*HEADER    METAL BINDING PROTEIN                   03-JAN-14   2MJC              
*TITLE     ZN-BINDING DOMAIN OF EUKARYOTIC TRANSLATION INITIATION FACTOR 3,      
*TITLE    2 SUBUNIT G                                                            
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: EUKARYOTIC TRANSLATION INITIATION FACTOR 3 SUBUNIT G;      
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: UNP RESIDUES 153-176;                                      
*COMPND   5 SYNONYM: EIF3G, EUKARYOTIC TRANSLATION INITIATION FACTOR 3 RNA-      
*COMPND   6 BINDING SUBUNIT, EIF-3 RNA-BINDING SUBUNIT, EUKARYOTIC TRANSLATION   
*COMPND   7 INITIATION FACTOR 3 SUBUNIT 4, EIF-3-DELTA, EIF3 P42, EIF3 P44;      
*COMPND   8 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: HOMO SAPIENS;                                   
*SOURCE   3 ORGANISM_COMMON: HUMAN;                                              
*SOURCE   4 ORGANISM_TAXID: 9606;                                                
*SOURCE   5 GENE: EIF3G, EIF3S4;                                                 
*SOURCE   6 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   7 EXPRESSION_SYSTEM_TAXID: 562;                                        
*SOURCE   8 EXPRESSION_SYSTEM_VECTOR: PGEX-6P1                                   
*KEYWDS    ZINC-BINDING DOMAIN, METAL BINDING PROTEIN                            
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    15                                                                    
*AUTHOR    M.AL-ABDUL-WAHID, M.MENADE, J.XIE, G.KOZLOV, K.GEHRING                
*REVDAT   1   07-JAN-15 2MJC    0                                                


!! Table of 13C NOE peaks. Ambiguities have been resolved by considering structures based only on unambiguous NOEs
!! 1. Ambigious NOES to sites on the same sidechain have been left in place. 

assign (RESID 10 AND NAME HA) (RESID 10 AND NAME HG2#) 2.90 1.10 1.10  !     noesy.170
    OR (RESID 10 AND NAME HA) (RESID 10 AND NAME HD1#)                 !     noesy.170
assign (RESID 10 AND NAME HA) (RESID 10 AND NAME HB) 2.90 1.10 1.10  !     noesy.169
assign (RESID 10 AND NAME HD1#) (RESID 10 AND NAME HA) 3.65 1.85 1.85  !     noesy.257
assign (RESID 10 AND NAME HA) (RESID 10 AND NAME HG1#) 3.65 1.85 1.85  !     noesy.171
assign (RESID 10 AND NAME HA) (RESID 10 AND NAME HG1#) 3.65 1.85 1.85  !     noesy.172
assign (RESID 10 AND NAME HB) (RESID 10 AND NAME HG1#) 3.65 1.85 1.85  !     noesy.240
assign (RESID 10 AND NAME HB) (RESID 10 AND NAME HG2#) 2.90 1.10 1.10  !     noesy.239
    OR (RESID 10 AND NAME HB) (RESID 10 AND NAME HD1#)                 !     noesy.239
assign (RESID 10 AND NAME HD1#) (RESID 10 AND NAME HG1#) 2.40 0.60 0.60  !     noesy.249
assign (RESID 10 AND NAME HD1#) (RESID 10 AND NAME HG1#) 2.90 1.10 1.10  !     noesy.251
assign (RESID 10 AND NAME HB) (RESID 10 AND NAME HA) 2.90 1.10 1.10  !     noesy.242
assign (RESID 10 AND NAME HB) (RESID 10 AND NAME HG1#) 2.90 1.10 1.10  !     noesy.241
assign (RESID 10 AND NAME HG1#) (RESID 10 AND NAME HD1#) 2.90 1.10 1.10  !     noesy.33
    OR (RESID 10 AND NAME HG1#) (RESID 10 AND NAME HG2#)                 !     noesy.33
