923
   36    HB3  DAL   7           3HB      DAL   7 -18.236   6.269  10.381
   37    H    DHA   8           H        DHA   8 -18.286   5.573  12.196
   38    HB1  DHA   8           2HB      DHA   8 -18.586   4.529  14.642
   39    HB2  DHA   8           3HB      DHA   8 -18.788   2.677  14.564
   40    H    TRP   9           H        TRP   9 -19.542   1.654  13.156
   41    HA   TRP   9           HA       TRP   9 -18.103  -0.332  11.860
   42    HB2  TRP   9           2HB      TRP   9 -21.072   0.021  12.269
   43    HB3  TRP   9           3HB      TRP   9 -20.384  -1.425  11.535
   44    HD1  TRP   9           HD1      TRP   9 -21.274  -0.003  14.827
   45    HE1  TRP   9           HE1      TRP   9 -20.344  -1.471  16.726
   46    HE3  TRP   9           HE3      TRP   9 -18.085  -2.929  12.105
   47    HZ2  TRP   9           HZ2      TRP   9 -18.502  -3.588  17.030
   48    HZ3  TRP   9           HZ3      TRP   9 -16.776  -4.651  13.276
   49    HH2  TRP   9           HH2      TRP   9 -16.981  -4.973  15.687
   50    H    THR  10           H        THR  10 -20.244   2.113  10.546
   51    HA   THR  10           HA       THR  10 -20.672   1.083   7.996
   52    HB   THR  10           HB       THR  10 -20.255   4.017   8.566
   53    HG1  THR  10           HG1      THR  10 -21.720   3.405  10.093
   54   HG21  THR  10          3HG2      THR  10 -20.547   3.464   6.221
   55   HG22  THR  10          1HG2      THR  10 -21.991   4.274   6.826
   56   HG23  THR  10          2HG2      THR  10 -21.992   2.526   6.596
   57    H    CYS  11           H        CYS  11 -18.279   3.601   8.824
   58    HA   CYS  11           HA       CYS  11 -16.884   3.548   6.428
   59    HB2  CYS  11           2HB      CYS  11 -15.656   4.078   9.139
   60    HB3  CYS  11           3HB      CYS  11 -15.102   4.687   7.582
   61    H    ILE  12           H        ILE  12 -16.540   1.515   9.276
   62    HA   ILE  12           HA       ILE  12 -14.114   0.270   8.592
   63    HB   ILE  12           HB       ILE  12 -16.421  -0.575  10.319
   64   HG12  ILE  12          2HG1      ILE  12 -13.542   0.183  10.854
   65   HG13  ILE  12          3HG1      ILE  12 -14.969   1.147  11.219
   66   HG21  ILE  12          1HG2      ILE  12 -15.753  -2.678   9.629
   67   HG22  ILE  12          2HG2      ILE  12 -14.066  -2.197   9.452
   68   HG23  ILE  12          3HG2      ILE  12 -14.754  -2.422  11.060
   69   HD11  ILE  12          3HD1      ILE  12 -14.825   0.281  13.258
   70   HD12  ILE  12          1HD1      ILE  12 -15.465  -1.200  12.546
   71   HD13  ILE  12          2HD1      ILE  12 -13.723  -0.992  12.734
   72    H1   DBU  13           H        DBU  13 -17.315  -1.204   8.444
   73    HB1  DBU  13           HB       DBU  13 -17.964  -4.357   6.466
   74    HG1  DBU  13           3HG      DBU  13 -16.823  -4.274   9.035
   75    HG2  DBU  13           1HG      DBU  13 -18.529  -4.636   8.835
   76    HG3  DBU  13           2HG      DBU  13 -18.018  -2.981   9.176
   77    H    ALA  14           H        ALA  14 -17.600  -0.256   5.623
   78    HA   ALA  14           HA       ALA  14 -17.884  -1.172   2.967
   79    HB1  ALA  14           1HB      ALA  14 -18.952   0.850   3.482
   80    HB2  ALA  14           2HB      ALA  14 -17.483   1.554   4.159
   81    HB3  ALA  14           3HB      ALA  14 -17.620   1.303   2.418
   82    H    GLY  15           H        GLY  15 -15.173   0.327   4.697
   83    HA2  GLY  15           2HA      GLY  15 -13.457   0.422   2.419
   84    HA3  GLY  15           3HA      GLY  15 -12.970   0.625   4.095
   85    H    VAL  16           H        VAL  16 -13.645  -1.772   5.213
   86    HA   VAL  16           HA       VAL  16 -11.491  -3.399   4.684
   87    HB   VAL  16           HB       VAL  16 -14.188  -4.154   5.809
   88   HG11  VAL  16          1HG1      VAL  16 -12.900  -6.112   6.780
   89   HG12  VAL  16          2HG1      VAL  16 -13.275  -6.195   5.057
   90   HG13  VAL  16          3HG1      VAL  16 -11.652  -5.753   5.587
   91   HG21  VAL  16          3HG2      VAL  16 -11.800  -2.868   6.863
   92   HG22  VAL  16          1HG2      VAL  16 -13.429  -2.954   7.533
   93   HG23  VAL  16          2HG2      VAL  16 -12.292  -4.275   7.806
   94    H1   DBU  17           H        DBU  17 -14.757  -3.681   3.423
   95    HB1  DBU  17           HB       DBU  17 -15.859  -6.391   1.030
   96    HG1  DBU  17           3HG      DBU  17 -16.846  -4.983   3.368
   97    HG2  DBU  17           1HG      DBU  17 -15.652  -6.108   3.994
   98    HG3  DBU  17           2HG      DBU  17 -17.050  -6.718   3.105
   99    H    VAL  18           H        VAL  18 -13.478  -2.908   0.847
  100    HA   VAL  18           HA       VAL  18 -13.063  -3.859  -1.809
  101    HB   VAL  18           HB       VAL  18 -12.176  -1.367  -0.371
  102   HG11  VAL  18          1HG1      VAL  18 -10.624  -0.967  -1.905
  103   HG12  VAL  18          2HG1      VAL  18 -10.964  -2.521  -2.669
  104   HG13  VAL  18          3HG1      VAL  18 -11.846  -1.079  -3.171
  105   HG21  VAL  18          3HG2      VAL  18 -14.353  -0.970  -0.866
  106   HG22  VAL  18          1HG2      VAL  18 -13.670  -0.541  -2.434
  107   HG23  VAL  18          2HG2      VAL  18 -14.379  -2.137  -2.188
  108    H    DAL  19           H        DAL  19 -10.919  -3.237   0.947
  109    HA   DAL  19           HA       DAL  19  -8.825  -3.957   1.430
  110    HB2  DAL  19           2HB      DAL  19  -8.291  -2.491  -0.493
  111    HB3  DAL  19           3HB      DAL  19  -8.444  -3.879  -1.569
  112    H    ALA  20           H        ALA  20 -10.536  -5.969   1.599
  113    HA   ALA  20           HA       ALA  20  -8.956  -8.266   1.186
  114    HB1  ALA  20           1HB      ALA  20 -10.919  -9.519   1.969
  115    HB2  ALA  20           2HB      ALA  20 -10.565  -8.131   2.998
  116    HB3  ALA  20           3HB      ALA  20 -11.893  -8.054   1.840
  117    H    SER  21           H        SER  21 -10.586  -6.512  -1.057
  118    HA   SER  21           HA       SER  21 -11.614  -8.717  -2.632
  119    HB2  SER  21           2HB      SER  21 -12.160  -5.968  -2.484
  120    HB3  SER  21           3HB      SER  21 -11.438  -6.214  -4.074
  121    HG   SER  21           HG       SER  21 -13.788  -6.515  -3.900
  122    H    LEU  22           H        LEU  22  -9.013  -6.311  -2.889
  123    HA   LEU  22           HA       LEU  22  -7.714  -8.063  -4.871
  124    HB2  LEU  22           2HB      LEU  22  -7.195  -5.122  -4.743
  125    HB3  LEU  22           3HB      LEU  22  -6.951  -6.238  -6.084
  126    HG   LEU  22           HG       LEU  22  -9.596  -5.177  -5.094
  127   HD11  LEU  22          1HD1      LEU  22  -7.868  -4.565  -7.469
  128   HD12  LEU  22          2HD1      LEU  22  -8.560  -3.453  -6.288
  129   HD13  LEU  22          3HD1      LEU  22  -9.603  -4.244  -7.470
  130   HD21  LEU  22          3HD2      LEU  22 -10.298  -7.173  -5.906
  131   HD22  LEU  22          1HD2      LEU  22  -8.873  -7.388  -6.922
  132   HD23  LEU  22          2HD2      LEU  22 -10.173  -6.315  -7.442
  133    H    CYS  23           H        CYS  23  -7.117  -5.587  -2.388
  134    HA   CYS  23           HA       CYS  23  -4.532  -5.451  -1.985
  135    HB2  CYS  23           2HB      CYS  23  -6.422  -6.283   0.227
  136    HB3  CYS  23           3HB      CYS  23  -4.851  -5.522   0.455
  137    HA   PRO  24           HA       PRO  24  -2.694  -9.471  -2.349
  138    HB2  PRO  24           2HB      PRO  24  -0.650  -8.131  -0.639
  139    HB3  PRO  24           3HB      PRO  24  -0.440  -9.041  -2.139
  140    HG2  PRO  24           2HG      PRO  24  -0.331  -6.363  -2.103
  141    HG3  PRO  24           3HG      PRO  24  -1.036  -7.248  -3.468
  142    HD2  PRO  24           2HD      PRO  24  -2.359  -5.673  -1.347
  143    HD3  PRO  24           3HD      PRO  24  -2.867  -5.986  -3.019
  144    HN2  DB2  25           H        DB2  25  -2.902 -11.249  -1.147
  145    HA   DB2  25           HA       DB2  25  -2.725 -11.086   1.767
  146   HB2C  DB2  25          HB        DB2  25  -2.441 -13.214  -0.255
  147   HG1C  DB2  25          3HG       DB2  25  -1.129 -12.955   2.443
  148   HG2C  DB2  25          1HG       DB2  25  -0.636 -11.986   1.052
  149   HG3C  DB2  25          2HG       DB2  25  -0.514 -13.743   0.990
  150    H1   DBU  26           H        DBU  26  -5.032 -10.648  -0.422
  151    HB1  DBU  26           HB       DBU  26  -8.546 -10.184   1.118
  152    HG1  DBU  26           3HG      DBU  26  -6.800  -8.186   0.488
  153    HG2  DBU  26           1HG      DBU  26  -5.673  -9.125   1.452
  154    HG3  DBU  26           2HG      DBU  26  -7.119  -8.448   2.206
  155    H    LYS  27           H        LYS  27  -6.199 -12.920  -1.237
  156    HA   LYS  27           HA       LYS  27  -8.648 -14.497  -0.826
  157    HB2  LYS  27           2HB      LYS  27  -8.626 -15.078  -3.063
  158    HB3  LYS  27           3HB      LYS  27  -7.971 -13.447  -3.124
  159    HG2  LYS  27           2HG      LYS  27  -5.737 -14.288  -3.339
  160    HG3  LYS  27           3HG      LYS  27  -6.291 -15.944  -3.084
  161    HD2  LYS  27           2HD      LYS  27  -5.943 -15.639  -5.430
  162    HD3  LYS  27           3HD      LYS  27  -7.684 -15.712  -5.147
  163    HE2  LYS  27           2HE      LYS  27  -6.296 -13.067  -5.185
  164    HE3  LYS  27           3HE      LYS  27  -6.676 -13.874  -6.706
  165    HZ1  LYS  27           3HZ      LYS  27  -8.806 -13.325  -6.514
  166    HZ2  LYS  27           1HZ      LYS  27  -8.361 -12.293  -5.249
  167    HZ3  LYS  27           2HZ      LYS  27  -8.897 -13.862  -4.912
  168    H    CYS  28           H        CYS  28  -5.580 -14.489   0.184
  169    HA   CYS  28           HA       CYS  28  -4.933 -17.275  -0.278
  170    HB2  CYS  28           2HB      CYS  28  -2.988 -16.705   1.285
  171    HB3  CYS  28           3HB      CYS  28  -3.040 -15.867  -0.262
  172    HN2  DB2  29           H        DB2  29  -7.181 -17.633   0.815
  173    HA   DB2  29           HA       DB2  29  -6.612 -18.481   3.556
  174   HB2C  DB2  29          HB        DB2  29  -7.655 -19.921   1.644
  175   HG1C  DB2  29          3HG       DB2  29  -8.544 -19.891   4.527
  176   HG2C  DB2  29          1HG       DB2  29  -7.191 -20.772   3.813
  177   HG3C  DB2  29          2HG       DB2  29  -8.847 -21.236   3.427
  178    H    SER  30           H        SER  30  -7.310 -15.668   2.627
  179    HA   SER  30           HA       SER  30  -8.817 -14.944   4.895
  180    HB2  SER  30           2HB      SER  30  -7.615 -13.120   4.270
  181    HB3  SER  30           3HB      SER  30  -7.654 -13.557   2.561
  182    HG   SER  30           HG       SER  30  -9.086 -11.719   3.767
  183    H    ARG  31           H        ARG  31  -9.704 -15.644   1.588
  184    HA   ARG  31           HA       ARG  31 -12.529 -15.427   2.358
  185    HB2  ARG  31           2HB      ARG  31 -12.491 -13.517   1.096
  186    HB3  ARG  31           3HB      ARG  31 -11.137 -14.062   0.116
  187    HG2  ARG  31           2HG      ARG  31 -12.486 -15.241  -1.336
  188    HG3  ARG  31           3HG      ARG  31 -13.796 -15.388  -0.162
  189    HD2  ARG  31           2HD      ARG  31 -14.591 -13.812  -1.683
  190    HD3  ARG  31           3HD      ARG  31 -13.979 -12.834  -0.349
  191    HE   ARG  31           HE       ARG  31 -12.342 -12.010  -1.736
  192   HH11  ARG  31          1HH1      ARG  31 -13.896 -14.735  -3.247
  193   HH12  ARG  31          2HH1      ARG  31 -13.141 -14.479  -4.785
  194   HH21  ARG  31          1HH2      ARG  31 -11.342 -11.662  -3.756
  195   HH22  ARG  31          2HH2      ARG  31 -11.687 -12.731  -5.073
  196    H    CYS  32           H        CYS  32 -10.178 -16.669   0.016
  197    HA   CYS  32           HA       CYS  32 -10.370 -18.415  -1.493
  198    HB2  CYS  32           2HB      CYS  32 -11.288 -20.344   0.435
  199    HB3  CYS  32           3HB      CYS  32  -9.679 -20.140  -0.249
  Start of MODEL   14
    1    H41  2KT   1           2H4      2KT   1 -23.352  -0.889  15.368
    2    H42  2KT   1           3H4      2KT   1 -22.425   0.106  14.733
    3    H43  2KT   1           1H4      2KT   1 -22.420  -1.323  14.275
    4    H31  2KT   1           2H3      2KT   1 -22.105  -1.454  16.703
    5    H32  2KT   1           3H3      2KT   1 -21.092  -1.961  15.720
    6    H1   DBU   2           H        DBU   2 -21.843   2.036  16.084
    7    HB1  DBU   2           HB       DBU   2 -23.110   3.091  19.756
    8    HG1  DBU   2           3HG      DBU   2 -24.656   1.248  18.852
    9    HG2  DBU   2           1HG      DBU   2 -23.323   0.461  19.679
   10    HG3  DBU   2           2HG      DBU   2 -23.300   0.604  17.920
   11    HA   PRO   3           HA       PRO   3 -20.498   6.410  19.364
   12    HB2  PRO   3           2HB      PRO   3 -18.585   5.921  21.228
   13    HB3  PRO   3           3HB      PRO   3 -20.310   5.972  21.612
   14    HG2  PRO   3           2HG      PRO   3 -18.544   3.602  21.135
   15    HG3  PRO   3           3HG      PRO   3 -19.786   3.839  22.378
   16    HD2  PRO   3           2HD      PRO   3 -20.230   2.393  20.132
   17    HD3  PRO   3           3HD      PRO   3 -21.508   3.330  20.933
   18    H    ALA   4           H        ALA   4 -19.630   5.449  17.031
   19    HA   ALA   4           HA       ALA   4 -16.743   5.218  17.004
   20    HB1  ALA   4           1HB      ALA   4 -18.657   5.382  14.681
   21    HB2  ALA   4           2HB      ALA   4 -16.966   4.884  14.624
   22    HB3  ALA   4           3HB      ALA   4 -18.151   3.889  15.471
   23    H1   DBU   5           H        DBU   5 -16.798   7.425  18.094
   24    HB1  DBU   5           HB       DBU   5 -17.252  11.175  17.148
   25    HG1  DBU   5           3HG      DBU   5 -18.752   8.712  18.238
   26    HG2  DBU   5           1HG      DBU   5 -19.549   9.721  17.042
   27    HG3  DBU   5           2HG      DBU   5 -19.123  10.397  18.616
   28    H1   DBU   6           H        DBU   6 -16.032   9.887  14.707
   29    HB1  DBU   6           HB       DBU   6 -12.389  11.578  14.461
   30    HG1  DBU   6           3HG      DBU   6 -14.996  12.381  15.743
   31    HG2  DBU   6           1HG      DBU   6 -13.467  13.230  15.887
   32    HG3  DBU   6           2HG      DBU   6 -13.802  11.846  16.930
   33    H    DAL   7           H        DAL   7 -14.289   7.717  14.467
   34    HA   DAL   7           HA       DAL   7 -12.194   7.289  12.508
   35    HB2  DAL   7           2HB      DAL   7 -14.507   7.767  11.386
   36    HB3  DAL   7           3HB      DAL   7 -14.877   6.115  11.877
   37    H    DHA   8           H        DHA   8 -14.989   5.499  13.667
   38    HB1  DHA   8           2HB      DHA   8 -13.575   4.664  16.390
   39    HB2  DHA   8           3HB      DHA   8 -13.784   2.811  16.353
   40    H    TRP   9           H        TRP   9 -16.021   2.311  15.101
   41    HA   TRP   9           HA       TRP   9 -15.305   0.045  13.654
   42    HB2  TRP   9           2HB      TRP   9 -17.989   1.115  14.514
   43    HB3  TRP   9           3HB      TRP   9 -17.824  -0.421  13.668
   44    HD1  TRP   9           HD1      TRP   9 -17.886   0.968  17.066
   45    HE1  TRP   9           HE1      TRP   9 -17.052  -0.762  18.781
   46    HE3  TRP   9           HE3      TRP   9 -15.806  -2.421  13.854
   47    HZ2  TRP   9           HZ2      TRP   9 -15.692  -3.235  18.772
   48    HZ3  TRP   9           HZ3      TRP   9 -14.758  -4.442  14.787
   49    HH2  TRP   9           HH2      TRP   9 -14.703  -4.839  17.196
   50    H    THR  10           H        THR  10 -17.090   2.915  12.650
   51    HA   THR  10           HA       THR  10 -17.986   2.017  10.159
   52    HB   THR  10           HB       THR  10 -17.105   4.857  10.483
   53    HG1  THR  10           HG1      THR  10 -18.871   3.484  12.127
   54   HG21  THR  10          3HG2      THR  10 -19.467   3.449   9.251
   55   HG22  THR  10          1HG2      THR  10 -18.201   4.363   8.433
   56   HG23  THR  10          2HG2      THR  10 -19.383   5.200   9.439
   57    H    CYS  11           H        CYS  11 -15.093   3.982  10.875
   58    HA   CYS  11           HA       CYS  11 -14.017   4.022   8.322
   59    HB2  CYS  11           2HB      CYS  11 -12.613   4.026  10.999
   60    HB3  CYS  11           3HB      CYS  11 -11.816   4.380   9.469
   61    H    ILE  12           H        ILE  12 -13.776   1.558  10.821
   62    HA   ILE  12           HA       ILE  12 -11.769  -0.016   9.639
   63    HB   ILE  12           HB       ILE  12 -13.946  -0.593  11.612
   64   HG12  ILE  12          2HG1      ILE  12 -11.022  -1.127  11.970
   65   HG13  ILE  12          3HG1      ILE  12 -11.603   0.534  12.021
   66   HG21  ILE  12          1HG2      ILE  12 -13.981  -2.651  10.550
   67   HG22  ILE  12          2HG2      ILE  12 -12.265  -2.587  10.150
   68   HG23  ILE  12          3HG2      ILE  12 -12.772  -2.892  11.811
   69   HD11  ILE  12          3HD1      ILE  12 -12.929  -1.536  13.703
   70   HD12  ILE  12          1HD1      ILE  12 -11.384  -0.851  14.207
   71   HD13  ILE  12          2HD1      ILE  12 -12.778   0.202  13.964
   72    H1   DBU  13           H        DBU  13 -15.171  -0.907   9.839
   73    HB1  DBU  13           HB       DBU  13 -16.701  -3.524   7.599
   74    HG1  DBU  13           3HG      DBU  13 -15.279  -4.083   9.937
   75    HG2  DBU  13           1HG      DBU  13 -17.032  -3.997   9.991
   76    HG3  DBU  13           2HG      DBU  13 -16.071  -2.583  10.432
   77    H    ALA  14           H        ALA  14 -15.609   0.523   7.219
   78    HA   ALA  14           HA       ALA  14 -16.420   0.090   4.548
   79    HB1  ALA  14           1HB      ALA  14 -15.743   2.517   4.261
   80    HB2  ALA  14           2HB      ALA  14 -16.954   2.178   5.498
   81    HB3  ALA  14           3HB      ALA  14 -15.280   2.484   5.963
   82    H    GLY  15           H        GLY  15 -13.254   0.798   5.992
   83    HA2  GLY  15           2HA      GLY  15 -11.866   0.897   3.505
   84    HA3  GLY  15           3HA      GLY  15 -11.134   0.743   5.096
   85    H    VAL  16           H        VAL  16 -12.137  -1.623   6.003
   86    HA   VAL  16           HA       VAL  16 -10.466  -3.529   4.939
   87    HB   VAL  16           HB       VAL  16 -13.087  -3.914   6.383
   88   HG11  VAL  16          1HG1      VAL  16 -11.704  -6.192   6.858
   89   HG12  VAL  16          2HG1      VAL  16 -12.951  -6.028   5.619
   90   HG13  VAL  16          3HG1      VAL  16 -11.248  -5.871   5.185
   91   HG21  VAL  16          3HG2      VAL  16 -11.758  -4.222   8.337
   92   HG22  VAL  16          1HG2      VAL  16 -10.268  -4.229   7.394
   93   HG23  VAL  16          2HG2      VAL  16 -11.203  -2.742   7.556
   94    H1   DBU  17           H        DBU  17 -13.855  -2.990   4.191
   95    HB1  DBU  17           HB       DBU  17 -15.807  -5.040   1.686
   96    HG1  DBU  17           3HG      DBU  17 -16.377  -5.771   4.006
   97    HG2  DBU  17           1HG      DBU  17 -16.605  -4.033   4.096
   98    HG3  DBU  17           2HG      DBU  17 -15.095  -4.750   4.666
   99    H    VAL  18           H        VAL  18 -12.798  -2.085   1.555
  100    HA   VAL  18           HA       VAL  18 -12.935  -2.698  -1.229
  101    HB   VAL  18           HB       VAL  18 -11.387  -0.638   0.330
  102   HG11  VAL  18          1HG1      VAL  18 -10.737  -1.645  -2.234
  103   HG12  VAL  18          2HG1      VAL  18 -11.422  -0.034  -2.451
  104   HG13  VAL  18          3HG1      VAL  18 -10.034  -0.267  -1.388
  105   HG21  VAL  18          3HG2      VAL  18 -13.452   0.262   0.247
  106   HG22  VAL  18          1HG2      VAL  18 -12.983   0.696  -1.397
  107   HG23  VAL  18          2HG2      VAL  18 -13.953  -0.749  -1.108
  108    H    DAL  19           H        DAL  19 -10.324  -2.784   1.181
  109    HA   DAL  19           HA       DAL  19  -8.385  -3.960   1.260
  110    HB2  DAL  19           2HB      DAL  19  -7.867  -2.322  -0.549
  111    HB3  DAL  19           3HB      DAL  19  -8.357  -3.532  -1.733
  112    H    ALA  20           H        ALA  20 -10.455  -5.636   1.396
  113    HA   ALA  20           HA       ALA  20  -9.404  -8.093   0.521
  114    HB1  ALA  20           1HB      ALA  20 -12.166  -7.416   1.525
  115    HB2  ALA  20           2HB      ALA  20 -11.542  -9.053   1.313
  116    HB3  ALA  20           3HB      ALA  20 -10.795  -7.969   2.487
  117    H    SER  21           H        SER  21 -10.851  -5.763  -1.292
  118    HA   SER  21           HA       SER  21 -12.404  -7.490  -3.020
  119    HB2  SER  21           2HB      SER  21 -11.634  -4.625  -3.574
  120    HB3  SER  21           3HB      SER  21 -13.017  -5.521  -4.201
  121    HG   SER  21           HG       SER  21 -13.951  -5.462  -2.183
  122    H    LEU  22           H        LEU  22  -9.420  -5.574  -3.268
  123    HA   LEU  22           HA       LEU  22  -8.642  -7.255  -5.560
  124    HB2  LEU  22           2HB      LEU  22  -7.575  -4.492  -5.148
  125    HB3  LEU  22           3HB      LEU  22  -7.640  -5.450  -6.625
  126    HG   LEU  22           HG       LEU  22  -9.880  -3.951  -5.287
  127   HD11  LEU  22          1HD1      LEU  22  -8.388  -3.726  -7.873
  128   HD12  LEU  22          2HD1      LEU  22  -8.712  -2.487  -6.662
  129   HD13  LEU  22          3HD1      LEU  22 -10.015  -3.067  -7.699
  130   HD21  LEU  22          3HD2      LEU  22 -10.006  -6.367  -6.866
  131   HD22  LEU  22          1HD2      LEU  22 -10.837  -5.030  -7.662
  132   HD23  LEU  22          2HD2      LEU  22 -11.293  -5.502  -6.025
  133    H    CYS  23           H        CYS  23  -7.380  -5.269  -2.891
  134    HA   CYS  23           HA       CYS  23  -4.789  -5.666  -2.760
  135    HB2  CYS  23           2HB      CYS  23  -6.594  -6.396  -0.443
  136    HB3  CYS  23           3HB      CYS  23  -4.900  -5.931  -0.327
  137    HA   PRO  24           HA       PRO  24  -3.923  -9.916  -3.756
  138    HB2  PRO  24           2HB      PRO  24  -1.411  -9.165  -2.333
  139    HB3  PRO  24           3HB      PRO  24  -1.624  -9.948  -3.903
  140    HG2  PRO  24           2HG      PRO  24  -0.965  -7.357  -3.711
  141    HG3  PRO  24           3HG      PRO  24  -2.036  -7.953  -4.992
  142    HD2  PRO  24           2HD      PRO  24  -2.668  -6.369  -2.580
  143    HD3  PRO  24           3HD      PRO  24  -3.480  -6.414  -4.159
  144    HN2  DB2  25           H        DB2  25  -4.106 -11.794  -2.667
  145    HA   DB2  25           HA       DB2  25  -3.576 -11.885   0.204
  146   HB2C  DB2  25          HB        DB2  25  -4.262 -14.024  -1.801
  147   HG1C  DB2  25          3HG       DB2  25  -2.060 -13.260  -2.149
  148   HG2C  DB2  25          1HG       DB2  25  -1.893 -14.745  -1.209
  149   HG3C  DB2  25          2HG       DB2  25  -1.726 -13.178  -0.419
  150    H1   DBU  26           H        DBU  26  -6.004 -10.807  -1.472
  151    HB1  DBU  26           HB       DBU  26  -9.238 -10.048   0.405
  152    HG1  DBU  26           3HG      DBU  26  -7.499  -8.198  -0.416
  153    HG2  DBU  26           1HG      DBU  26  -6.248  -9.296   0.142
  154    HG3  DBU  26           2HG      DBU  26  -7.368  -8.580   1.304
  155    H    LYS  27           H        LYS  27  -7.191 -13.468  -1.511
  156    HA   LYS  27           HA       LYS  27  -9.864 -14.598  -1.011
  157    HB2  LYS  27           2HB      LYS  27  -9.823 -15.663  -3.191
  158    HB3  LYS  27           3HB      LYS  27  -9.625 -13.926  -3.377
  159    HG2  LYS  27           2HG      LYS  27  -7.999 -14.604  -4.793
  160    HG3  LYS  27           3HG      LYS  27  -7.056 -14.608  -3.301
  161    HD2  LYS  27           2HD      LYS  27  -6.596 -16.667  -4.366
  162    HD3  LYS  27           3HD      LYS  27  -7.713 -17.043  -3.052
  163    HE2  LYS  27           2HE      LYS  27  -9.525 -16.689  -4.916
  164    HE3  LYS  27           3HE      LYS  27  -8.176 -17.024  -6.000
  165    HZ1  LYS  27           3HZ      LYS  27  -7.814 -19.073  -4.564
  166    HZ2  LYS  27           1HZ      LYS  27  -9.149 -19.087  -5.604
  167    HZ3  LYS  27           2HZ      LYS  27  -9.367 -18.791  -3.953
  168    H    CYS  28           H        CYS  28  -6.594 -14.868  -0.509
  169    HA   CYS  28           HA       CYS  28  -6.464 -17.765  -0.532
  170    HB2  CYS  28           2HB      CYS  28  -4.149 -17.328   0.433
  171    HB3  CYS  28           3HB      CYS  28  -4.447 -16.708  -1.187
  172    HN2  DB2  29           H        DB2  29  -8.372 -17.704   1.023
  173    HA   DB2  29           HA       DB2  29  -7.309 -17.881   3.758
  174   HB2C  DB2  29          HB        DB2  29  -8.510 -19.813   2.494
  175   HG1C  DB2  29          3HG       DB2  29  -7.709 -19.677   4.875
  176   HG2C  DB2  29          1HG       DB2  29  -9.068 -20.770   4.599
  177   HG3C  DB2  29          2HG       DB2  29  -9.343 -19.186   5.323
  178    H    SER  30           H        SER  30  -8.141 -15.378   2.423
  179    HA   SER  30           HA       SER  30  -9.554 -14.251   4.604
  180    HB2  SER  30           2HB      SER  30  -9.763 -12.350   2.660
  181    HB3  SER  30           3HB      SER  30  -8.343 -12.570   3.682
  182    HG   SER  30           HG       SER  30  -8.662 -13.966   1.246
  183    H    ARG  31           H        ARG  31 -10.503 -14.611   1.183
  184    HA   ARG  31           HA       ARG  31 -13.312 -14.645   2.074
  185    HB2  ARG  31           2HB      ARG  31 -12.979 -12.629   0.845
  186    HB3  ARG  31           3HB      ARG  31 -12.085 -13.468  -0.416
  187    HG2  ARG  31           2HG      ARG  31 -13.959 -14.208  -1.448
  188    HG3  ARG  31           3HG      ARG  31 -14.868 -14.345   0.058
  189    HD2  ARG  31           2HD      ARG  31 -15.919 -12.552  -0.910
  190    HD3  ARG  31           3HD      ARG  31 -14.684 -11.731   0.042
  191    HE   ARG  31           HE       ARG  31 -13.472 -12.077  -2.343
  192   HH11  ARG  31          1HH1      ARG  31 -16.557 -10.757  -1.417
  193   HH12  ARG  31          2HH1      ARG  31 -16.628  -9.647  -2.746
  194   HH21  ARG  31          1HH2      ARG  31 -13.553 -10.620  -4.096
  195   HH22  ARG  31          2HH2      ARG  31 -14.919  -9.570  -4.269
  196    H    CYS  32           H        CYS  32 -11.829 -16.983   2.008
  197    HA   CYS  32           HA       CYS  32 -12.338 -18.338  -0.501
  198    HB2  CYS  32           2HB      CYS  32 -11.515 -20.348   0.966
  199    HB3  CYS  32           3HB      CYS  32 -10.369 -19.125   0.427
  Start of MODEL   15
    1    H41  2KT   1           2H4      2KT   1 -21.620  -1.511  21.422
    2    H42  2KT   1           3H4      2KT   1 -20.473  -0.866  22.141
    3    H43  2KT   1           1H4      2KT   1 -21.628  -0.032  21.671
    4    H31  2KT   1           2H3      2KT   1 -20.942  -1.200  19.656
    5    H32  2KT   1           3H3      2KT   1 -20.831   0.288  19.801
    6    H1   DBU   2           H        DBU   2 -16.862  -1.197  19.593
    7    HB1  DBU   2           HB       DBU   2 -14.874   0.258  16.780
    8    HG1  DBU   2           3HG      DBU   2 -16.351  -2.194  17.925
    9    HG2  DBU   2           1HG      DBU   2 -14.601  -2.131  18.057
   10    HG3  DBU   2           2HG      DBU   2 -15.359  -2.175  16.463
   11    HA   PRO   3           HA       PRO   3 -17.022   4.301  19.384
   12    HB2  PRO   3           2HB      PRO   3 -15.109   4.988  21.184
   13    HB3  PRO   3           3HB      PRO   3 -16.600   4.154  21.638
   14    HG2  PRO   3           2HG      PRO   3 -13.863   3.029  21.187
   15    HG3  PRO   3           3HG      PRO   3 -15.029   2.656  22.470
   16    HD2  PRO   3           2HD      PRO   3 -14.684   1.063  20.307
   17    HD3  PRO   3           3HD      PRO   3 -16.251   1.241  21.121
   18    H    ALA   4           H        ALA   4 -15.812   3.798  17.058
   19    HA   ALA   4           HA       ALA   4 -13.230   5.105  16.920
   20    HB1  ALA   4           1HB      ALA   4 -14.640   4.555  14.405
   21    HB2  ALA   4           2HB      ALA   4 -13.004   4.129  14.910
   22    HB3  ALA   4           3HB      ALA   4 -14.372   3.145  15.431
   23    H1   DBU   5           H        DBU   5 -14.359   7.035  17.902
   24    HB1  DBU   5           HB       DBU   5 -15.817  10.411  17.539
   25    HG1  DBU   5           3HG      DBU   5 -15.612   9.725  19.848
   26    HG2  DBU   5           1HG      DBU   5 -14.336   8.620  19.365