assign (RESID 10 AND NAME HG1#) (RESID 10 AND NAME HD1#) 2.90 1.10 1.10  !     noesy.32
    OR (RESID 10 AND NAME HG1#) (RESID 10 AND NAME HG2#)                 !     noesy.32
assign (RESID 10 AND NAME HG1#) (RESID 10 AND NAME HB) 3.65 1.85 1.85  !     noesy.36
assign (RESID 10 AND NAME HG2#) (RESID 10 AND NAME HB) 2.90 1.10 1.10  !     noesy.287
assign (RESID 10 AND NAME HG1#) (RESID 10 AND NAME HA) 3.65 1.85 1.85  !     noesy.367
assign (RESID 10 AND NAME HG2#) (RESID 10 AND NAME HA) 2.90 1.10 1.10  !     noesy.290
assign (RESID 10 AND NAME HG1#) (RESID 10 AND NAME HA) 3.65 1.85 1.85  !     noesy.368
assign (RESID 10 AND NAME HD1#) (RESID 10 AND NAME HB) 3.65 1.85 1.85  !     noesy.252
assign (RESID 10 AND NAME HG2#) (RESID 10 AND NAME HG1#) 3.65 1.85 1.85  !     noesy.289
assign (RESID 10 AND NAME HG2#) (RESID 10 AND NAME HG1#) 3.65 1.85 1.85  !     noesy.288
assign (RESID 11 AND NAME HA) (RESID 11 AND NAME HB) 2.90 1.10 1.10  !     noesy.175
assign (RESID 11 AND NAME HB) (RESID 11 AND NAME HG2#) 3.65 1.85 1.85  !     noesy.159
assign (RESID 11 AND NAME HB) (RESID 11 AND NAME HA) 2.90 1.10 1.10  !     noesy.160
assign (RESID 11 AND NAME HG2#) (RESID 11 AND NAME HA) 3.65 1.85 1.85  !     noesy.304
assign (RESID 11 AND NAME HB) (RESID 11 AND NAME HG1#) 3.65 1.85 1.85  !     noesy.158
assign (RESID 11 AND NAME HG2#) (RESID 11 AND NAME HB) 2.90 1.10 1.10  !     noesy.303
assign (RESID 11 AND NAME HG1#) (RESID 11 AND NAME HA) 3.65 1.85 1.85  !     noesy.302
assign (RESID 11 AND NAME HA) (RESID 11 AND NAME HG1#) 3.65 1.85 1.85  !     noesy.174
assign (RESID 11 AND NAME HA) (RESID 11 AND NAME HG2#) 3.65 1.85 1.85  !     noesy.173
assign (RESID 11 AND NAME HG1#) (RESID 11 AND NAME HB) 2.90 1.10 1.10  !     noesy.301
assign (RESID 12 AND NAME HA) (RESID 12 AND NAME HB#) 2.40 0.60 0.60  !     noesy.51
assign (RESID 12 AND NAME HB#) (RESID 12 AND NAME HA) 2.90 1.10 1.10  !     noesy.215
assign (RESID 12 AND NAME HB#) (RESID 12 AND NAME HA) 2.40 0.60 0.60  !     noesy.214
assign (RESID 13 AND NAME HB1) (RESID 13 AND NAME HA) 2.40 0.60 0.60  !     noesy.80
assign (RESID 13 AND NAME HB2) (RESID 13 AND NAME HA) 2.40 0.60 0.60  !     noesy.81
assign (RESID 13 AND NAME HA) (RESID 13 AND NAME HB2) 2.40 0.60 0.60  !     noesy.133
assign (RESID 13 AND NAME HA) (RESID 13 AND NAME HB1) 2.90 1.10 1.10  !     noesy.132
assign (RESID 14 AND NAME HA) (RESID 14 AND NAME HB#) 2.40 0.60 0.60  !     noesy.93
assign (RESID 14 AND NAME HA) (RESID 14 AND NAME HD#) 3.65 1.85 1.85  !     noesy.107
assign (RESID 14 AND NAME HB#) (RESID 14 AND NAME HA) 2.40 0.60 0.60  !     noesy.124
assign (RESID 14 AND NAME HD#) (RESID 14 AND NAME HB#) 2.90 1.10 1.10  !     noesy.282
assign (RESID 14 AND NAME HD#) (RESID 14 AND NAME HA) 3.65 1.85 1.85  !     noesy.281
assign (RESID 14 AND NAME HD#) (RESID 14 AND NAME HG#) 3.65 1.85 1.85  !     noesy.283
assign (RESID 14 AND NAME HB#) (RESID 14 AND NAME HD#) 3.65 1.85 1.85  !     noesy.119
assign (RESID 14 AND NAME HG#) (RESID 14 AND NAME HD#) 3.65 1.85 1.85  !     noesy.39
assign (RESID 14 AND NAME HG#) (RESID 14 AND NAME HA) 3.65 1.85 1.85  !     noesy.38
assign (RESID 14 AND NAME HG#) (RESID 14 AND NAME HA) 3.65 1.85 1.85  !     noesy.37