   27    HG3  DBU   5           2HG      DBU   5 -16.020   8.091  19.315
   28    H1   DBU   6           H        DBU   6 -13.329   9.573  15.356
   29    HB1  DBU   6           HB       DBU   6 -14.096  11.775  12.296
   30    HG1  DBU   6           3HG      DBU   6 -12.924  12.602  14.601
   31    HG2  DBU   6           1HG      DBU   6 -14.278  11.795  15.375
   32    HG3  DBU   6           2HG      DBU   6 -14.570  13.178  14.316
   33    H    DAL   7           H        DAL   7 -15.663   8.051  13.331
   34    HA   DAL   7           HA       DAL   7 -14.394   6.957  10.970
   35    HB2  DAL   7           2HB      DAL   7 -16.284   8.660  10.354
   36    HB3  DAL   7           3HB      DAL   7 -17.361   7.342  10.813
   37    H    DHA   8           H        DHA   8 -17.521   6.604  12.536
   38    HB1  DHA   8           2HB      DHA   8 -17.979   5.595  14.982
   39    HB2  DHA   8           3HB      DHA   8 -18.360   3.772  14.890
   40    H    TRP   9           H        TRP   9 -19.174   2.831  13.458
   41    HA   TRP   9           HA       TRP   9 -17.901   0.718  12.186
   42    HB2  TRP   9           2HB      TRP   9 -20.747   1.381  12.794
   43    HB3  TRP   9           3HB      TRP   9 -20.423   0.042  11.696
   44    HD1  TRP   9           HD1      TRP   9 -21.111   0.541  15.170
   45    HE1  TRP   9           HE1      TRP   9 -20.155  -1.344  16.640
   46    HE3  TRP   9           HE3      TRP   9 -17.862  -1.536  11.814
   47    HZ2  TRP   9           HZ2      TRP   9 -18.273  -3.434  16.406
   48    HZ3  TRP   9           HZ3      TRP   9 -16.520  -3.475  12.516
   49    HH2  TRP   9           HH2      TRP   9 -16.722  -4.403  14.766
   50    H    THR  10           H        THR  10 -19.803   3.344  10.840
   51    HA   THR  10           HA       THR  10 -20.256   2.365   8.276
   52    HB   THR  10           HB       THR  10 -19.822   5.184   9.256
   53    HG1  THR  10           HG1      THR  10 -22.214   4.129   8.204
   54   HG21  THR  10          3HG2      THR  10 -19.348   5.643   7.086
   55   HG22  THR  10          1HG2      THR  10 -21.099   5.541   6.914
   56   HG23  THR  10          2HG2      THR  10 -20.089   4.156   6.496
   57    H    CYS  11           H        CYS  11 -17.671   4.656   9.182
   58    HA   CYS  11           HA       CYS  11 -16.235   4.511   6.815
   59    HB2  CYS  11           2HB      CYS  11 -15.020   4.888   9.557
   60    HB3  CYS  11           3HB      CYS  11 -14.384   5.469   8.022
   61    H    ILE  12           H        ILE  12 -16.133   2.416   9.637
   62    HA   ILE  12           HA       ILE  12 -13.816   0.966   8.980
   63    HB   ILE  12           HB       ILE  12 -16.241   0.217  10.603
   64   HG12  ILE  12          2HG1      ILE  12 -13.401   0.978  11.315
   65   HG13  ILE  12          3HG1      ILE  12 -14.848   1.943  11.587
   66   HG21  ILE  12          1HG2      ILE  12 -14.540  -1.603  11.443
   67   HG22  ILE  12          2HG2      ILE  12 -15.564  -1.896  10.039
   68   HG23  ILE  12          3HG2      ILE  12 -13.881  -1.418   9.818
   69   HD11  ILE  12          3HD1      ILE  12 -13.919  -0.510  13.011
   70   HD12  ILE  12          1HD1      ILE  12 -14.410   1.051  13.669
   71   HD13  ILE  12          2HD1      ILE  12 -15.622  -0.055  13.022
   72    H1   DBU  13           H        DBU  13 -17.130  -0.219   8.754
   73    HB1  DBU  13           HB       DBU  13 -18.020  -3.271   6.713
   74    HG1  DBU  13           3HG      DBU  13 -18.661  -3.523   9.066
   75    HG2  DBU  13           1HG      DBU  13 -18.008  -1.940   9.449
   76    HG3  DBU  13           2HG      DBU  13 -16.922  -3.324   9.300
   77    H    ALA  14           H        ALA  14 -17.275   0.792   5.940
   78    HA   ALA  14           HA       ALA  14 -17.585  -0.059   3.266
   79    HB1  ALA  14           1HB      ALA  14 -17.121   2.563   4.602
   80    HB2  ALA  14           2HB      ALA  14 -16.936   2.448   2.852
   81    HB3  ALA  14           3HB      ALA  14 -18.474   2.028   3.605
   82    H    GLY  15           H        GLY  15 -14.786   1.170   5.068
   83    HA2  GLY  15           2HA      GLY  15 -13.022   1.143   2.827
   84    HA3  GLY  15           3HA      GLY  15 -12.553   1.272   4.515
   85    H    VAL  16           H        VAL  16 -13.461  -1.072   5.576
   86    HA   VAL  16           HA       VAL  16 -11.454  -2.879   5.052
   87    HB   VAL  16           HB       VAL  16 -14.226  -3.390   6.128
   88   HG11  VAL  16          1HG1      VAL  16 -11.984  -5.248   5.582
   89   HG12  VAL  16          2HG1      VAL  16 -12.840  -5.442   7.113
   90   HG13  VAL  16          3HG1      VAL  16 -13.723  -5.539   5.589
   91   HG21  VAL  16          3HG2      VAL  16 -12.194  -1.986   7.244
   92   HG22  VAL  16          1HG2      VAL  16 -13.420  -2.860   8.162
   93   HG23  VAL  16          2HG2      VAL  16 -11.853  -3.606   7.851
   94    H1   DBU  17           H        DBU  17 -14.707  -2.835   3.730
   95    HB1  DBU  17           HB       DBU  17 -16.009  -5.395   1.272
   96    HG1  DBU  17           3HG      DBU  17 -16.045  -4.236   4.145
   97    HG2  DBU  17           1HG      DBU  17 -16.452  -5.913   3.824
   98    HG3  DBU  17           2HG      DBU  17 -17.496  -4.625   3.216
   99    H    VAL  18           H        VAL  18 -13.321  -2.140   1.191
  100    HA   VAL  18           HA       VAL  18 -12.948  -3.078  -1.475
  101    HB   VAL  18           HB       VAL  18 -11.862  -0.704   0.023
  102   HG11  VAL  18          1HG1      VAL  18 -10.723  -1.924  -2.278
  103   HG12  VAL  18          2HG1      VAL  18 -11.459  -0.396  -2.765
  104   HG13  VAL  18          3HG1      VAL  18 -10.252  -0.425  -1.478
  105   HG21  VAL  18          3HG2      VAL  18 -13.244   0.264  -2.079
  106   HG22  VAL  18          1HG2      VAL  18 -14.112  -1.246  -1.802
  107   HG23  VAL  18          2HG2      VAL  18 -13.963  -0.063  -0.502
  108    H    DAL  19           H        DAL  19 -10.808  -2.712   1.328
  109    HA   DAL  19           HA       DAL  19  -8.795  -3.625   1.828
  110    HB2  DAL  19           2HB      DAL  19  -8.092  -2.183  -0.057
  111    HB3  DAL  19           3HB      DAL  19  -8.360  -3.529  -1.164
  112    H    ALA  20           H        ALA  20 -10.682  -5.475   1.939
  113    HA   ALA  20           HA       ALA  20  -9.313  -7.900   1.503
  114    HB1  ALA  20           1HB      ALA  20 -12.224  -7.425   2.132
  115    HB2  ALA  20           2HB      ALA  20 -11.395  -8.979   2.241
  116    HB3  ALA  20           3HB      ALA  20 -10.922  -7.650   3.301
  117    H    SER  21           H        SER  21 -10.746  -5.966  -0.726
  118    HA   SER  21           HA       SER  21 -11.953  -8.041  -2.350
  119    HB2  SER  21           2HB      SER  21 -12.226  -5.245  -2.165
  120    HB3  SER  21           3HB      SER  21 -11.545  -5.557  -3.762
  121    HG   SER  21           HG       SER  21 -13.287  -7.220  -3.884
  122    H    LEU  22           H        LEU  22  -9.141  -5.879  -2.537
  123    HA   LEU  22           HA       LEU  22  -7.984  -7.708  -4.537
  124    HB2  LEU  22           2HB      LEU  22  -7.200  -4.829  -4.347
  125    HB3  LEU  22           3HB      LEU  22  -7.040  -5.939  -5.707
  126    HG   LEU  22           HG       LEU  22  -9.581  -4.638  -4.731
  127   HD11  LEU  22          1HD1      LEU  22  -9.473  -3.734  -7.126
  128   HD12  LEU  22          2HD1      LEU  22  -7.772  -4.199  -7.081
  129   HD13  LEU  22          3HD1      LEU  22  -8.396  -3.023  -5.924
  130   HD21  LEU  22          3HD2      LEU  22  -9.081  -6.933  -6.516
  131   HD22  LEU  22          1HD2      LEU  22 -10.228  -5.727  -7.099
  132   HD23  LEU  22          2HD2      LEU  22 -10.502  -6.528  -5.552
  133    H    CYS  23           H        CYS  23  -7.196  -5.347  -1.996
  134    HA   CYS  23           HA       CYS  23  -4.614  -5.453  -1.564
  135    HB2  CYS  23           2HB      CYS  23  -6.602  -6.150   0.608
  136    HB3  CYS  23           3HB      CYS  23  -4.969  -5.545   0.870
  137    HA   PRO  24           HA       PRO  24  -3.137  -9.613  -1.984
  138    HB2  PRO  24           2HB      PRO  24  -1.013  -8.500  -0.210
  139    HB3  PRO  24           3HB      PRO  24  -0.858  -9.393  -1.727
  140    HG2  PRO  24           2HG      PRO  24  -0.509  -6.738  -1.627
  141    HG3  PRO  24           3HG      PRO  24  -1.265  -7.526  -3.024
  142    HD2  PRO  24           2HD      PRO  24  -2.480  -5.883  -0.890
  143    HD3  PRO  24           3HD      PRO  24  -2.983  -6.113  -2.576
  144    HN2  DB2  25           H        DB2  25  -3.548 -11.385  -0.830
  145    HA   DB2  25           HA       DB2  25  -3.397 -11.308   2.090
  146   HB2C  DB2  25          HB        DB2  25  -3.288 -13.405   0.020
  147   HG1C  DB2  25          3HG       DB2  25  -1.932 -12.800   2.635
  148   HG2C  DB2  25          1HG       DB2  25  -1.259 -12.778   1.003
  149   HG3C  DB2  25          2HG       DB2  25  -1.659 -14.313   1.771
  150    H1   DBU  26           H        DBU  26  -5.619 -10.614  -0.131
  151    HB1  DBU  26           HB       DBU  26  -9.093  -9.844   1.394
  152    HG1  DBU  26           3HG      DBU  26  -6.141  -9.096   1.839
  153    HG2  DBU  26           1HG      DBU  26  -7.524  -8.280   2.549
  154    HG3  DBU  26           2HG      DBU  26  -7.132  -8.021   0.847
  155    H    LYS  27           H        LYS  27  -6.915 -12.802  -0.920
  156    HA   LYS  27           HA       LYS  27  -9.524 -14.137  -0.613
  157    HB2  LYS  27           2HB      LYS  27  -9.307 -14.890  -2.917
  158    HB3  LYS  27           3HB      LYS  27  -9.176 -13.137  -2.837
  159    HG2  LYS  27           2HG      LYS  27  -7.445 -13.552  -4.234
  160    HG3  LYS  27           3HG      LYS  27  -6.591 -13.719  -2.698
  161    HD2  LYS  27           2HD      LYS  27  -6.091 -15.555  -4.272
  162    HD3  LYS  27           3HD      LYS  27  -6.841 -16.125  -2.779
  163    HE2  LYS  27           2HE      LYS  27  -7.662 -17.026  -5.085
  164    HE3  LYS  27           3HE      LYS  27  -8.828 -16.647  -3.817
  165    HZ1  LYS  27           3HZ      LYS  27  -9.186 -15.778  -6.223
  166    HZ2  LYS  27           1HZ      LYS  27  -8.098 -14.568  -5.760
  167    HZ3  LYS  27           2HZ      LYS  27  -9.542 -14.778  -4.906
  168    H    CYS  28           H        CYS  28  -6.537 -14.438   0.458
  169    HA   CYS  28           HA       CYS  28  -6.046 -17.216  -0.210
  170    HB2  CYS  28           2HB      CYS  28  -4.150 -16.863   1.518
  171    HB3  CYS  28           3HB      CYS  28  -4.049 -16.017  -0.023
  172    HN2  DB2  29           H        DB2  29  -8.318 -17.579   0.762
  173    HA   DB2  29           HA       DB2  29  -7.914 -18.595   3.477
  174   HB2C  DB2  29          HB        DB2  29  -8.894 -19.884   1.406
  175   HG1C  DB2  29          3HG       DB2  29 -10.121 -20.175   4.150
  176   HG2C  DB2  29          1HG       DB2  29  -8.478 -20.670   3.732
  177   HG3C  DB2  29          2HG       DB2  29  -9.858 -21.443   2.953
  178    H    SER  30           H        SER  30  -8.512 -15.724   2.662
  179    HA   SER  30           HA       SER  30  -9.953 -14.956   4.885
  180    HB2  SER  30           2HB      SER  30  -8.720 -13.654   2.751
  181    HB3  SER  30           3HB      SER  30 -10.401 -13.127   2.667
  182    HG   SER  30           HG       SER  30 -10.232 -12.511   4.865
  183    H    ARG  31           H        ARG  31 -11.154 -15.377   1.564
  184    HA   ARG  31           HA       ARG  31 -13.859 -15.687   2.679
  185    HB2  ARG  31           2HB      ARG  31 -14.834 -14.338   1.041
  186    HB3  ARG  31           3HB      ARG  31 -13.384 -13.449   1.489
  187    HG2  ARG  31           2HG      ARG  31 -13.376 -15.335  -0.835
  188    HG3  ARG  31           3HG      ARG  31 -13.969 -13.681  -0.998
  189    HD2  ARG  31           2HD      ARG  31 -11.390 -13.917   0.374
  190    HD3  ARG  31           3HD      ARG  31 -11.372 -14.456  -1.305
  191    HE   ARG  31           HE       ARG  31 -11.441 -11.788  -0.415
  192   HH11  ARG  31          1HH1      ARG  31 -12.866 -13.869  -2.814
  193   HH12  ARG  31          2HH1      ARG  31 -13.134 -12.591  -3.953
  194   HH21  ARG  31          1HH2      ARG  31 -11.788 -10.096  -1.905
  195   HH22  ARG  31          2HH2      ARG  31 -12.520 -10.445  -3.435
  196    H    CYS  32           H        CYS  32 -11.565 -16.463   0.135
  197    HA   CYS  32           HA       CYS  32 -11.698 -18.006  -1.590
  198    HB2  CYS  32           2HB      CYS  32 -12.475 -20.209   0.091
  199    HB3  CYS  32           3HB      CYS  32 -10.891 -19.831  -0.580
  Start of MODEL   16
    1    H41  2KT   1           2H4      2KT   1 -17.026   4.628  19.965
    2    H42  2KT   1           3H4      2KT   1 -17.263   5.815  20.851
    3    H43  2KT   1           1H4      2KT   1 -16.085   4.921  21.096
    4    H31  2KT   1           2H3      2KT   1 -17.712   3.265  21.198
    5    H32  2KT   1           3H3      2KT   1 -17.173   3.845  22.471
    6    H1   DBU   2           H        DBU   2 -20.936   5.923  21.581
    7    HB1  DBU   2           HB       DBU   2 -24.141   4.026  20.570
    8    HG1  DBU   2           3HG      DBU   2 -24.237   4.076  22.986
    9    HG2  DBU   2           1HG      DBU   2 -23.161   5.462  22.914
   10    HG3  DBU   2           2HG      DBU   2 -22.488   3.833  23.025
   11    HA   PRO   3           HA       PRO   3 -23.133   4.791  16.409
   12    HB2  PRO   3           2HB      PRO   3 -23.108   7.398  15.650
   13    HB3  PRO   3           3HB      PRO   3 -24.507   6.632  16.412
   14    HG2  PRO   3           2HG      PRO   3 -22.397   8.368  17.635
   15    HG3  PRO   3           3HG      PRO   3 -24.151   8.392  17.891
   16    HD2  PRO   3           2HD      PRO   3 -22.441   7.224  19.634
   17    HD3  PRO   3           3HD      PRO   3 -24.087   6.619  19.362
   18    H    ALA   4           H        ALA   4 -20.386   5.232  17.904
   19    HA   ALA   4           HA       ALA   4 -18.237   4.946  17.111
   20    HB1  ALA   4           1HB      ALA   4 -17.765   4.727  14.871
   21    HB2  ALA   4           2HB      ALA   4 -19.482   4.322  14.902
   22    HB3  ALA   4           3HB      ALA   4 -18.963   5.928  14.389
   23    H1   DBU   5           H        DBU   5 -19.643   7.614  15.275
   24    HB1  DBU   5           HB       DBU   5 -18.970  11.250  16.091
   25    HG1  DBU   5           3HG      DBU   5 -20.991   8.924  15.918
   26    HG2  DBU   5           1HG      DBU   5 -21.382  10.625  15.722
   27    HG3  DBU   5           2HG      DBU   5 -21.014   9.989  17.328
   28    H1   DBU   6           H        DBU   6 -17.346   9.789  13.734
   29    HB1  DBU   6           HB       DBU   6 -13.591  11.132  14.468
   30    HG1  DBU   6           3HG      DBU   6 -14.987  12.882  15.566
   31    HG2  DBU   6           1HG      DBU   6 -15.158  11.534  16.677
   32    HG3  DBU   6           2HG      DBU   6 -16.410  11.840  15.471
   33    H    DAL   7           H        DAL   7 -15.256   7.459  14.135
   34    HA   DAL   7           HA       DAL   7 -13.170   7.215  12.137
   35    HB2  DAL   7           2HB      DAL   7 -15.559   7.286  11.069
   36    HB3  DAL   7           3HB      DAL   7 -15.665   5.629  11.659
   37    H    DHA   8           H        DHA   8 -15.648   5.118  13.485
   38    HB1  DHA   8           2HB      DHA   8 -14.003   4.661  16.187
   39    HB2  DHA   8           3HB      DHA   8 -13.970   2.798  16.269
   40    H    TRP   9           H        TRP   9 -16.212   1.955  15.154
   41    HA   TRP   9           HA       TRP   9 -15.271  -0.298  13.813
   42    HB2  TRP   9           2HB      TRP   9 -17.970   0.508  14.850
   43    HB3  TRP   9           3HB      TRP   9 -17.785  -0.988  13.938
   44    HD1  TRP   9           HD1      TRP   9 -17.977   0.018  17.350
   45    HE1  TRP   9           HE1      TRP   9 -16.737  -1.594  18.928
   46    HE3  TRP   9           HE3      TRP   9 -15.139  -2.470  13.902
   47    HZ2  TRP   9           HZ2      TRP   9 -14.810  -3.648  18.736
   48    HZ3  TRP   9           HZ3      TRP   9 -13.622  -4.244  14.681
   49    HH2  TRP   9           HH2      TRP   9 -13.463  -4.819  17.049
   50    H    THR  10           H        THR  10 -17.354   2.309  12.717
   51    HA   THR  10           HA       THR  10 -18.269   1.135  10.334
   52    HB   THR  10           HB       THR  10 -17.768   4.074  10.839
   53    HG1  THR  10           HG1      THR  10 -19.394   3.921  12.172
   54   HG21  THR  10          3HG2      THR  10 -18.455   4.312   8.728
   55   HG22  THR  10          1HG2      THR  10 -20.030   3.717   9.249
   56   HG23  THR  10          2HG2      THR  10 -18.836   2.596   8.594
   57    H    CYS  11           H        CYS  11 -15.618   3.481  10.800
   58    HA   CYS  11           HA       CYS  11 -14.657   3.488   8.200
   59    HB2  CYS  11           2HB      CYS  11 -13.150   3.835  10.798
   60    HB3  CYS  11           3HB      CYS  11 -12.482   4.203   9.211
   61    H    ILE  12           H        ILE  12 -14.008   1.243  10.829
   62    HA   ILE  12           HA       ILE  12 -11.865  -0.143   9.650
   63    HB   ILE  12           HB       ILE  12 -13.877  -0.867  11.750
   64   HG12  ILE  12          2HG1      ILE  12 -10.900  -0.978  12.029
   65   HG13  ILE  12          3HG1      ILE  12 -11.694   0.592  11.984
   66   HG21  ILE  12          1HG2      ILE  12 -12.251  -2.941  11.994
   67   HG22  ILE  12          2HG2      ILE  12 -13.681  -2.997  10.964
   68   HG23  ILE  12          3HG2      ILE  12 -12.093  -2.709  10.253
   69   HD11  ILE  12          3HD1      ILE  12 -13.095  -0.098  13.884
   70   HD12  ILE  12          1HD1      ILE  12 -12.213  -1.623  13.951
   71   HD13  ILE  12          2HD1      ILE  12 -11.372  -0.104  14.262
   72    H1   DBU  13           H        DBU  13 -15.120  -1.428  10.062
   73    HB1  DBU  13           HB       DBU  13 -16.394  -4.358   8.061
   74    HG1  DBU  13           3HG      DBU  13 -14.823  -4.576  10.364
   75    HG2  DBU  13           1HG      DBU  13 -16.569  -4.711  10.489
   76    HG3  DBU  13           2HG      DBU  13 -15.786  -3.160  10.799
   77    H    ALA  14           H        ALA  14 -15.840  -0.245   7.381
   78    HA   ALA  14           HA       ALA  14 -16.685  -0.955   4.782
   79    HB1  ALA  14           1HB      ALA  14 -17.333   1.141   5.871
   80    HB2  ALA  14           2HB      ALA  14 -15.666   1.708   5.766
   81    HB3  ALA  14           3HB      ALA  14 -16.596   1.426   4.294
   82    H    GLY  15           H        GLY  15 -13.585   0.242   6.034
   83    HA2  GLY  15           2HA      GLY  15 -12.313   0.347   3.487
   84    HA3  GLY  15           3HA      GLY  15 -11.511   0.394   5.050
   85    H    VAL  16           H        VAL  16 -12.173  -2.015   6.145
   86    HA   VAL  16           HA       VAL  16 -10.309  -3.762   5.129
   87    HB   VAL  16           HB       VAL  16 -12.807  -4.376   6.707
   88   HG11  VAL  16          1HG1      VAL  16 -10.975  -6.179   5.410
   89   HG12  VAL  16          2HG1      VAL  16 -10.911  -6.378   7.162
   90   HG13  VAL  16          3HG1      VAL  16 -12.449  -6.534   6.311
   91   HG21  VAL  16          3HG2      VAL  16 -10.876  -2.908   7.612
   92   HG22  VAL  16          1HG2      VAL  16 -11.498  -4.217   8.616
   93   HG23  VAL  16          2HG2      VAL  16  -9.991  -4.429   7.724
   94    H1   DBU  17           H        DBU  17 -13.764  -3.705   4.497
   95    HB1  DBU  17           HB       DBU  17 -15.522  -6.149   2.212
   96    HG1  DBU  17           3HG      DBU  17 -16.089  -6.715   4.535
   97    HG2  DBU  17           1HG      DBU  17 -16.210  -4.968   4.654
   98    HG3  DBU  17           2HG      DBU  17 -14.714  -5.777   5.127
   99    H    VAL  18           H        VAL  18 -12.926  -2.851   1.769
  100    HA   VAL  18           HA       VAL  18 -13.091  -3.644  -0.964
  101    HB   VAL  18           HB       VAL  18 -11.738  -1.331   0.410
  102   HG11  VAL  18          1HG1      VAL  18 -11.923  -0.883  -2.386
  103   HG12  VAL  18          2HG1      VAL  18 -10.479  -0.936  -1.374
  104   HG13  VAL  18          3HG1      VAL  18 -11.080  -2.411  -2.133
  105   HG21  VAL  18          3HG2      VAL  18 -14.307  -1.809  -0.968
  106   HG22  VAL  18          1HG2      VAL  18 -13.917  -0.723   0.366
  107   HG23  VAL  18          2HG2      VAL  18 -13.522  -0.263  -1.290
  108    H    DAL  19           H        DAL  19 -10.433  -3.384   1.368
  109    HA   DAL  19           HA       DAL  19  -8.354  -4.288   1.405
  110    HB2  DAL  19           2HB      DAL  19  -8.057  -2.734  -0.501
  111    HB3  DAL  19           3HB      DAL  19  -8.527  -4.026  -1.604
  112    H    ALA  20           H        ALA  20 -10.168  -6.174   1.786
  113    HA   ALA  20           HA       ALA  20  -8.898  -8.547   0.952
  114    HB1  ALA  20           1HB      ALA  20 -11.631  -8.161   2.168
  115    HB2  ALA  20           2HB      ALA  20 -10.783  -9.702   2.026
  116    HB3  ALA  20           3HB      ALA  20 -10.121  -8.422   3.043
  117    H    SER  21           H        SER  21 -10.759  -6.523  -0.838
  118    HA   SER  21           HA       SER  21 -12.250  -8.529  -2.305
  119    HB2  SER  21           2HB      SER  21 -12.507  -5.756  -1.910
  120    HB3  SER  21           3HB      SER  21 -12.141  -5.961  -3.623
  121    HG   SER  21           HG       SER  21 -14.156  -7.409  -2.249
  122    H    LEU  22           H        LEU  22  -9.544  -6.313  -2.922
  123    HA   LEU  22           HA       LEU  22  -8.794  -8.012  -5.209
  124    HB2  LEU  22           2HB      LEU  22  -8.010  -5.133  -5.021
  125    HB3  LEU  22           3HB      LEU  22  -8.115  -6.168  -6.444
  126    HG   LEU  22           HG       LEU  22 -10.425  -4.975  -4.914
  127   HD11  LEU  22          1HD1      LEU  22  -9.512  -3.266  -6.210
  128   HD12  LEU  22          2HD1      LEU  22 -10.795  -3.926  -7.223
  129   HD13  LEU  22          3HD1      LEU  22  -9.114  -4.356  -7.538
  130   HD21  LEU  22          3HD2      LEU  22 -11.823  -6.377  -5.934
  131   HD22  LEU  22          1HD2      LEU  22 -10.406  -7.356  -6.318
  132   HD23  LEU  22          2HD2      LEU  22 -11.009  -6.181  -7.487
  133    H    CYS  23           H        CYS  23  -7.536  -5.773  -2.749
  134    HA   CYS  23           HA       CYS  23  -4.918  -5.854  -2.843
  135    HB2  CYS  23           2HB      CYS  23  -6.431  -6.699  -0.361
  136    HB3  CYS  23           3HB      CYS  23  -4.783  -6.079  -0.394
  137    HA   PRO  24           HA       PRO  24  -3.528  -9.961  -3.774
  138    HB2  PRO  24           2HB      PRO  24  -1.097  -8.901  -2.407
  139    HB3  PRO  24           3HB      PRO  24  -1.246  -9.714  -3.970
  140    HG2  PRO  24           2HG      PRO  24  -0.903  -7.061  -3.802
  141    HG3  PRO  24           3HG      PRO  24  -1.920  -7.791  -5.058
  142    HD2  PRO  24           2HD      PRO  24  -2.691  -6.280  -2.638
  143    HD3  PRO  24           3HD      PRO  24  -3.523  -6.434  -4.199
  144    HN2  DB2  25           H        DB2  25  -3.674 -11.799  -2.658
  145    HA   DB2  25           HA       DB2  25  -2.945 -11.863   0.174
  146   HB2C  DB2  25          HB        DB2  25  -3.229 -13.852  -1.985
  147   HG1C  DB2  25          3HG       DB2  25  -1.034 -13.468  -1.507
  148   HG2C  DB2  25          1HG       DB2  25  -1.326 -14.797  -0.381
  149   HG3C  DB2  25          2HG       DB2  25  -1.347 -13.131   0.196
  150    H1   DBU  26           H        DBU  26  -5.571 -11.099  -1.514
  151    HB1  DBU  26           HB       DBU  26  -8.681 -10.481   0.702
  152    HG1  DBU  26           3HG      DBU  26  -6.897  -8.586  -0.129
  153    HG2  DBU  26           1HG      DBU  26  -5.711  -9.681   0.561
  154    HG3  DBU  26           2HG      DBU  26  -6.934  -8.945   1.601
  155    H    LYS  27           H        LYS  27  -7.022 -13.238  -2.186
  156    HA   LYS  27           HA       LYS  27  -9.494 -14.645  -1.421
  157    HB2  LYS  27           2HB      LYS  27  -9.565 -15.392  -3.799
  158    HB3  LYS  27           3HB      LYS  27  -9.706 -13.650  -3.600
  159    HG2  LYS  27           2HG      LYS  27  -7.003 -14.787  -4.065
  160    HG3  LYS  27           3HG      LYS  27  -8.131 -14.723  -5.421
  161    HD2  LYS  27           2HD      LYS  27  -8.177 -12.427  -5.450
  162    HD3  LYS  27           3HD      LYS  27  -7.781 -12.291  -3.735
  163    HE2  LYS  27           2HE      LYS  27  -5.939 -11.550  -5.197
  164    HE3  LYS  27           3HE      LYS  27  -5.489 -12.916  -4.176
  165    HZ1  LYS  27           3HZ      LYS  27  -4.676 -13.306  -6.367
  166    HZ2  LYS  27           1HZ      LYS  27  -6.189 -12.998  -7.059
  167    HZ3  LYS  27           2HZ      LYS  27  -5.960 -14.375  -6.104
  168    H    CYS  28           H        CYS  28  -6.327 -14.941  -0.994
  169    HA   CYS  28           HA       CYS  28  -5.990 -17.702  -1.810
  170    HB2  CYS  28           2HB      CYS  28  -3.767 -17.396  -0.551
  171    HB3  CYS  28           3HB      CYS  28  -4.009 -16.460  -2.022
  172    HN2  DB2  29           H        DB2  29  -8.013 -18.078  -0.381
  173    HA   DB2  29           HA       DB2  29  -7.044 -19.034   2.227
  174   HB2C  DB2  29          HB        DB2  29  -8.136 -20.540   0.404
  175   HG1C  DB2  29          3HG       DB2  29  -7.492 -20.926   2.897
  176   HG2C  DB2  29          1HG       DB2  29  -8.517 -22.098   2.066
  177   HG3C  DB2  29          2HG       DB2  29  -9.235 -20.918   3.161
  178    H    SER  30           H        SER  30  -7.951 -16.270   1.573
  179    HA   SER  30           HA       SER  30  -9.424 -15.813   3.945
  180    HB2  SER  30           2HB      SER  30  -8.355 -13.867   3.534
  181    HB3  SER  30           3HB      SER  30  -8.244 -14.194   1.805
  182    HG   SER  30           HG       SER  30 -10.509 -13.192   3.194
  183    H    ARG  31           H        ARG  31 -10.361 -15.250   0.546
  184    HA   ARG  31           HA       ARG  31 -13.158 -15.711   1.351
  185    HB2  ARG  31           2HB      ARG  31 -13.856 -14.128  -0.357
  186    HB3  ARG  31           3HB      ARG  31 -12.729 -13.358   0.752
  187    HG2  ARG  31           2HG      ARG  31 -10.968 -13.454  -0.834
  188    HG3  ARG  31           3HG      ARG  31 -11.901 -14.509  -1.898
  189    HD2  ARG  31           2HD      ARG  31 -12.563 -11.648  -1.207
  190    HD3  ARG  31           3HD      ARG  31 -11.868 -12.211  -2.726
  191    HE   ARG  31           HE       ARG  31 -13.940 -13.032  -3.353
  192   HH11  ARG  31          1HH1      ARG  31 -14.010 -11.905  -0.060
  193   HH12  ARG  31          2HH1      ARG  31 -15.739 -11.947   0.055
  194   HH21  ARG  31          1HH2      ARG  31 -16.216 -13.093  -3.214
  195   HH22  ARG  31          2HH2      ARG  31 -16.992 -12.624  -1.739
  196    H    CYS  32           H        CYS  32 -11.524 -17.822   0.600
  197    HA   CYS  32           HA       CYS  32 -11.900 -18.393  -2.202
  198    HB2  CYS  32           2HB      CYS  32 -11.113 -20.751  -1.294
  199    HB3  CYS  32           3HB      CYS  32  -9.974 -19.421  -1.479
  Start of MODEL   17
    1    H41  2KT   1           2H4      2KT   1 -21.929  -0.929  13.454
    2    H42  2KT   1           3H4      2KT   1 -21.231  -2.241  13.252
    3    H43  2KT   1           1H4      2KT   1 -21.955  -1.966  14.537
    4    H31  2KT   1           2H3      2KT   1 -19.635  -1.830  14.305
    5    H32  2KT   1           3H3      2KT   1 -19.814  -0.463  13.715
    6    H1   DBU   2           H        DBU   2 -20.701   0.630  17.722
    7    HB1  DBU   2           HB       DBU   2 -23.998   2.701  17.908
    8    HG1  DBU   2           3HG      DBU   2 -22.987  -0.223  17.726
    9    HG2  DBU   2           1HG      DBU   2 -24.668   0.237  17.515
   10    HG3  DBU   2           2HG      DBU   2 -23.917   0.369  19.107
   11    HA   PRO   3           HA       PRO   3 -21.858   6.249  16.976
   12    HB2  PRO   3           2HB      PRO   3 -21.020   7.176  19.386
   13    HB3  PRO   3           3HB      PRO   3 -22.714   6.818  19.031
   14    HG2  PRO   3           2HG      PRO   3 -20.691   5.155  20.481
   15    HG3  PRO   3           3HG      PRO   3 -22.391   5.452  20.885
   16    HD2  PRO   3           2HD      PRO   3 -21.558   3.178  19.674
   17    HD3  PRO   3           3HD      PRO   3 -23.155   3.892  19.371