assign (RESID 15 AND NAME HG2#) (RESID 15 AND NAME HG1#) 2.90 1.10 1.10  !     noesy.296
assign (RESID 15 AND NAME HA) (RESID 15 AND NAME HG2#) 2.90 1.10 1.10  !     noesy.211
assign (RESID 15 AND NAME HA) (RESID 15 AND NAME HG1#) 2.90 1.10 1.10  !     noesy.208
assign (RESID 15 AND NAME HA) (RESID 15 AND NAME HB) 3.65 1.85 1.85  !     noesy.207
assign (RESID 15 AND NAME HB) (RESID 15 AND NAME HG2#) 2.40 0.60 0.60  !     noesy.233
assign (RESID 15 AND NAME HA) (RESID 15 AND NAME HD1#) 3.65 1.85 1.85  !     noesy.210
assign (RESID 15 AND NAME HG1#) (RESID 15 AND NAME HD1#) 2.40 0.60 0.60  !     noesy.42
assign (RESID 15 AND NAME HG1#) (RESID 15 AND NAME HB) 2.90 1.10 1.10  !     noesy.45
assign (RESID 15 AND NAME HG1#) (RESID 15 AND NAME HA) 2.90 1.10 1.10  !     noesy.47
assign (RESID 15 AND NAME HG1#) (RESID 15 AND NAME HA) 2.90 1.10 1.10  !     noesy.46
assign (RESID 15 AND NAME HG1#) (RESID 15 AND NAME HD1#) 2.40 0.60 0.60  !     noesy.41
assign (RESID 15 AND NAME HB) (RESID 15 AND NAME HA) 3.65 1.85 1.85  !     noesy.238
assign (RESID 15 AND NAME HB) (RESID 15 AND NAME HG1#) 3.65 1.85 1.85  !     noesy.237
assign (RESID 15 AND NAME HG2#) (RESID 15 AND NAME HA) 2.90 1.10 1.10  !     noesy.292
assign (RESID 15 AND NAME HA) (RESID 15 AND NAME HG1#) 2.90 1.10 1.10  !     noesy.209
assign (RESID 15 AND NAME HG1#) (RESID 15 AND NAME HG2#) 3.65 1.85 1.85  !     noesy.57
assign (RESID 15 AND NAME HB) (RESID 15 AND NAME HG1#) 3.65 1.85 1.85  !     noesy.235
assign (RESID 15 AND NAME HD1#) (RESID 15 AND NAME HA) 3.65 1.85 1.85  !     noesy.261
assign (RESID 15 AND NAME HB) (RESID 15 AND NAME HD1#) 2.90 1.10 1.10  !     noesy.234
assign (RESID 15 AND NAME HD1#) (RESID 15 AND NAME HB) 2.90 1.10 1.10  !     noesy.264
assign (RESID 15 AND NAME HG1#) (RESID 15 AND NAME HG2#) 3.65 1.85 1.85  !     noesy.49
assign (RESID 15 AND NAME HG1#) (RESID 15 AND NAME HB) 3.65 1.85 1.85  !     noesy.48
assign (RESID 15 AND NAME HD1#) (RESID 15 AND NAME HG1#) 2.40 0.60 0.60  !     noesy.267
assign (RESID 16 AND NAME HB2) (RESID 16 AND NAME HA) 2.40 0.60 0.60  !     noesy.176
assign (RESID 16 AND NAME HB1) (RESID 16 AND NAME HA) 2.40 0.60 0.60  !     noesy.177
assign (RESID 16 AND NAME HA) (RESID 16 AND NAME HB2) 2.40 0.60 0.60  !     noesy.74
assign (RESID 16 AND NAME HA) (RESID 16 AND NAME HB1) 2.40 0.60 0.60  !     noesy.75
assign (RESID 17 AND NAME HA) (RESID 17 AND NAME HD#) 3.65 1.85 1.85  !     noesy.125
assign (RESID 17 AND NAME HB1) (RESID 17 AND NAME HA) 2.40 0.60 0.60  !     noesy.63
assign (RESID 17 AND NAME HB2) (RESID 17 AND NAME HG#) 2.90 1.10 1.10  !     noesy.64
assign (RESID 17 AND NAME HB1) (RESID 17 AND NAME HG#) 2.90 1.10 1.10  !     noesy.65
assign (RESID 17 AND NAME HB2) (RESID 17 AND NAME HA) 2.40 0.60 0.60  !     noesy.62
assign (RESID 17 AND NAME HA) (RESID 17 AND NAME HB2) 2.90 1.10 1.10  !     noesy.76
assign (RESID 17 AND NAME HG#) (RESID 17 AND NAME HB2) 2.90 1.10 1.10  !     noesy.1
assign (RESID 17 AND NAME HG#) (RESID 17 AND NAME HB1) 2.90 1.10 1.10  !     noesy.0
assign (RESID 17 AND NAME HA) (RESID 17 AND NAME HG#) 2.90 1.10 1.10  !     noesy.90
assign (RESID 17 AND NAME HA) (RESID 17 AND NAME HB1) 2.40 0.60 0.60  !     noesy.77