   18    H    ALA   4           H        ALA   4 -19.889   4.775  15.938
   19    HA   ALA   4           HA       ALA   4 -17.329   5.492  17.089
   20    HB1  ALA   4           1HB      ALA   4 -17.430   3.326  16.133
   21    HB2  ALA   4           2HB      ALA   4 -18.102   3.948  14.625
   22    HB3  ALA   4           3HB      ALA   4 -16.430   4.305  15.059
   23    H1   DBU   5           H        DBU   5 -18.132   7.805  16.826
   24    HB1  DBU   5           HB       DBU   5 -18.435  10.781  14.498
   25    HG1  DBU   5           3HG      DBU   5 -20.719   9.962  15.069
   26    HG2  DBU   5           1HG      DBU   5 -19.977  10.099  16.654
   27    HG3  DBU   5           2HG      DBU   5 -20.037   8.530  15.848
   28    H1   DBU   6           H        DBU   6 -15.681  10.168  16.175
   29    HB1  DBU   6           HB       DBU   6 -12.587  11.608  14.702
   30    HG1  DBU   6           3HG      DBU   6 -15.244  12.387  15.878
   31    HG2  DBU   6           1HG      DBU   6 -13.716  13.211  16.138
   32    HG3  DBU   6           2HG      DBU   6 -14.126  11.796  17.112
   33    H    DAL   7           H        DAL   7 -14.248   7.714  14.691
   34    HA   DAL   7           HA       DAL   7 -12.197   7.423  12.663
   35    HB2  DAL   7           2HB      DAL   7 -14.590   7.646  11.626
   36    HB3  DAL   7           3HB      DAL   7 -14.774   5.979  12.168
   37    H    DHA   8           H        DHA   8 -14.765   5.416  13.979
   38    HB1  DHA   8           2HB      DHA   8 -13.085   4.795  16.637
   39    HB2  DHA   8           3HB      DHA   8 -13.162   2.933  16.670
   40    H    TRP   9           H        TRP   9 -15.519   2.284  15.554
   41    HA   TRP   9           HA       TRP   9 -14.735   0.003  14.150
   42    HB2  TRP   9           2HB      TRP   9 -17.474   0.912  15.047
   43    HB3  TRP   9           3HB      TRP   9 -17.147  -0.686  14.382
   44    HD1  TRP   9           HD1      TRP   9 -17.378   1.037  17.596
   45    HE1  TRP   9           HE1      TRP   9 -16.301  -0.353  19.476
   46    HE3  TRP   9           HE3      TRP   9 -14.825  -2.348  14.740
   47    HZ2  TRP   9           HZ2      TRP   9 -14.594  -2.588  19.715
   48    HZ3  TRP   9           HZ3      TRP   9 -13.493  -4.080  15.872
   49    HH2  TRP   9           HH2      TRP   9 -13.381  -4.195  18.308
   50    H    THR  10           H        THR  10 -16.649   2.772  13.151
   51    HA   THR  10           HA       THR  10 -17.668   1.724  10.750
   52    HB   THR  10           HB       THR  10 -16.945   4.622  10.964
   53    HG1  THR  10           HG1      THR  10 -19.298   3.696  12.191
   54   HG21  THR  10          3HG2      THR  10 -18.094   3.864   8.964
   55   HG22  THR  10          1HG2      THR  10 -19.171   4.878   9.922
   56   HG23  THR  10          2HG2      THR  10 -19.361   3.124   9.942
   57    H    CYS  11           H        CYS  11 -14.868   3.884  11.244
   58    HA   CYS  11           HA       CYS  11 -13.939   3.901   8.632
   59    HB2  CYS  11           2HB      CYS  11 -12.377   4.078  11.216
   60    HB3  CYS  11           3HB      CYS  11 -11.715   4.455   9.629
   61    H    ILE  12           H        ILE  12 -13.403   1.549  11.192
   62    HA   ILE  12           HA       ILE  12 -11.366   0.063   9.948
   63    HB   ILE  12           HB       ILE  12 -13.400  -0.601  12.049
   64   HG12  ILE  12          2HG1      ILE  12 -10.438  -0.885  12.323
   65   HG13  ILE  12          3HG1      ILE  12 -11.128   0.734  12.289
   66   HG21  ILE  12          1HG2      ILE  12 -11.655  -2.491  10.540
   67   HG22  ILE  12          2HG2      ILE  12 -11.949  -2.768  12.256
   68   HG23  ILE  12          3HG2      ILE  12 -13.304  -2.706  11.128
   69   HD11  ILE  12          3HD1      ILE  12 -12.363   0.361  14.247
   70   HD12  ILE  12          1HD1      ILE  12 -12.108  -1.382  14.172
   71   HD13  ILE  12          2HD1      ILE  12 -10.763  -0.310  14.560
   72    H1   DBU  13           H        DBU  13 -14.689  -1.026  10.372
   73    HB1  DBU  13           HB       DBU  13 -16.171  -3.814   8.313
   74    HG1  DBU  13           3HG      DBU  13 -16.346  -4.213  10.735
   75    HG2  DBU  13           1HG      DBU  13 -15.457  -2.739  11.078
   76    HG3  DBU  13           2HG      DBU  13 -14.586  -4.192  10.581
   77    H    ALA  14           H        ALA  14 -15.367   0.272   7.732
   78    HA   ALA  14           HA       ALA  14 -16.286  -0.314   5.127
   79    HB1  ALA  14           1HB      ALA  14 -15.263   2.264   5.023
   80    HB2  ALA  14           2HB      ALA  14 -16.919   1.799   5.415
   81    HB3  ALA  14           3HB      ALA  14 -15.744   2.047   6.706
   82    H    GLY  15           H        GLY  15 -13.102   0.651   6.369
   83    HA2  GLY  15           2HA      GLY  15 -11.856   0.744   3.808
   84    HA3  GLY  15           3HA      GLY  15 -11.034   0.700   5.360
   85    H    VAL  16           H        VAL  16 -11.835  -1.691   6.402
   86    HA   VAL  16           HA       VAL  16 -10.096  -3.524   5.317
   87    HB   VAL  16           HB       VAL  16 -12.609  -4.022   6.911
   88   HG11  VAL  16          1HG1      VAL  16 -10.636  -5.903   5.757
   89   HG12  VAL  16          2HG1      VAL  16 -11.153  -6.200   7.418
   90   HG13  VAL  16          3HG1      VAL  16 -12.346  -6.133   6.119
   91   HG21  VAL  16          3HG2      VAL  16  -9.718  -4.080   7.764
   92   HG22  VAL  16          1HG2      VAL  16 -10.785  -2.690   7.964
   93   HG23  VAL  16          2HG2      VAL  16 -11.140  -4.202   8.799
   94    H1   DBU  17           H        DBU  17 -13.547  -3.233   4.733
   95    HB1  DBU  17           HB       DBU  17 -15.483  -5.501   2.410
   96    HG1  DBU  17           3HG      DBU  17 -15.258  -6.192   5.007
   97    HG2  DBU  17           1HG      DBU  17 -16.523  -5.026   4.658
   98    HG3  DBU  17           2HG      DBU  17 -14.963  -4.470   5.272
   99    H    VAL  18           H        VAL  18 -12.686  -2.363   2.017
  100    HA   VAL  18           HA       VAL  18 -12.933  -3.073  -0.733
  101    HB   VAL  18           HB       VAL  18 -11.421  -0.887   0.681
  102   HG11  VAL  18          1HG1      VAL  18 -11.611  -0.357  -2.101
  103   HG12  VAL  18          2HG1      VAL  18 -10.160  -0.524  -1.110
  104   HG13  VAL  18          3HG1      VAL  18 -10.860  -1.940  -1.896
  105   HG21  VAL  18          3HG2      VAL  18 -13.553  -0.134   0.679
  106   HG22  VAL  18          1HG2      VAL  18 -13.155   0.328  -0.976
  107   HG23  VAL  18          2HG2      VAL  18 -14.033  -1.169  -0.666
  108    H    DAL  19           H        DAL  19 -10.234  -3.035   1.567
  109    HA   DAL  19           HA       DAL  19  -8.218  -4.071   1.555
  110    HB2  DAL  19           2HB      DAL  19  -7.846  -2.490  -0.316
  111    HB3  DAL  19           3HB      DAL  19  -8.408  -3.722  -1.444
  112    H    ALA  20           H        ALA  20 -10.148  -5.848   1.909
  113    HA   ALA  20           HA       ALA  20  -9.038  -8.275   1.005
  114    HB1  ALA  20           1HB      ALA  20 -10.231  -8.126   3.110
  115    HB2  ALA  20           2HB      ALA  20 -11.729  -7.747   2.258
  116    HB3  ALA  20           3HB      ALA  20 -10.984  -9.334   2.068
  117    H    SER  21           H        SER  21 -10.784  -6.092  -0.715
  118    HA   SER  21           HA       SER  21 -12.410  -7.962  -2.217
  119    HB2  SER  21           2HB      SER  21 -12.494  -5.194  -1.747
  120    HB3  SER  21           3HB      SER  21 -12.143  -5.369  -3.467
  121    HG   SER  21           HG       SER  21 -14.107  -6.042  -3.770
  122    H    LEU  22           H        LEU  22  -9.575  -5.906  -2.807
  123    HA   LEU  22           HA       LEU  22  -8.954  -7.591  -5.143
  124    HB2  LEU  22           2HB      LEU  22  -7.985  -4.774  -4.892
  125    HB3  LEU  22           3HB      LEU  22  -8.170  -5.763  -6.338
  126    HG   LEU  22           HG       LEU  22 -10.388  -4.472  -4.753
  127   HD11  LEU  22          1HD1      LEU  22  -9.049  -3.846  -7.359
  128   HD12  LEU  22          2HD1      LEU  22  -9.386  -2.778  -5.997
  129   HD13  LEU  22          3HD1      LEU  22 -10.703  -3.331  -7.030
  130   HD21  LEU  22          3HD2      LEU  22 -11.558  -6.228  -5.553
  131   HD22  LEU  22          1HD2      LEU  22 -10.370  -6.588  -6.806
  132   HD23  LEU  22          2HD2      LEU  22 -11.537  -5.288  -7.046
  133    H    CYS  23           H        CYS  23  -7.531  -5.494  -2.646
  134    HA   CYS  23           HA       CYS  23  -4.926  -5.743  -2.768
  135    HB2  CYS  23           2HB      CYS  23  -6.464  -6.549  -0.290
  136    HB3  CYS  23           3HB      CYS  23  -4.782  -6.028  -0.328
  137    HA   PRO  24           HA       PRO  24  -3.822  -9.911  -3.812
  138    HB2  PRO  24           2HB      PRO  24  -1.307  -9.038  -2.466
  139    HB3  PRO  24           3HB      PRO  24  -1.532  -9.806  -4.042
  140    HG2  PRO  24           2HG      PRO  24  -1.016  -7.185  -3.826
  141    HG3  PRO  24           3HG      PRO  24  -2.098  -7.822  -5.079
  142    HD2  PRO  24           2HD      PRO  24  -2.731  -6.316  -2.617
  143    HD3  PRO  24           3HD      PRO  24  -3.596  -6.383  -4.166
  144    HN2  DB2  25           H        DB2  25  -4.049 -11.765  -2.732
  145    HA   DB2  25           HA       DB2  25  -3.292 -11.928   0.088
  146   HB2C  DB2  25          HB        DB2  25  -3.717 -13.853  -2.105
  147   HG1C  DB2  25          3HG       DB2  25  -1.808 -14.950  -0.754
  148   HG2C  DB2  25          1HG       DB2  25  -1.813 -13.451   0.178
  149   HG3C  DB2  25          2HG       DB2  25  -1.495 -13.411  -1.555
  150    H1   DBU  26           H        DBU  26  -5.886 -10.965  -1.537
  151    HB1  DBU  26           HB       DBU  26  -8.933 -10.213   0.713
  152    HG1  DBU  26           3HG      DBU  26  -7.077  -8.786   1.599
  153    HG2  DBU  26           1HG      DBU  26  -7.083  -8.396  -0.113
  154    HG3  DBU  26           2HG      DBU  26  -5.927  -9.575   0.513
  155    H    LYS  27           H        LYS  27  -7.560 -12.933  -2.298
  156    HA   LYS  27           HA       LYS  27 -10.071 -14.227  -1.489
  157    HB2  LYS  27           2HB      LYS  27 -10.291 -14.908  -3.828
  158    HB3  LYS  27           3HB      LYS  27 -10.095 -13.165  -3.699
  159    HG2  LYS  27           2HG      LYS  27  -8.651 -13.550  -5.396
  160    HG3  LYS  27           3HG      LYS  27  -7.544 -13.813  -4.046
  161    HD2  LYS  27           2HD      LYS  27  -7.332 -15.593  -5.696
  162    HD3  LYS  27           3HD      LYS  27  -7.970 -16.225  -4.176
  163    HE2  LYS  27           2HE      LYS  27 -10.066 -16.584  -5.050
  164    HE3  LYS  27           3HE      LYS  27  -9.879 -15.344  -6.289
  165    HZ1  LYS  27           3HZ      LYS  27  -9.845 -17.659  -7.141
  166    HZ2  LYS  27           1HZ      LYS  27  -8.402 -17.917  -6.297
  167    HZ3  LYS  27           2HZ      LYS  27  -8.463 -16.769  -7.538
  168    H    CYS  28           H        CYS  28  -6.890 -14.724  -1.145
  169    HA   CYS  28           HA       CYS  28  -6.786 -17.522  -1.892
  170    HB2  CYS  28           2HB      CYS  28  -4.497 -17.379  -0.786
  171    HB3  CYS  28           3HB      CYS  28  -4.743 -16.365  -2.205
  172    HN2  DB2  29           H        DB2  29  -8.771 -17.725  -0.384
  173    HA   DB2  29           HA       DB2  29  -7.781 -18.777   2.166
  174   HB2C  DB2  29          HB        DB2  29  -9.241 -20.064   0.438
  175   HG1C  DB2  29          3HG       DB2  29 -10.079 -21.448   2.263
  176   HG2C  DB2  29          1HG       DB2  29  -9.853 -20.113   3.395
  177   HG3C  DB2  29          2HG       DB2  29  -8.456 -20.861   2.623
  178    H    SER  30           H        SER  30  -8.228 -15.902   1.653
  179    HA   SER  30           HA       SER  30  -9.485 -15.281   4.116
  180    HB2  SER  30           2HB      SER  30  -7.896 -13.698   3.577
  181    HB3  SER  30           3HB      SER  30  -8.314 -13.705   1.864
  182    HG   SER  30           HG       SER  30  -8.962 -11.822   3.273
  183    H    ARG  31           H        ARG  31 -10.434 -14.519   0.762
  184    HA   ARG  31           HA       ARG  31 -13.227 -14.387   1.692
  185    HB2  ARG  31           2HB      ARG  31 -12.585 -12.170   1.096
  186    HB3  ARG  31           3HB      ARG  31 -11.807 -12.722  -0.381
  187    HG2  ARG  31           2HG      ARG  31 -13.755 -12.848  -1.528
  188    HG3  ARG  31           3HG      ARG  31 -14.695 -13.287  -0.100
  189    HD2  ARG  31           2HD      ARG  31 -13.625 -10.544  -0.756
  190    HD3  ARG  31           3HD      ARG  31 -15.302 -11.066  -0.901
  191    HE   ARG  31           HE       ARG  31 -14.391 -11.480   1.736
  192   HH11  ARG  31          1HH1      ARG  31 -15.305  -8.936  -0.458
  193   HH12  ARG  31          2HH1      ARG  31 -15.821  -7.860   0.798
  194   HH21  ARG  31          1HH2      ARG  31 -15.067 -10.072   3.399
  195   HH22  ARG  31          2HH2      ARG  31 -15.685  -8.507   2.992
  196    H    CYS  32           H        CYS  32 -12.114 -16.793   0.906
  197    HA   CYS  32           HA       CYS  32 -12.773 -17.265  -1.874
  198    HB2  CYS  32           2HB      CYS  32 -12.297 -19.719  -1.060
  199    HB3  CYS  32           3HB      CYS  32 -10.971 -18.583  -1.283
  Start of MODEL   18
    1    H41  2KT   1           2H4      2KT   1 -13.917  10.705  21.057
    2    H42  2KT   1           3H4      2KT   1 -15.225  10.065  20.698
    3    H43  2KT   1           1H4      2KT   1 -14.972  10.517  22.106
    4    H31  2KT   1           2H3      2KT   1 -14.308   8.368  20.836
    5    H32  2KT   1           3H3      2KT   1 -13.051   8.889  21.467
    6    H1   DBU   2           H        DBU   2 -16.627   7.661  22.107
    7    HB1  DBU   2           HB       DBU   2 -17.860   4.322  23.696
    8    HG1  DBU   2           3HG      DBU   2 -17.651   5.905  25.645
    9    HG2  DBU   2           1HG      DBU   2 -18.713   6.746  24.529
   10    HG3  DBU   2           2HG      DBU   2 -16.996   7.151  24.577
   11    HA   PRO   3           HA       PRO   3 -16.753   2.217  20.173
   12    HB2  PRO   3           2HB      PRO   3 -18.894   2.431  18.519
   13    HB3  PRO   3           3HB      PRO   3 -19.013   1.805  20.168