assign (RESID 17 AND NAME HG#) (RESID 17 AND NAME HA) 2.90 1.10 1.10  !     noesy.2
assign (RESID 19 AND NAME HA) (RESID 19 AND NAME HB#) 2.40 0.60 0.60  !     noesy.388
assign (RESID 19 AND NAME HB#) (RESID 19 AND NAME HA) 2.90 1.10 1.10  !     noesy.243
assign (RESID 19 AND NAME HB#) (RESID 19 AND NAME HA) 2.90 1.10 1.10  !     noesy.244
assign (RESID 20 AND NAME HB1) (RESID 20 AND NAME HA) 2.40 0.60 0.60  !     noesy.78
assign (RESID 20 AND NAME HB2) (RESID 20 AND NAME HA) 2.40 0.60 0.60  !     noesy.79
assign (RESID 20 AND NAME HA) (RESID 20 AND NAME HB2) 2.40 0.60 0.60  !     noesy.5
assign (RESID 20 AND NAME HA) (RESID 20 AND NAME HB1) 2.40 0.60 0.60  !     noesy.3
assign (RESID 21 AND NAME HB1) (RESID 21 AND NAME HA) 2.40 0.60 0.60  !     noesy.72
assign (RESID 21 AND NAME HB2) (RESID 21 AND NAME HA) 2.90 1.10 1.10  !     noesy.73
assign (RESID 21 AND NAME HA) (RESID 21 AND NAME HB1) 2.40 0.60 0.60  !     noesy.52
assign (RESID 22 AND NAME HG2#) (RESID 22 AND NAME HA) 2.90 1.10 1.10  !     noesy.329
assign (RESID 22 AND NAME HA) (RESID 22 AND NAME HB) 2.90 1.10 1.10  !     noesy.222
assign (RESID 22 AND NAME HA) (RESID 22 AND NAME HG2#) 3.65 1.85 1.85  !     noesy.223
assign (RESID 22 AND NAME HB) (RESID 22 AND NAME HG2#) 2.40 0.60 0.60  !     noesy.258
assign (RESID 22 AND NAME HB) (RESID 22 AND NAME HA) 3.65 1.85 1.85  !     noesy.269
assign (RESID 22 AND NAME HG2#) (RESID 22 AND NAME HB) 2.40 0.60 0.60  !     noesy.318
assign (RESID 22 AND NAME HG2#) (RESID 13 AND NAME HA)  3.65 1.85 1.85 !     noesy.318b
assign (RESID 23 AND NAME HA) (RESID 23 AND NAME HB) 2.40 0.60 0.60  !     noesy.194
assign (RESID 23 AND NAME HB) (RESID 23 AND NAME HG2#) 2.40 0.60 0.60  !     noesy.248
assign (RESID 23 AND NAME HG2#) (RESID 23 AND NAME HB) 2.40 0.60 0.60  !     noesy.317
assign (RESID 23 AND NAME HG2#) (RESID 23 AND NAME HA) 2.40 0.60 0.60  !     noesy.316
assign (RESID 23 AND NAME HB) (RESID 23 AND NAME HA) 2.40 0.60 0.60  !     noesy.247
assign (RESID 24 AND NAME HG#) (RESID 24 AND NAME HB2) 2.90 1.10 1.10  !     noesy.28
assign (RESID 24 AND NAME HG#) (RESID 24 AND NAME HA) 3.65 1.85 1.85  !     noesy.25
assign (RESID 24 AND NAME HG#) (RESID 24 AND NAME HA) 3.65 1.85 1.85  !     noesy.24
assign (RESID 24 AND NAME HG#) (RESID 24 AND NAME HB2) 2.90 1.10 1.10  !     noesy.29
assign (RESID 24 AND NAME HB1) (RESID 24 AND NAME HA) 2.90 1.10 1.10  !     noesy.83
assign (RESID 24 AND NAME HB2) (RESID 24 AND NAME HA) 2.90 1.10 1.10  !     noesy.82
assign (RESID 24 AND NAME HG#) (RESID 24 AND NAME HD#) 3.65 1.85 1.85  !     noesy.30
assign (RESID 24 AND NAME HA) (RESID 24 AND NAME HG#) 2.90 1.10 1.10  !     noesy.8
assign (RESID 24 AND NAME HA) (RESID 24 AND NAME HB1) 2.40 0.60 0.60  !     noesy.7
assign (RESID 24 AND NAME HA) (RESID 24 AND NAME HB2) 2.40 0.60 0.60  !     noesy.6
assign (RESID 24 AND NAME HD#) (RESID 24 AND NAME HB2) 3.65 1.85 1.85  !     noesy.280
assign (RESID 24 AND NAME HD#) (RESID 24 AND NAME HA) 3.65 1.85 1.85  !     noesy.277
assign (RESID 24 AND NAME HD#) (RESID 24 AND NAME HG#) 2.90 1.10 1.10  !     noesy.278
    OR (RESID 24 AND NAME HD#) (RESID 24 AND NAME HB1)                 !     noesy.278