   14    HG2  PRO   3           2HG      PRO   3 -19.642   4.542  19.130
   15    HG3  PRO   3           3HG      PRO   3 -20.550   3.547  20.283
   16    HD2  PRO   3           2HD      PRO   3 -18.931   5.572  21.065
   17    HD3  PRO   3           3HD      PRO   3 -19.176   4.113  22.046
   18    H    ALA   4           H        ALA   4 -15.047   4.177  19.559
   19    HA   ALA   4           HA       ALA   4 -13.689   4.664  17.755
   20    HB1  ALA   4           1HB      ALA   4 -15.718   4.305  15.662
   21    HB2  ALA   4           2HB      ALA   4 -14.060   3.710  15.754
   22    HB3  ALA   4           3HB      ALA   4 -15.350   2.858  16.602
   23    H1   DBU   5           H        DBU   5 -16.986   5.522  16.825
   24    HB1  DBU   5           HB       DBU   5 -17.550   9.422  17.341
   25    HG1  DBU   5           3HG      DBU   5 -17.112   6.881  19.031
   26    HG2  DBU   5           1HG      DBU   5 -17.988   8.311  19.550
   27    HG3  DBU   5           2HG      DBU   5 -16.226   8.350  19.451
   28    H1   DBU   6           H        DBU   6 -15.054   8.626  15.252
   29    HB1  DBU   6           HB       DBU   6 -15.838  10.761  12.140
   30    HG1  DBU   6           3HG      DBU   6 -16.846  11.665  14.509
   31    HG2  DBU   6           1HG      DBU   6 -15.212  12.169  14.109
   32    HG3  DBU   6           2HG      DBU   6 -15.467  10.800  15.195
   33    H    DAL   7           H        DAL   7 -17.006   6.834  13.237
   34    HA   DAL   7           HA       DAL   7 -15.634   5.941  10.847
   35    HB2  DAL   7           2HB      DAL   7 -17.798   7.307  10.284
   36    HB3  DAL   7           3HB      DAL   7 -18.626   5.828  10.770
   37    H    DHA   8           H        DHA   8 -18.578   5.130  12.594
   38    HB1  DHA   8           2HB      DHA   8 -18.734   4.067  15.046
   39    HB2  DHA   8           3HB      DHA   8 -18.844   2.207  14.967
   40    H    TRP   9           H        TRP   9 -19.603   1.154  13.576
   41    HA   TRP   9           HA       TRP   9 -18.113  -0.757  12.227
   42    HB2  TRP   9           2HB      TRP   9 -21.123  -0.626  12.521
   43    HB3  TRP   9           3HB      TRP   9 -20.199  -2.064  12.098
   44    HD1  TRP   9           HD1      TRP   9 -21.724  -0.473  14.996
   45    HE1  TRP   9           HE1      TRP   9 -20.771  -1.415  17.193
   46    HE3  TRP   9           HE3      TRP   9 -17.611  -2.873  13.135
   47    HZ2  TRP   9           HZ2      TRP   9 -18.568  -2.970  18.028
   48    HZ3  TRP   9           HZ3      TRP   9 -16.132  -4.064  14.700
   49    HH2  TRP   9           HH2      TRP   9 -16.602  -4.110  17.095
   50    H    THR  10           H        THR  10 -20.441   1.564  10.991
   51    HA   THR  10           HA       THR  10 -20.887   0.528   8.452
   52    HB   THR  10           HB       THR  10 -20.852   3.343   9.503
   53    HG1  THR  10           HG1      THR  10 -23.114   3.090   8.978
   54   HG21  THR  10          3HG2      THR  10 -21.832   4.029   7.301
   55   HG22  THR  10          1HG2      THR  10 -21.323   2.470   6.653
   56   HG23  THR  10          2HG2      THR  10 -20.118   3.617   7.238
   57    H    CYS  11           H        CYS  11 -18.590   3.154   9.219
   58    HA   CYS  11           HA       CYS  11 -17.274   3.181   6.778
   59    HB2  CYS  11           2HB      CYS  11 -15.995   3.758   9.456
   60    HB3  CYS  11           3HB      CYS  11 -15.504   4.389   7.888
   61    H    ILE  12           H        ILE  12 -16.740   1.152   9.599
   62    HA   ILE  12           HA       ILE  12 -14.283   0.027   8.828
   63    HB   ILE  12           HB       ILE  12 -16.495  -1.060  10.563
   64   HG12  ILE  12          2HG1      ILE  12 -13.797   0.170  11.159
   65   HG13  ILE  12          3HG1      ILE  12 -15.373   0.887  11.476
   66   HG21  ILE  12          1HG2      ILE  12 -15.451  -3.019   9.876
   67   HG22  ILE  12          2HG2      ILE  12 -13.861  -2.261   9.802
   68   HG23  ILE  12          3HG2      ILE  12 -14.597  -2.614  11.365
   69   HD11  ILE  12          3HD1      ILE  12 -13.823  -0.977  13.058
   70   HD12  ILE  12          1HD1      ILE  12 -15.166   0.065  13.526
   71   HD13  ILE  12          2HD1      ILE  12 -15.483  -1.517  12.811
   72    H1   DBU  13           H        DBU  13 -17.412  -1.599   8.775
   73    HB1  DBU  13           HB       DBU  13 -17.975  -4.769   6.797
   74    HG1  DBU  13           3HG      DBU  13 -17.735  -3.384   9.539
   75    HG2  DBU  13           1HG      DBU  13 -16.855  -4.880   9.280
   76    HG3  DBU  13           2HG      DBU  13 -18.619  -4.877   9.208
   77    H    ALA  14           H        ALA  14 -17.836  -0.651   5.972
   78    HA   ALA  14           HA       ALA  14 -18.164  -1.565   3.320
   79    HB1  ALA  14           1HB      ALA  14 -17.798   1.052   2.933
   80    HB2  ALA  14           2HB      ALA  14 -19.298   0.380   3.575
   81    HB3  ALA  14           3HB      ALA  14 -18.098   1.066   4.671
   82    H    GLY  15           H        GLY  15 -15.471   0.054   4.970
   83    HA2  GLY  15           2HA      GLY  15 -13.838   0.246   2.638
   84    HA3  GLY  15           3HA      GLY  15 -13.305   0.456   4.300
   85    H    VAL  16           H        VAL  16 -13.828  -1.979   5.415
   86    HA   VAL  16           HA       VAL  16 -11.621  -3.499   4.795
   87    HB   VAL  16           HB       VAL  16 -14.239  -4.377   6.013
   88   HG11  VAL  16          1HG1      VAL  16 -12.583  -6.218   6.939
   89   HG12  VAL  16          2HG1      VAL  16 -13.443  -6.432   5.413
   90   HG13  VAL  16          3HG1      VAL  16 -11.760  -5.902   5.412
   91   HG21  VAL  16          3HG2      VAL  16 -11.752  -4.211   7.590
   92   HG22  VAL  16          1HG2      VAL  16 -12.415  -2.677   7.029
   93   HG23  VAL  16          2HG2      VAL  16 -13.401  -3.754   8.017
   94    H1   DBU  17           H        DBU  17 -14.912  -3.917   3.643
   95    HB1  DBU  17           HB       DBU  17 -15.972  -6.658   1.264
   96    HG1  DBU  17           3HG      DBU  17 -17.344  -5.721   3.385
   97    HG2  DBU  17           1HG      DBU  17 -15.801  -5.774   4.221
   98    HG3  DBU  17           2HG      DBU  17 -16.538  -7.272   3.644
   99    H    VAL  18           H        VAL  18 -13.764  -3.066   1.033
  100    HA   VAL  18           HA       VAL  18 -13.400  -3.974  -1.645
  101    HB   VAL  18           HB       VAL  18 -12.578  -1.455  -0.215
  102   HG11  VAL  18          1HG1      VAL  18 -11.107  -0.967  -1.802
  103   HG12  VAL  18          2HG1      VAL  18 -11.398  -2.532  -2.565
  104   HG13  VAL  18          3HG1      VAL  18 -12.368  -1.132  -3.024
  105   HG21  VAL  18          3HG2      VAL  18 -14.818  -2.318  -1.931
  106   HG22  VAL  18          1HG2      VAL  18 -14.776  -1.130  -0.629
  107   HG23  VAL  18          2HG2      VAL  18 -14.186  -0.700  -2.234
  108    H    DAL  19           H        DAL  19 -11.194  -3.284   1.044
  109    HA   DAL  19           HA       DAL  19  -9.051  -3.906   1.444
  110    HB2  DAL  19           2HB      DAL  19  -8.651  -2.400  -0.479
  111    HB3  DAL  19           3HB      DAL  19  -8.784  -3.781  -1.566
  112    H    ALA  20           H        ALA  20 -10.661  -5.997   1.652
  113    HA   ALA  20           HA       ALA  20  -8.992  -8.214   1.160
  114    HB1  ALA  20           1HB      ALA  20 -10.858  -9.564   2.005
  115    HB2  ALA  20           2HB      ALA  20 -10.541  -8.163   3.029
  116    HB3  ALA  20           3HB      ALA  20 -11.910  -8.150   1.918
  117    H    SER  21           H        SER  21 -10.784  -6.519  -1.005
  118    HA   SER  21           HA       SER  21 -11.765  -8.756  -2.564
  119    HB2  SER  21           2HB      SER  21 -12.417  -6.025  -2.373
  120    HB3  SER  21           3HB      SER  21 -11.768  -6.250  -3.997
  121    HG   SER  21           HG       SER  21 -13.633  -7.075  -4.463
  122    H    LEU  22           H        LEU  22  -9.291  -6.229  -2.891
  123    HA   LEU  22           HA       LEU  22  -7.987  -7.900  -4.939
  124    HB2  LEU  22           2HB      LEU  22  -7.597  -4.939  -4.794
  125    HB3  LEU  22           3HB      LEU  22  -7.353  -6.030  -6.157
  126    HG   LEU  22           HG       LEU  22  -9.997  -5.077  -5.061
  127   HD11  LEU  22          1HD1      LEU  22  -8.370  -4.409  -7.485
  128   HD12  LEU  22          2HD1      LEU  22  -9.123  -3.325  -6.316
  129   HD13  LEU  22          3HD1      LEU  22 -10.122  -4.202  -7.475
  130   HD21  LEU  22          3HD2      LEU  22 -11.050  -6.686  -6.187
  131   HD22  LEU  22          1HD2      LEU  22  -9.488  -7.499  -6.288
  132   HD23  LEU  22          2HD2      LEU  22 -10.031  -6.466  -7.610
  133    H    CYS  23           H        CYS  23  -7.412  -5.425  -2.449
  134    HA   CYS  23           HA       CYS  23  -4.821  -5.176  -2.140
  135    HB2  CYS  23           2HB      CYS  23  -6.588  -6.111   0.132
  136    HB3  CYS  23           3HB      CYS  23  -5.047  -5.279   0.307
  137    HA   PRO  24           HA       PRO  24  -2.829  -9.112  -2.614
  138    HB2  PRO  24           2HB      PRO  24  -0.776  -7.693  -0.979
  139    HB3  PRO  24           3HB      PRO  24  -0.589  -8.584  -2.494
  140    HG2  PRO  24           2HG      PRO  24  -0.595  -5.905  -2.442
  141    HG3  PRO  24           3HG      PRO  24  -1.317  -6.812  -3.784
  142    HD2  PRO  24           2HD      PRO  24  -2.617  -5.309  -1.599
  143    HD3  PRO  24           3HD      PRO  24  -3.181  -5.634  -3.251
  144    HN2  DB2  25           H        DB2  25  -2.899 -10.906  -1.418
  145    HA   DB2  25           HA       DB2  25  -2.616 -10.750   1.488
  146   HB2C  DB2  25          HB        DB2  25  -2.311 -12.850  -0.560
  147   HG1C  DB2  25          3HG       DB2  25  -0.283 -13.203   0.498
  148   HG2C  DB2  25          1HG       DB2  25  -0.898 -12.696   2.073
  149   HG3C  DB2  25          2HG       DB2  25  -0.567 -11.494   0.827
  150    H1   DBU  26           H        DBU  26  -5.026 -10.402  -0.601
  151    HB1  DBU  26           HB       DBU  26  -8.495 -10.112   1.071
  152    HG1  DBU  26           3HG      DBU  26  -6.884  -8.028   0.380
  153    HG2  DBU  26           1HG      DBU  26  -5.663  -8.914   1.279
  154    HG3  DBU  26           2HG      DBU  26  -7.101  -8.316   2.110
  155    H    LYS  27           H        LYS  27  -6.158 -12.700  -1.424
  156    HA   LYS  27           HA       LYS  27  -8.501 -14.397  -0.907
  157    HB2  LYS  27           2HB      LYS  27  -8.409 -15.105  -3.156
  158    HB3  LYS  27           3HB      LYS  27  -8.114 -13.372  -3.207
  159    HG2  LYS  27           2HG      LYS  27  -5.787 -13.694  -3.562
  160    HG3  LYS  27           3HG      LYS  27  -5.916 -15.423  -3.230
  161    HD2  LYS  27           2HD      LYS  27  -7.521 -14.231  -5.448
  162    HD3  LYS  27           3HD      LYS  27  -5.802 -14.548  -5.696
  163    HE2  LYS  27           2HE      LYS  27  -6.929 -16.478  -6.450
  164    HE3  LYS  27           3HE      LYS  27  -6.258 -16.899  -4.875
  165    HZ1  LYS  27           3HZ      LYS  27  -8.767 -17.382  -5.536
  166    HZ2  LYS  27           1HZ      LYS  27  -8.966 -15.828  -4.899
  167    HZ3  LYS  27           2HZ      LYS  27  -8.295 -17.052  -3.946
  168    H    CYS  28           H        CYS  28  -5.390 -14.255  -0.023
  169    HA   CYS  28           HA       CYS  28  -4.660 -17.021  -0.491
  170    HB2  CYS  28           2HB      CYS  28  -2.658 -16.374   0.947
  171    HB3  CYS  28           3HB      CYS  28  -2.832 -15.518  -0.582
  172    HN2  DB2  29           H        DB2  29  -6.802 -17.515   0.697
  173    HA   DB2  29           HA       DB2  29  -6.094 -18.183   3.465
  174   HB2C  DB2  29          HB        DB2  29  -6.934 -19.857   1.657
  175   HG1C  DB2  29          3HG       DB2  29  -8.123 -21.107   3.590
  176   HG2C  DB2  29          1HG       DB2  29  -7.695 -19.689   4.551
  177   HG3C  DB2  29          2HG       DB2  29  -6.431 -20.650   3.784
  178    H    SER  30           H        SER  30  -7.008 -15.508   2.586
  179    HA   SER  30           HA       SER  30  -8.780 -15.004   4.740
  180    HB2  SER  30           2HB      SER  30  -7.553 -13.117   4.341
  181    HB3  SER  30           3HB      SER  30  -7.491 -13.397   2.601
  182    HG   SER  30           HG       SER  30  -9.594 -12.622   2.438
  183    H    ARG  31           H        ARG  31  -9.257 -14.688   1.218
  184    HA   ARG  31           HA       ARG  31 -12.138 -15.110   1.676
  185    HB2  ARG  31           2HB      ARG  31 -11.699 -12.813   0.968
  186    HB3  ARG  31           3HB      ARG  31 -10.811 -13.397  -0.433
  187    HG2  ARG  31           2HG      ARG  31 -13.333 -14.621  -0.545
  188    HG3  ARG  31           3HG      ARG  31 -13.616 -12.929  -0.129
  189    HD2  ARG  31           2HD      ARG  31 -11.633 -13.408  -2.253
  190    HD3  ARG  31           3HD      ARG  31 -13.295 -13.840  -2.653
  191    HE   ARG  31           HE       ARG  31 -12.945 -11.212  -1.495
  192   HH11  ARG  31          1HH1      ARG  31 -13.148 -13.113  -4.405
  193   HH12  ARG  31          2HH1      ARG  31 -13.587 -11.769  -5.407
  194   HH21  ARG  31          1HH2      ARG  31 -13.522  -9.436  -2.804
  195   HH22  ARG  31          2HH2      ARG  31 -13.799  -9.678  -4.496
  196    H    CYS  32           H        CYS  32 -10.446 -17.263   1.324
  197    HA   CYS  32           HA       CYS  32 -10.486 -18.044  -1.465
  198    HB2  CYS  32           2HB      CYS  32  -9.686 -20.282  -0.334
  199    HB3  CYS  32           3HB      CYS  32  -8.593 -18.908  -0.466
  Start of MODEL   19
    1    H41  2KT   1           2H4      2KT   1 -14.176  -3.464  14.315
    2    H42  2KT   1           3H4      2KT   1 -15.410  -3.415  15.168
    3    H43  2KT   1           1H4      2KT   1 -15.076  -2.264  14.266
    4    H31  2KT   1           2H3      2KT   1 -14.336  -2.828  16.646
    5    H32  2KT   1           3H3      2KT   1 -13.052  -2.736  15.877
    6    H1   DBU   2           H        DBU   2 -14.858  -1.297  18.201
    7    HB1  DBU   2           HB       DBU   2 -18.418  -0.392  19.162
    8    HG1  DBU   2           3HG      DBU   2 -16.902  -2.679  19.617