assign (RESID 24 AND NAME HD#) (RESID 24 AND NAME HG#) 3.65 1.85 1.85  !     noesy.279
assign (RESID 24 AND NAME HB1) (RESID 24 AND NAME HD#) 3.65 1.85 1.85  !     noesy.85
assign (RESID 24 AND NAME HB2) (RESID 24 AND NAME HG#) 2.40 0.60 0.60  !     noesy.89
    OR (RESID 24 AND NAME HB2) (RESID 24 AND NAME HB1)                 !     noesy.89
assign (RESID 24 AND NAME HB2) (RESID 24 AND NAME HD#) 3.65 1.85 1.85  !     noesy.84
assign (RESID 25 AND NAME HA) (RESID 25 AND NAME HB1) 2.90 1.10 1.10  !     noesy.109
assign (RESID 25 AND NAME HA) (RESID 25 AND NAME HB2) 2.90 1.10 1.10  !     noesy.105 - double peak, bound increased to 4A
assign (RESID 25 AND NAME HA) (RESID 26 AND NAME HD#) 2.90 1.10 1.10 !      noesy.105 - second resonance within peak 105
assign (RESID 25 AND NAME HB2) (RESID 25 AND NAME HA) 2.40 0.60 0.60  !     noesy.138
assign (RESID 25 AND NAME HB1) (RESID 25 AND NAME HA) 2.40 0.60 0.60  !     noesy.141
assign (RESID 26 AND NAME HA) (RESID 26 AND NAME HB#) 2.40 0.60 0.60  !     noesy.200
assign (RESID 26 AND NAME HA) (RESID 26 AND NAME HB#) 2.40 0.60 0.60  !     noesy.201
    OR (RESID 26 AND NAME HA) (RESID 26 AND NAME HG#)                 !     noesy.201
assign (RESID 26 AND NAME HA) (RESID 26 AND NAME HG#) 3.65 1.85 1.85  !     noesy.204
assign (RESID 26 AND NAME HA) (RESID 26 AND NAME HD#) 3.65 1.85 1.85  !     noesy.206
assign (RESID 26 AND NAME HA) (RESID 26 AND NAME HD#) 3.65 1.85 1.85  !     noesy.205
assign (RESID 26 AND NAME HD#) (RESID 26 AND NAME HG#) 2.90 1.10 1.10  !     noesy.323
assign (RESID 26 AND NAME HD#) (RESID 26 AND NAME HG#) 3.65 1.85 1.85  !     noesy.324
assign (RESID 26 AND NAME HD#) (RESID 26 AND NAME HG#) 2.90 1.10 1.10  !     noesy.325
assign (RESID 26 AND NAME HB#) (RESID 26 AND NAME HD#) 3.65 1.85 1.85  !     noesy.147
assign (RESID 26 AND NAME HB#) (RESID 26 AND NAME HG#) 2.90 1.10 1.10  !     noesy.146
assign (RESID 26 AND NAME HD#) (RESID 26 AND NAME HG#) 3.65 1.85 1.85  !     noesy.326
assign (RESID 26 AND NAME HD#) (RESID 26 AND NAME HA) 3.65 1.85 1.85  !     noesy.342
assign (RESID 26 AND NAME HD#) (RESID 26 AND NAME HA) 3.65 1.85 1.85  !     noesy.343
assign (RESID 26 AND NAME HD#) (RESID 26 AND NAME HB#) 3.65 1.85 1.85  !     noesy.327
assign (RESID 26 AND NAME HD#) (RESID 26 AND NAME HB#) 3.65 1.85 1.85  !     noesy.328
assign (RESID 26 AND NAME HB#) (RESID 26 AND NAME HA) 2.40 0.60 0.60  !     noesy.134
assign (RESID 26 AND NAME HB#) (RESID 26 AND NAME HD#) 3.65 1.85 1.85  !     noesy.148
assign (RESID 26 AND NAME HG#) (RESID 26 AND NAME HD#) 3.65 1.85 1.85  !     noesy.15
assign (RESID 26 AND NAME HG#) (RESID 26 AND NAME HA) 3.65 1.85 1.85  !     noesy.14
assign (RESID 26 AND NAME HG#) (RESID 26 AND NAME HB#) 2.90 1.10 1.10  !     noesy.17
assign (RESID 26 AND NAME HG#) (RESID 26 AND NAME HD#) 3.65 1.85 1.85  !     noesy.16
assign (RESID 26 AND NAME HG#) (RESID 26 AND NAME HD#) 2.90 1.10 1.10  !     noesy.11
assign (RESID 26 AND NAME HG#) (RESID 26 AND NAME HB#) 2.90 1.10 1.10  !     noesy.10
assign (RESID 26 AND NAME HG#) (RESID 26 AND NAME HA) 3.65 1.85 1.85  !     noesy.13
assign (RESID 26 AND NAME HG#) (RESID 26 AND NAME HD#) 3.65 1.85 1.85  !     noesy.12