    9    HG2  DBU   2           1HG      DBU   2 -16.795  -2.640  17.865
   10    HG3  DBU   2           2HG      DBU   2 -18.372  -2.800  18.644
   11    HA   PRO   3           HA       PRO   3 -17.374   3.844  19.364
   12    HB2  PRO   3           2HB      PRO   3 -15.506   4.582  21.191
   13    HB3  PRO   3           3HB      PRO   3 -16.972   3.694  21.622
   14    HG2  PRO   3           2HG      PRO   3 -14.193   2.667  21.192
   15    HG3  PRO   3           3HG      PRO   3 -15.359   2.244  22.459
   16    HD2  PRO   3           2HD      PRO   3 -14.936   0.682  20.288
   17    HD3  PRO   3           3HD      PRO   3 -16.517   0.799  21.086
   18    H    ALA   4           H        ALA   4 -16.123   3.402  17.048
   19    HA   ALA   4           HA       ALA   4 -13.586   4.798  16.948
   20    HB1  ALA   4           1HB      ALA   4 -14.951   4.219  14.415
   21    HB2  ALA   4           2HB      ALA   4 -13.306   3.849  14.932
   22    HB3  ALA   4           3HB      ALA   4 -14.641   2.812  15.433
   23    H1   DBU   5           H        DBU   5 -14.794   6.679  17.935
   24    HB1  DBU   5           HB       DBU   5 -16.363  10.006  17.582
   25    HG1  DBU   5           3HG      DBU   5 -14.821   8.419  19.465
   26    HG2  DBU   5           1HG      DBU   5 -16.347   7.568  19.298
   27    HG3  DBU   5           2HG      DBU   5 -16.334   9.238  19.870
   28    H1   DBU   6           H        DBU   6 -13.824   9.274  15.420
   29    HB1  DBU   6           HB       DBU   6 -14.635  11.472  12.369
   30    HG1  DBU   6           3HG      DBU   6 -13.502  12.148  14.826
   31    HG2  DBU   6           1HG      DBU   6 -15.047  11.541  15.397
   32    HG3  DBU   6           2HG      DBU   6 -14.999  12.933  14.313
   33    H    DAL   7           H        DAL   7 -16.082   7.688  13.357
   34    HA   DAL   7           HA       DAL   7 -14.750   6.659  11.001
   35    HB2  DAL   7           2HB      DAL   7 -16.691   8.300  10.378
   36    HB3  DAL   7           3HB      DAL   7 -17.726   6.942  10.814
   37    H    DHA   8           H        DHA   8 -17.879   6.185  12.529
   38    HB1  DHA   8           2HB      DHA   8 -18.328   5.139  14.962
   39    HB2  DHA   8           3HB      DHA   8 -18.644   3.305  14.851
   40    H    TRP   9           H        TRP   9 -19.411   2.348  13.402
   41    HA   TRP   9           HA       TRP   9 -18.052   0.292  12.127
   42    HB2  TRP   9           2HB      TRP   9 -20.939   0.850  12.670
   43    HB3  TRP   9           3HB      TRP   9 -20.519  -0.497  11.616
   44    HD1  TRP   9           HD1      TRP   9 -20.678   0.499  15.236
   45    HE1  TRP   9           HE1      TRP   9 -19.937  -1.477  16.709
   46    HE3  TRP   9           HE3      TRP   9 -18.806  -2.568  11.599
   47    HZ2  TRP   9           HZ2      TRP   9 -18.720  -4.002  16.374
   48    HZ3  TRP   9           HZ3      TRP   9 -17.871  -4.746  12.260
   49    HH2  TRP   9           HH2      TRP   9 -17.829  -5.446  14.598
   50    H    THR  10           H        THR  10 -20.028   2.862  10.781
   51    HA   THR  10           HA       THR  10 -20.419   1.890   8.204
   52    HB   THR  10           HB       THR  10 -19.955   4.767   9.013
   53    HG1  THR  10           HG1      THR  10 -21.755   4.309  10.076
   54   HG21  THR  10          3HG2      THR  10 -20.690   5.433   6.962
   55   HG22  THR  10          1HG2      THR  10 -21.709   4.011   6.743
   56   HG23  THR  10          2HG2      THR  10 -19.967   3.896   6.489
   57    H    CYS  11           H        CYS  11 -17.924   4.261   9.158
   58    HA   CYS  11           HA       CYS  11 -16.458   4.185   6.807
   59    HB2  CYS  11           2HB      CYS  11 -15.288   4.582   9.565
   60    HB3  CYS  11           3HB      CYS  11 -14.655   5.197   8.042
   61    H    ILE  12           H        ILE  12 -16.317   2.070   9.611
   62    HA   ILE  12           HA       ILE  12 -13.944   0.708   8.971
   63    HB   ILE  12           HB       ILE  12 -16.335   0.007  10.634
   64   HG12  ILE  12          2HG1      ILE  12 -13.473  -0.006  11.516
   65   HG13  ILE  12          3HG1      ILE  12 -14.288   1.534  11.262
   66   HG21  ILE  12          1HG2      ILE  12 -15.905  -2.134   9.890
   67   HG22  ILE  12          2HG2      ILE  12 -14.177  -1.836   9.705
   68   HG23  ILE  12          3HG2      ILE  12 -14.870  -2.034  11.315
   69   HD11  ILE  12          3HD1      ILE  12 -16.118   0.380  12.790
   70   HD12  ILE  12          1HD1      ILE  12 -14.708  -0.519  13.350
   71   HD13  ILE  12          2HD1      ILE  12 -14.733   1.242  13.461
   72    H1   DBU  13           H        DBU  13 -17.211  -0.591   8.695
   73    HB1  DBU  13           HB       DBU  13 -17.966  -3.654   6.617
   74    HG1  DBU  13           3HG      DBU  13 -17.940  -2.338   9.377
   75    HG2  DBU  13           1HG      DBU  13 -16.934  -3.766   9.203
   76    HG3  DBU  13           2HG      DBU  13 -18.678  -3.889   8.960
   77    H    ALA  14           H        ALA  14 -17.352   0.442   5.891
   78    HA   ALA  14           HA       ALA  14 -17.607  -0.393   3.205
   79    HB1  ALA  14           1HB      ALA  14 -16.850   2.224   3.015
   80    HB2  ALA  14           2HB      ALA  14 -18.500   1.659   3.280
   81    HB3  ALA  14           3HB      ALA  14 -17.504   2.146   4.652
   82    H    GLY  15           H        GLY  15 -14.871   0.915   5.049
   83    HA2  GLY  15           2HA      GLY  15 -13.084   0.970   2.827
   84    HA3  GLY  15           3HA      GLY  15 -12.637   1.097   4.522
   85    H    VAL  16           H        VAL  16 -13.474  -1.287   5.550
   86    HA   VAL  16           HA       VAL  16 -11.402  -3.019   5.029
   87    HB   VAL  16           HB       VAL  16 -14.166  -3.639   6.069
   88   HG11  VAL  16          1HG1      VAL  16 -11.717  -5.400   6.061
   89   HG12  VAL  16          2HG1      VAL  16 -13.227  -5.746   6.905
   90   HG13  VAL  16          3HG1      VAL  16 -13.197  -5.669   5.143
   91   HG21  VAL  16          3HG2      VAL  16 -12.128  -2.204   7.209
   92   HG22  VAL  16          1HG2      VAL  16 -13.421  -3.021   8.087
   93   HG23  VAL  16          2HG2      VAL  16 -11.866  -3.822   7.861
   94    H1   DBU  17           H        DBU  17 -14.643  -3.076   3.676
   95    HB1  DBU  17           HB       DBU  17 -15.832  -5.653   1.179
   96    HG1  DBU  17           3HG      DBU  17 -17.355  -4.920   3.131
   97    HG2  DBU  17           1HG      DBU  17 -15.921  -4.545   4.073
   98    HG3  DBU  17           2HG      DBU  17 -16.307  -6.226   3.696
   99    H    VAL  18           H        VAL  18 -13.256  -2.307   1.157
  100    HA   VAL  18           HA       VAL  18 -12.824  -3.208  -1.513
  101    HB   VAL  18           HB       VAL  18 -11.837  -0.809   0.015
  102   HG11  VAL  18          1HG1      VAL  18 -10.233  -0.449  -1.475
  103   HG12  VAL  18          2HG1      VAL  18 -10.632  -1.967  -2.282
  104   HG13  VAL  18          3HG1      VAL  18 -11.428  -0.470  -2.771
  105   HG21  VAL  18          3HG2      VAL  18 -13.237   0.132  -2.084
  106   HG22  VAL  18          1HG2      VAL  18 -14.051  -1.414  -1.836
  107   HG23  VAL  18          2HG2      VAL  18 -13.959  -0.244  -0.519
  108    H    DAL  19           H        DAL  19 -10.726  -2.786   1.314
  109    HA   DAL  19           HA       DAL  19  -8.688  -3.632   1.829
  110    HB2  DAL  19           2HB      DAL  19  -8.019  -2.145  -0.034
  111    HB3  DAL  19           3HB      DAL  19  -8.222  -3.489  -1.156
  112    H    ALA  20           H        ALA  20 -10.516  -5.549   1.887
  113    HA   ALA  20           HA       ALA  20  -9.053  -7.919   1.453
  114    HB1  ALA  20           1HB      ALA  20 -10.704  -7.744   3.221
  115    HB2  ALA  20           2HB      ALA  20 -11.992  -7.559   2.029
  116    HB3  ALA  20           3HB      ALA  20 -11.106  -9.080   2.141
  117    H    SER  21           H        SER  21 -10.521  -6.013  -0.782
  118    HA   SER  21           HA       SER  21 -11.619  -8.113  -2.451
  119    HB2  SER  21           2HB      SER  21 -12.008  -5.337  -2.239
  120    HB3  SER  21           3HB      SER  21 -11.266  -5.591  -3.818
  121    HG   SER  21           HG       SER  21 -13.515  -7.033  -2.863
  122    H    LEU  22           H        LEU  22  -8.884  -5.849  -2.564
  123    HA   LEU  22           HA       LEU  22  -7.625  -7.614  -4.560
  124    HB2  LEU  22           2HB      LEU  22  -6.944  -4.713  -4.325
  125    HB3  LEU  22           3HB      LEU  22  -6.725  -5.801  -5.694
  126    HG   LEU  22           HG       LEU  22  -9.329  -4.608  -4.746
  127   HD11  LEU  22          1HD1      LEU  22  -7.489  -4.046  -7.043
  128   HD12  LEU  22          2HD1      LEU  22  -8.187  -2.922  -5.878
  129   HD13  LEU  22          3HD1      LEU  22  -9.206  -3.650  -7.120
  130   HD21  LEU  22          3HD2      LEU  22  -8.988  -7.037  -6.000
  131   HD22  LEU  22          1HD2      LEU  22  -9.299  -5.930  -7.337
  132   HD23  LEU  22          2HD2      LEU  22 -10.456  -6.059  -6.012
  133    H    CYS  23           H        CYS  23  -6.956  -5.241  -1.994
  134    HA   CYS  23           HA       CYS  23  -4.383  -5.271  -1.513
  135    HB2  CYS  23           2HB      CYS  23  -6.377  -6.053   0.624
  136    HB3  CYS  23           3HB      CYS  23  -4.776  -5.380   0.911
  137    HA   PRO  24           HA       PRO  24  -2.790  -9.391  -1.951
  138    HB2  PRO  24           2HB      PRO  24  -0.695  -8.212  -0.185
  139    HB3  PRO  24           3HB      PRO  24  -0.518  -9.102  -1.701
  140    HG2  PRO  24           2HG      PRO  24  -0.248  -6.438  -1.606
  141    HG3  PRO  24           3HG      PRO  24  -0.984  -7.250  -3.000
  142    HD2  PRO  24           2HD      PRO  24  -2.241  -5.641  -0.865
  143    HD3  PRO  24           3HD      PRO  24  -2.742  -5.888  -2.550
  144    HN2  DB2  25           H        DB2  25  -3.090 -11.184  -0.787
  145    HA   DB2  25           HA       DB2  25  -2.970 -11.082   2.132
  146   HB2C  DB2  25          HB        DB2  25  -2.744 -13.182   0.076
  147   HG1C  DB2  25          3HG       DB2  25  -0.921 -13.898   1.463
  148   HG2C  DB2  25          1HG       DB2  25  -1.495 -12.910   2.809
  149   HG3C  DB2  25          2HG       DB2  25  -0.868 -12.138   1.353
  150    H1   DBU  26           H        DBU  26  -5.205 -10.466  -0.076
  151    HB1  DBU  26           HB       DBU  26  -8.727  -9.854   1.362
  152    HG1  DBU  26           3HG      DBU  26  -5.806  -8.913   1.684
  153    HG2  DBU  26           1HG      DBU  26  -7.195  -8.199   2.485
  154    HG3  DBU  26           2HG      DBU  26  -6.938  -7.921   0.760
  155    H    LYS  27           H        LYS  27  -6.640 -12.558  -1.111
  156    HA   LYS  27           HA       LYS  27  -9.120 -14.049  -0.672
  157    HB2  LYS  27           2HB      LYS  27  -7.608 -13.274  -2.985
  158    HB3  LYS  27           3HB      LYS  27  -7.753 -15.026  -2.950
  159    HG2  LYS  27           2HG      LYS  27 -10.177 -14.831  -2.784
  160    HG3  LYS  27           3HG      LYS  27 -10.040 -13.071  -2.797
  161    HD2  LYS  27           2HD      LYS  27  -8.656 -13.652  -5.026
  162    HD3  LYS  27           3HD      LYS  27  -9.773 -15.018  -5.006
  163    HE2  LYS  27           2HE      LYS  27 -10.523 -12.098  -4.903
  164    HE3  LYS  27           3HE      LYS  27 -10.683 -13.163  -6.298
  165    HZ1  LYS  27           3HZ      LYS  27 -12.724 -12.738  -4.822
  166    HZ2  LYS  27           1HZ      LYS  27 -12.007 -13.836  -3.753
  167    HZ3  LYS  27           2HZ      LYS  27 -12.407 -14.323  -5.322
  168    H    CYS  28           H        CYS  28  -6.018 -14.227   0.343
  169    HA   CYS  28           HA       CYS  28  -5.628 -17.080   0.015
  170    HB2  CYS  28           2HB      CYS  28  -3.582 -16.664   1.415
  171    HB3  CYS  28           3HB      CYS  28  -3.648 -15.735  -0.078
  172    HN2  DB2  29           H        DB2  29  -7.853 -17.240   1.152
  173    HA   DB2  29           HA       DB2  29  -7.309 -17.925   3.946
  174   HB2C  DB2  29          HB        DB2  29  -8.391 -19.481   2.177
  175   HG1C  DB2  29          3HG       DB2  29  -9.468 -20.693   3.961
  176   HG2C  DB2  29          1HG       DB2  29  -9.637 -19.217   4.914
  177   HG3C  DB2  29          2HG       DB2  29  -8.037 -19.888   4.604
  178    H    SER  30           H        SER  30  -7.726 -15.151   3.040
  179    HA   SER  30           HA       SER  30  -9.428 -14.323   5.149
  180    HB2  SER  30           2HB      SER  30  -7.896 -12.674   4.778
  181    HB3  SER  30           3HB      SER  30  -7.812 -12.997   3.046
  182    HG   SER  30           HG       SER  30  -8.994 -10.998   4.093
  183    H    ARG  31           H        ARG  31  -9.768 -14.016   1.612
  184    HA   ARG  31           HA       ARG  31 -12.686 -13.904   2.005
  185    HB2  ARG  31           2HB      ARG  31 -10.983 -11.983   0.786
  186    HB3  ARG  31           3HB      ARG  31 -11.954 -12.712  -0.486
  187    HG2  ARG  31           2HG      ARG  31 -13.072 -11.518   2.041
  188    HG3  ARG  31           3HG      ARG  31 -12.960 -10.678   0.493
  189    HD2  ARG  31           2HD      ARG  31 -14.526 -12.094  -0.517
  190    HD3  ARG  31           3HD      ARG  31 -14.363 -13.317   0.743
  191    HE   ARG  31           HE       ARG  31 -15.341 -10.921   1.861
  192   HH11  ARG  31          1HH1      ARG  31 -16.322 -13.553  -0.197
  193   HH12  ARG  31          2HH1      ARG  31 -17.997 -13.430   0.226
  194   HH21  ARG  31          1HH2      ARG  31 -17.544 -10.750   2.425
  195   HH22  ARG  31          2HH2      ARG  31 -18.692 -11.835   1.716
  196    H    CYS  32           H        CYS  32 -11.328 -16.311   1.683
  197    HA   CYS  32           HA       CYS  32 -11.436 -17.100  -1.092
  198    HB2  CYS  32           2HB      CYS  32 -11.111 -19.438   0.078
  199    HB3  CYS  32           3HB      CYS  32  -9.778 -18.291  -0.020
  Start of MODEL   20
    1    H41  2KT   1           2H4      2KT   1 -28.270   8.841  20.842
    2    H42  2KT   1           3H4      2KT   1 -28.590  10.264  20.491
    3    H43  2KT   1           1H4      2KT   1 -29.244   9.142  19.741
    4    H31  2KT   1           2H3      2KT   1 -27.274   8.432  19.091