assign (RESID 26 AND NAME HB#) (RESID 26 AND NAME HG#) 2.90 1.10 1.10  !     noesy.152
assign (RESID 26 AND NAME HB#) (RESID 26 AND NAME HD#) 3.65 1.85 1.85  !     noesy.150
assign (RESID 26 AND NAME HB#) (RESID 26 AND NAME HA) 2.90 1.10 1.10  !     noesy.149
assign (RESID 26 AND NAME HB#) (RESID 26 AND NAME HD#) 3.65 1.85 1.85  !     noesy.151
assign (RESID 27 AND NAME HB2) (RESID 27 AND NAME HA) 2.90 1.10 1.10  !     noesy.221
assign (RESID 27 AND NAME HB1) (RESID 27 AND NAME HA) 2.90 1.10 1.10  !     noesy.220
assign (RESID 27 AND NAME HA) (RESID 27 AND NAME HB1) 2.40 0.60 0.60  !     noesy.53
assign (RESID 28 AND NAME HA) (RESID 28 AND NAME HB#) 2.90 1.10 1.10  !     noesy.92
assign (RESID 28 AND NAME HG#) (RESID 28 AND NAME HE#) 3.65 1.85 1.85  !     noesy.346
assign (RESID 28 AND NAME HG#) (RESID 28 AND NAME HA) 3.65 1.85 1.85  !     noesy.347
assign (RESID 28 AND NAME HA) (RESID 28 AND NAME HG#) 3.65 1.85 1.85  !     noesy.126
assign (RESID 28 AND NAME HG#) (RESID 28 AND NAME HB#) 2.90 1.10 1.10  !     noesy.345
assign (RESID 28 AND NAME HG#) (RESID 28 AND NAME HD#) 2.40 0.60 0.60  !     noesy.344
assign (RESID 29 AND NAME HB2) (RESID 29 AND NAME HA) 2.90 1.10 1.10  !     noesy.256
assign (RESID 29 AND NAME HA) (RESID 29 AND NAME HB1) 2.90 1.10 1.10  !     noesy.67
assign (RESID 29 AND NAME HA) (RESID 29 AND NAME HB2) 2.40 0.60 0.60  !     noesy.66
assign (RESID 29 AND NAME HB1) (RESID 29 AND NAME HA) 2.90 1.10 1.10  !     noesy.255
assign (RESID 30 AND NAME HB) (RESID 30 AND NAME HG2#) 2.90 1.10 1.10  !     noesy.259
assign (RESID 30 AND NAME HG2#) (RESID 30 AND NAME HA) 2.90 1.10 1.10  !     noesy.312
assign (RESID 30 AND NAME HA) (RESID 30 AND NAME HG2#) 2.90 1.10 1.10  !     noesy.188
assign (RESID 30 AND NAME HG2#) (RESID 30 AND NAME HB) 2.40 0.60 0.60  !     noesy.311
assign (RESID 31 AND NAME HB#) (RESID 31 AND NAME HA) 2.90 1.10 1.10  !     noesy.272
assign (RESID 31 AND NAME HB#) (RESID 31 AND NAME HD2#) 3.65 1.85 1.85  !     noesy.273
assign (RESID 31 AND NAME HA) (RESID 31 AND NAME HD2#) 3.65 1.85 1.85  !     noesy.27
assign (RESID 31 AND NAME HA) (RESID 31 AND NAME HB#) 2.90 1.10 1.10  !     noesy.26
assign (RESID 31 AND NAME HD2#) (RESID 31 AND NAME HA) 2.90 1.10 1.10  !     noesy.331
assign (RESID 31 AND NAME HD2#) (RESID 31 AND NAME HB#) 2.90 1.10 1.10  !     noesy.340
assign (RESID 12 AND NAME HA) (RESID 13 AND NAME HB1) 3.65 1.85 1.85  !     noesy.370
assign (RESID 12 AND NAME HA) (RESID 13 AND NAME HB2) 3.65 1.85 1.85  !     noesy.371
assign (RESID 15 AND NAME HG2#) (RESID 27 AND NAME HB1) 3.65 1.85 1.85  !     noesy.294
assign (RESID 16 AND NAME HB2) (RESID 15 AND NAME HG2#) 3.65 1.85 1.85  !     noesy.178
assign (RESID 16 AND NAME HB1) (RESID 15 AND NAME HG2#) 3.65 1.85 1.85  !     noesy.179
assign (RESID 15 AND NAME HG2#) (RESID 16 AND NAME HA) 3.65 1.85 1.85  !     noesy.295
assign (RESID 16 AND NAME HA) (RESID 15 AND NAME HG2#) 3.65 1.85 1.85  !     noesy.100
assign (RESID 16 AND NAME HA) (RESID 17 AND NAME HG#) 3.65 1.85 1.85  !     noesy.363
assign (RESID 17 AND NAME HG#) (RESID 16 AND NAME HA) 3.65 1.85 1.85  !     noesy.386