    5    H32  2KT   1           3H3      2KT   1 -27.794   9.587  18.288
    6    H1   DBU   2           H        DBU   2 -24.587   9.904  17.866
    7    HB1  DBU   2           HB       DBU   2 -21.183   8.956  19.751
    8    HG1  DBU   2           3HG      DBU   2 -22.496  11.539  19.461
    9    HG2  DBU   2           1HG      DBU   2 -21.568  11.066  20.874
   10    HG3  DBU   2           2HG      DBU   2 -23.303  10.745  20.817
   11    HA   PRO   3           HA       PRO   3 -23.434   5.472  16.482
   12    HB2  PRO   3           2HB      PRO   3 -22.579   6.137  13.993
   13    HB3  PRO   3           3HB      PRO   3 -24.229   6.435  14.553
   14    HG2  PRO   3           2HG      PRO   3 -21.914   8.326  14.388
   15    HG3  PRO   3           3HG      PRO   3 -23.610   8.593  13.947
   16    HD2  PRO   3           2HD      PRO   3 -22.556   9.471  16.282
   17    HD3  PRO   3           3HD      PRO   3 -24.251   8.962  16.130
   18    H    ALA   4           H        ALA   4 -21.351   5.684  18.143
   19    HA   ALA   4           HA       ALA   4 -19.343   4.627  18.487
   20    HB1  ALA   4           1HB      ALA   4 -18.822   3.053  17.011
   21    HB2  ALA   4           2HB      ALA   4 -20.061   3.710  15.940
   22    HB3  ALA   4           3HB      ALA   4 -18.392   4.263  15.802
   23    H1   DBU   5           H        DBU   5 -18.930   6.335  15.426
   24    HB1  DBU   5           HB       DBU   5 -17.136   9.692  15.259
   25    HG1  DBU   5           3HG      DBU   5 -19.829   9.251  16.122
   26    HG2  DBU   5           1HG      DBU   5 -19.729   8.273  14.668
   27    HG3  DBU   5           2HG      DBU   5 -19.441  10.012  14.576
   28    H1   DBU   6           H        DBU   6 -15.678   9.407  16.253
   29    HB1  DBU   6           HB       DBU   6 -12.206   8.791  17.696
   30    HG1  DBU   6           3HG      DBU   6 -15.110   9.225  18.571
   31    HG2  DBU   6           1HG      DBU   6 -14.129  10.668  18.374
   32    HG3  DBU   6           2HG      DBU   6 -13.670   9.452  19.569
   33    H    DAL   7           H        DAL   7 -14.696   6.764  14.748
   34    HA   DAL   7           HA       DAL   7 -12.245   6.667  13.212
   35    HB2  DAL   7           2HB      DAL   7 -14.606   6.659  12.250
   36    HB3  DAL   7           3HB      DAL   7 -14.711   4.984  12.789
   37    H    DHA   8           H        DHA   8 -14.301   4.318  14.833
   38    HB1  DHA   8           2HB      DHA   8 -12.078   3.707  17.004
   39    HB2  DHA   8           3HB      DHA   8 -11.972   1.847  16.911
   40    H    TRP   9           H        TRP   9 -14.623   1.125  16.112
   41    HA   TRP   9           HA       TRP   9 -13.881  -1.068  14.556
   42    HB2  TRP   9           2HB      TRP   9 -16.517  -0.281  15.791
   43    HB3  TRP   9           3HB      TRP   9 -16.301  -1.801  14.927
   44    HD1  TRP   9           HD1      TRP   9 -16.141  -0.447  18.310
   45    HE1  TRP   9           HE1      TRP   9 -14.861  -2.027  19.888
   46    HE3  TRP   9           HE3      TRP   9 -13.945  -3.475  14.824
   47    HZ2  TRP   9           HZ2      TRP   9 -13.146  -4.259  19.683
   48    HZ3  TRP   9           HZ3      TRP   9 -12.499  -5.309  15.598
   49    HH2  TRP   9           HH2      TRP   9 -12.109  -5.691  17.977
   50    H    THR  10           H        THR  10 -16.358   1.406  13.928
   51    HA   THR  10           HA       THR  10 -17.377   0.457  11.549
   52    HB   THR  10           HB       THR  10 -16.858   3.382  12.096
   53    HG1  THR  10           HG1      THR  10 -19.071   1.789  12.933
   54   HG21  THR  10          3HG2      THR  10 -18.149   3.790  10.323
   55   HG22  THR  10          1HG2      THR  10 -19.395   2.686  10.905
   56   HG23  THR  10          2HG2      THR  10 -18.054   2.072   9.938
   57    H    CYS  11           H        CYS  11 -14.692   2.781  11.910
   58    HA   CYS  11           HA       CYS  11 -14.022   3.017   9.230
   59    HB2  CYS  11           2HB      CYS  11 -12.287   3.174  11.697
   60    HB3  CYS  11           3HB      CYS  11 -11.715   3.596  10.087
   61    H    ILE  12           H        ILE  12 -13.075   0.567  11.575
   62    HA   ILE  12           HA       ILE  12 -11.100  -0.708  10.034
   63    HB   ILE  12           HB       ILE  12 -12.828  -1.591  12.313
   64   HG12  ILE  12          2HG1      ILE  12  -9.830  -1.402  11.943
   65   HG13  ILE  12          3HG1      ILE  12 -10.836  -0.182  12.717
   66   HG21  ILE  12          1HG2      ILE  12 -11.213  -3.691  12.167
   67   HG22  ILE  12          2HG2      ILE  12 -12.783  -3.659  11.365
   68   HG23  ILE  12          3HG2      ILE  12 -11.315  -3.327  10.444
   69   HD11  ILE  12          3HD1      ILE  12 -10.350  -1.213  14.620
   70   HD12  ILE  12          1HD1      ILE  12 -11.461  -2.478  14.093
   71   HD13  ILE  12          2HD1      ILE  12  -9.732  -2.638  13.786
   72    H1   DBU  13           H        DBU  13 -14.276  -2.052  10.749
   73    HB1  DBU  13           HB       DBU  13 -15.817  -4.813   8.704
   74    HG1  DBU  13           3HG      DBU  13 -15.709  -5.352  11.097
   75    HG2  DBU  13           1HG      DBU  13 -14.912  -3.825  11.440
   76    HG3  DBU  13           2HG      DBU  13 -13.978  -5.174  10.787
   77    H    ALA  14           H        ALA  14 -15.343  -0.674   8.259
   78    HA   ALA  14           HA       ALA  14 -16.464  -1.203   5.725
   79    HB1  ALA  14           1HB      ALA  14 -17.210   0.798   6.511
   80    HB2  ALA  14           2HB      ALA  14 -15.652   1.229   7.218
   81    HB3  ALA  14           3HB      ALA  14 -15.901   1.376   5.478
   82    H    GLY  15           H        GLY  15 -13.248  -0.053   6.700
   83    HA2  GLY  15           2HA      GLY  15 -12.271   0.234   4.040
   84    HA3  GLY  15           3HA      GLY  15 -11.297   0.186   5.502
   85    H    VAL  16           H        VAL  16 -11.829  -2.300   6.498
   86    HA   VAL  16           HA       VAL  16 -10.079  -3.954   5.174
   87    HB   VAL  16           HB       VAL  16 -12.398  -4.703   6.953
   88   HG11  VAL  16          1HG1      VAL  16 -10.758  -6.395   5.329
   89   HG12  VAL  16          2HG1      VAL  16 -10.415  -6.697   7.034
   90   HG13  VAL  16          3HG1      VAL  16 -12.066  -6.834   6.427
   91   HG21  VAL  16          3HG2      VAL  16  -9.504  -4.827   7.691
   92   HG22  VAL  16          1HG2      VAL  16 -10.359  -3.285   7.732
   93   HG23  VAL  16          2HG2      VAL  16 -10.918  -4.629   8.727
   94    H1   DBU  17           H        DBU  17 -13.584  -3.911   4.920
   95    HB1  DBU  17           HB       DBU  17 -15.559  -6.200   2.657
   96    HG1  DBU  17           3HG      DBU  17 -16.162  -5.333   5.167
   97    HG2  DBU  17           1HG      DBU  17 -14.506  -5.792   5.525
   98    HG3  DBU  17           2HG      DBU  17 -15.666  -7.022   5.016
   99    H    VAL  18           H        VAL  18 -13.048  -2.848   2.178
  100    HA   VAL  18           HA       VAL  18 -13.480  -3.467  -0.573
  101    HB   VAL  18           HB       VAL  18 -12.027  -1.216   0.803
  102   HG11  VAL  18          1HG1      VAL  18 -10.999  -0.646  -1.079
  103   HG12  VAL  18          2HG1      VAL  18 -11.605  -2.115  -1.846
  104   HG13  VAL  18          3HG1      VAL  18 -12.541  -0.622  -1.935
  105   HG21  VAL  18          3HG2      VAL  18 -14.729  -1.675  -0.275
  106   HG22  VAL  18          1HG2      VAL  18 -14.189  -0.621   1.031
  107   HG23  VAL  18          2HG2      VAL  18 -14.017  -0.105  -0.646
  108    H    DAL  19           H        DAL  19 -10.574  -3.204   1.455
  109    HA   DAL  19           HA       DAL  19  -8.500  -4.096   1.239
  110    HB2  DAL  19           2HB      DAL  19  -8.474  -2.396  -0.590
  111    HB3  DAL  19           3HB      DAL  19  -8.944  -3.665  -1.720
  112    H    ALA  20           H        ALA  20 -10.257  -6.048   1.637
  113    HA   ALA  20           HA       ALA  20  -9.018  -8.329   0.556
  114    HB1  ALA  20           1HB      ALA  20 -10.854  -9.585   1.632
  115    HB2  ALA  20           2HB      ALA  20 -10.104  -8.406   2.709
  116    HB3  ALA  20           3HB      ALA  20 -11.667  -8.057   1.971
  117    H    SER  21           H        SER  21 -11.027  -6.222  -0.970
  118    HA   SER  21           HA       SER  21 -12.566  -8.147  -2.490
  119    HB2  SER  21           2HB      SER  21 -12.296  -5.202  -3.088
  120    HB3  SER  21           3HB      SER  21 -13.622  -6.283  -3.515
  121    HG   SER  21           HG       SER  21 -13.869  -6.506  -1.135
  122    H    LEU  22           H        LEU  22  -9.944  -5.833  -3.124
  123    HA   LEU  22           HA       LEU  22  -9.289  -7.383  -5.543
  124    HB2  LEU  22           2HB      LEU  22  -8.586  -4.492  -5.238
  125    HB3  LEU  22           3HB      LEU  22  -8.723  -5.453  -6.709
  126    HG   LEU  22           HG       LEU  22 -10.942  -4.299  -5.034
  127   HD11  LEU  22          1HD1      LEU  22 -11.550  -3.461  -7.395
  128   HD12  LEU  22          2HD1      LEU  22  -9.879  -3.857  -7.798
  129   HD13  LEU  22          3HD1      LEU  22 -10.225  -2.678  -6.532
  130   HD21  LEU  22          3HD2      LEU  22 -12.085  -6.162  -5.541
  131   HD22  LEU  22          1HD2      LEU  22 -10.936  -6.651  -6.786
  132   HD23  LEU  22          2HD2      LEU  22 -12.182  -5.459  -7.156
  133    H    CYS  23           H        CYS  23  -7.940  -5.223  -3.058
  134    HA   CYS  23           HA       CYS  23  -5.337  -5.218  -3.300
  135    HB2  CYS  23           2HB      CYS  23  -6.668  -6.259  -0.789
  136    HB3  CYS  23           3HB      CYS  23  -5.046  -5.581  -0.882
  137    HA   PRO  24           HA       PRO  24  -3.892  -9.218  -4.565
  138    HB2  PRO  24           2HB      PRO  24  -1.406  -8.147  -3.311
  139    HB3  PRO  24           3HB      PRO  24  -1.638  -8.878  -4.903
  140    HG2  PRO  24           2HG      PRO  24  -1.368  -6.228  -4.608
  141    HG3  PRO  24           3HG      PRO  24  -2.448  -6.925  -5.831
  142    HD2  PRO  24           2HD      PRO  24  -3.094  -5.576  -3.283
  143    HD3  PRO  24           3HD      PRO  24  -4.028  -5.674  -4.789
  144    HN2  DB2  25           H        DB2  25  -3.855 -11.126  -3.556
  145    HA   DB2  25           HA       DB2  25  -2.956 -11.305  -0.779
  146   HB2C  DB2  25          HB        DB2  25  -3.429 -13.265  -2.974
  147   HG1C  DB2  25          3HG       DB2  25  -1.153 -12.948  -1.013
  148   HG2C  DB2  25          1HG       DB2  25  -1.247 -12.144  -2.582
  149   HG3C  DB2  25          2HG       DB2  25  -1.161 -13.903  -2.496
  150    H1   DBU  26           H        DBU  26  -5.703 -10.547  -2.229
  151    HB1  DBU  26           HB       DBU  26  -8.714 -10.217   0.155
  152    HG1  DBU  26           3HG      DBU  26  -7.138  -8.175  -0.689
  153    HG2  DBU  26           1HG      DBU  26  -5.816  -9.217  -0.191
  154    HG3  DBU  26           2HG      DBU  26  -6.971  -8.631   1.009
  155    H    LYS  27           H        LYS  27  -6.860 -12.977  -2.704
  156    HA   LYS  27           HA       LYS  27  -9.281 -14.476  -1.940
  157    HB2  LYS  27           2HB      LYS  27  -9.479 -15.184  -4.266
  158    HB3  LYS  27           3HB      LYS  27  -9.484 -13.428  -4.154
  159    HG2  LYS  27           2HG      LYS  27  -8.070 -13.717  -5.915
  160    HG3  LYS  27           3HG      LYS  27  -6.908 -13.719  -4.586
  161    HD2  LYS  27           2HD      LYS  27  -6.511 -15.969  -4.758
  162    HD3  LYS  27           3HD      LYS  27  -8.114 -16.312  -5.412
  163    HE2  LYS  27           2HE      LYS  27  -6.522 -16.656  -7.158
  164    HE3  LYS  27           3HE      LYS  27  -7.410 -15.178  -7.522
  165    HZ1  LYS  27           3HZ      LYS  27  -4.718 -15.414  -7.491
  166    HZ2  LYS  27           1HZ      LYS  27  -5.029 -14.737  -5.972
  167    HZ3  LYS  27           2HZ      LYS  27  -5.567 -13.956  -7.372
  168    H    CYS  28           H        CYS  28  -6.043 -14.549  -1.703
  169    HA   CYS  28           HA       CYS  28  -5.611 -17.322  -2.425
  170    HB2  CYS  28           2HB      CYS  28  -3.319 -16.843  -1.365
  171    HB3  CYS  28           3HB      CYS  28  -3.728 -15.977  -2.842
  172    HN2  DB2  29           H        DB2  29  -7.495 -17.741  -0.830
  173    HA   DB2  29           HA       DB2  29  -6.277 -18.668   1.663
  174   HB2C  DB2  29          HB        DB2  29  -7.758 -20.051   0.006
  175   HG1C  DB2  29          3HG       DB2  29  -8.439 -21.461   1.972
  176   HG2C  DB2  29          1HG       DB2  29  -7.896 -20.145   3.017
  177   HG3C  DB2  29          2HG       DB2  29  -6.746 -20.966   1.963
  178    H    SER  30           H        SER  30  -7.145 -15.835   1.056
  179    HA   SER  30           HA       SER  30  -7.972 -15.117   3.605
  180    HB2  SER  30           2HB      SER  30  -8.933 -13.134   1.814
  181    HB3  SER  30           3HB      SER  30  -7.447 -13.111   2.763
  182    HG   SER  30           HG       SER  30  -7.759 -14.269   0.188
  183    H    ARG  31           H        ARG  31  -9.906 -15.622   0.680
  184    HA   ARG  31           HA       ARG  31 -12.289 -15.824   2.391
  185    HB2  ARG  31           2HB      ARG  31 -13.507 -14.346   1.173
  186    HB3  ARG  31           3HB      ARG  31 -11.920 -13.679   0.813
  187    HG2  ARG  31           2HG      ARG  31 -12.911 -13.796  -1.267
  188    HG3  ARG  31           3HG      ARG  31 -11.960 -15.281  -1.210
  189    HD2  ARG  31           2HD      ARG  31 -13.906 -16.208  -1.888
  190    HD3  ARG  31           3HD      ARG  31 -14.256 -16.181  -0.160
  191    HE   ARG  31           HE       ARG  31 -15.065 -13.767  -1.433
  192   HH11  ARG  31          1HH1      ARG  31 -15.968 -17.092  -0.929
  193   HH12  ARG  31          2HH1      ARG  31 -17.664 -16.797  -1.128
  194   HH21  ARG  31          1HH2      ARG  31 -17.295 -13.367  -1.697
  195   HH22  ARG  31          2HH2      ARG  31 -18.417 -14.678  -1.565
  196    H    CYS  32           H        CYS  32 -10.678 -16.696  -0.615
  197    HA   CYS  32           HA       CYS  32 -11.219 -18.299  -2.198
  198    HB2  CYS  32           2HB      CYS  32 -11.570 -20.434  -0.296
  199    HB3  CYS  32           3HB      CYS  32 -10.203 -20.104  -1.355