assign (RESID 22 AND NAME HG2#) (RESID 23 AND NAME HA) 3.65 1.85 1.85  !     noesy.330
assign (RESID 23 AND NAME HA) (RESID 22 AND NAME HG2#) 3.65 1.85 1.85  !     noesy.202
assign (RESID 26 AND NAME HD#) (RESID 25 AND NAME HA) 2.40 0.60 0.60  !     noesy.322
assign (RESID 26 AND NAME HG#) (RESID 25 AND NAME HA) 3.65 1.85 1.85  !     noesy.23
assign (RESID 25 AND NAME HA) (RESID 26 AND NAME HD#) 2.40 0.60 0.60  !     noesy.108
assign (RESID 26 AND NAME HG#) (RESID 25 AND NAME HA) 3.65 1.85 1.85  !     noesy.22
assign (RESID 26 AND NAME HD#) (RESID 25 AND NAME HA) 2.40 0.60 0.60  !     noesy.320
assign (RESID 25 AND NAME HA) (RESID 26 AND NAME HG#) 3.65 1.85 1.85  !     noesy.403
assign (RESID 25 AND NAME HA) (RESID 26 AND NAME HG#) 3.65 1.85 1.85  !     noesy.404
assign (RESID 27 AND NAME HB1) (RESID 28 AND NAME HD#) 3.65 1.85 1.85  !     noesy.228
assign (RESID 10 AND NAME HG2#) (RESID 12 AND NAME HB#) 3.65 1.85 1.85  !     noesy.369
assign (RESID 12 AND NAME HB#) (RESID 10 AND NAME HG2#) 3.65 1.85 1.85  !     noesy.372
assign (RESID 12 AND NAME HB#) (RESID 10 AND NAME HG2#) 3.65 1.85 1.85  !     noesy.373
assign (RESID 24 AND NAME HB2) (RESID 20 AND NAME HB2) 3.65 1.85 1.85  !     noesy.120
assign (RESID 20 AND NAME HB1) (RESID 24 AND NAME HB1) 3.65 1.85 1.85  !     noesy.111
assign (RESID 20 AND NAME HB2) (RESID 24 AND NAME HB1) 3.65 1.85 1.85  !     noesy.112
    OR (RESID 20 AND NAME HB2) (RESID 24 AND NAME HG#)                 !     noesy.112
assign (RESID 20 AND NAME HB2) (RESID 24 AND NAME HB2) 3.65 1.85 1.85  !     noesy.113
assign (RESID 23 AND NAME HG2#) (RESID 21 AND NAME HB1) 3.65 1.85 1.85  !     noesy.337
assign (RESID 21 AND NAME HB2) (RESID 24 AND NAME HG#) 3.65 1.85 1.85  !     noesy.96
    OR (RESID 21 AND NAME HB2) (RESID 24 AND NAME HB1)                 !     noesy.96
assign (RESID 24 AND NAME HB1) (RESID 21 AND NAME HB2) 3.65 1.85 1.85  !     noesy.87
assign (RESID 21 AND NAME HB2) (RESID 24 AND NAME HG#) 3.65 1.85 1.85  !     noesy.397
assign (RESID 21 AND NAME HB1) (RESID 23 AND NAME HG2#) 3.65 1.85 1.85  !     noesy.394
assign (RESID 21 AND NAME HB1) (RESID 24 AND NAME HG#) 3.65 1.85 1.85  !     noesy.395
assign (RESID 25 AND NAME HB2) (RESID 22 AND NAME HG2#) 3.65 1.85 1.85  !     noesy.136
assign (RESID 22 AND NAME HA) (RESID 25 AND NAME HB1) 3.65 1.85 1.85  !     noesy.225
assign (RESID 22 AND NAME HA) (RESID 25 AND NAME HB2) 3.65 1.85 1.85  !     noesy.224
assign (RESID 25 AND NAME HB2) (RESID 22 AND NAME HA) 3.65 1.85 1.85  !     noesy.139
assign (RESID 25 AND NAME HB1) (RESID 22 AND NAME HA) 3.65 1.85 1.85  !     noesy.140
assign (RESID 22 AND NAME HG2#) (RESID 25 AND NAME HB2) 3.65 1.85 1.85  !     noesy.332
assign (RESID 22 AND NAME HG2#) (RESID 25 AND NAME HB1) 3.65 1.85 1.85  !     noesy.335
assign (RESID 25 AND NAME HB2) (RESID 28 AND NAME HB#) 3.65 1.85 1.85  !     noesy.137
assign (RESID 25 AND NAME HB1) (RESID 28 AND NAME HD#) 3.65 1.85 1.85  !     noesy.143
assign (RESID 25 AND NAME HB1) (RESID 28 AND NAME HB#) 3.65 1.85 1.85  !     noesy.142
assign (RESID 25 AND NAME HB1) (RESID 28 AND NAME HG#) 3.65 1.85 1.85  !     noesy.144
assign (RESID 30 AND NAME HG2#) (RESID 27 AND NAME HA) 3.65 1.85 1.85  !     noesy.440
assign (RESID 11 AND NAME HG2#) (RESID 20 AND NAME HA) 3.65 1.85 1.85  !     noesy.305
assign (RESID 11 AND NAME HG1#) (RESID 20 AND NAME HA) 3.65 1.85 1.85  !     noesy.439
assign (RESID 20 AND NAME HA) (RESID 11 AND NAME HG2#) 3.65 1.85 1.85  !     noesy.21
assign (RESID 11 AND NAME HG2#) (RESID 21 AND NAME HA) 3.65 1.85 1.85  !     noesy.306
assign (RESID 11 AND NAME HG1#) (RESID 21 AND NAME HA) 3.65 1.85 1.85  !     noesy.307
assign (RESID 22 AND NAME HA) (RESID 13 AND NAME HB2) 3.65 1.85 1.85  !     noesy.226
assign (RESID 13 AND NAME HB1) (RESID 22 AND NAME HA) 3.65 1.85 1.85  !     noesy.379
assign (RESID 13 AND NAME HB1) (RESID 18 AND NAME HA#) 3.65 1.85 1.85  !     noesy.377
assign (RESID 13 AND NAME HA) (RESID 22 AND NAME HA) 3.65 1.85 1.85  !     noesy.153
assign (RESID 13 AND NAME HB2) (RESID 22 AND NAME HA) 3.65 1.85 1.85  !     noesy.380
assign (RESID 13 AND NAME HA) (RESID 21 AND NAME HA) 3.65 1.85 1.85  !     noesy.441
assign (RESID 13 AND NAME HA) (RESID 22 AND NAME HG2#) 3.65 1.85 1.85  !     noesy.442
assign (RESID 18 AND NAME HA#) (RESID 13 AND NAME HB2) 3.65 1.85 1.85  !     noesy.361
assign (RESID 18 AND NAME HA#) (RESID 13 AND NAME HB1) 3.65 1.85 1.85  !     noesy.359
assign (RESID 13 AND NAME HB2) (RESID 18 AND NAME HA#) 3.65 1.85 1.85  !     noesy.378
assign (RESID 14 AND NAME HB#) (RESID 22 AND NAME HG2#) 3.65 1.85 1.85  !     noesy.121
assign (RESID 22 AND NAME HG2#) (RESID 14 AND NAME HD#) 3.65 1.85 1.85  !     noesy.334
assign (RESID 22 AND NAME HG2#) (RESID 14 AND NAME HB#) 2.90 1.10 1.10  !     noesy.339
assign (RESID 25 AND NAME HB1) (RESID 15 AND NAME HD1#) 3.65 1.85 1.85  !     noesy.145
assign (RESID 15 AND NAME HG2#) (RESID 27 AND NAME HB2) 3.65 1.85 1.85  !     noesy.293
assign (RESID 15 AND NAME HD1#) (RESID 22 AND NAME HG2#) 2.90 1.10 1.10  !     noesy.268
assign (RESID 15 AND NAME HD1#) (RESID 22 AND NAME HA) 3.65 1.85 1.85  !     noesy.270
assign (RESID 15 AND NAME HD1#) (RESID 25 AND NAME HB2) 3.65 1.85 1.85  !     noesy.262
assign (RESID 15 AND NAME HD1#) (RESID 25 AND NAME HB1) 3.65 1.85 1.85  !     noesy.263
assign (RESID 28 AND NAME HA) (RESID 15 AND NAME HG2#) 3.65 1.85 1.85  !     noesy.110
assign (RESID 22 AND NAME HG2#) (RESID 15 AND NAME HA) 3.65 1.85 1.85  !     noesy.333
assign (RESID 28 AND NAME HA) (RESID 15 AND NAME HD1#) 2.90 1.10 1.10  !     noesy.91
assign (RESID 22 AND NAME HG2#) (RESID 15 AND NAME HB) 3.65 1.85 1.85  !     noesy.336
assign (RESID 25 AND NAME HB2) (RESID 15 AND NAME HD1#) 3.65 1.85 1.85  !     noesy.135
assign (RESID 15 AND NAME HA) (RESID 22 AND NAME HG2#) 3.65 1.85 1.85  !     noesy.212
assign (RESID 22 AND NAME HG2#) (RESID 15 AND NAME HD1#) 2.90 1.10 1.10  !     noesy.341
assign (RESID 27 AND NAME HB1) (RESID 15 AND NAME HG2#) 3.65 1.85 1.85  !     noesy.229
assign (RESID 15 AND NAME HG2#) (RESID 22 AND NAME HG2#) 3.65 1.85 1.85  !     noesy.297
assign (RESID 15 AND NAME HD1#) (RESID 28 AND NAME HA) 2.90 1.10 1.10  !     noesy.260
assign (RESID 15 AND NAME HG2#) (RESID 28 AND NAME HA) 3.65 1.85 1.85  !     noesy.298
assign (RESID 27 AND NAME HB2) (RESID 15 AND NAME HG2#) 3.65 1.85 1.85  !     noesy.230
assign (RESID 15 AND NAME HB) (RESID 22 AND NAME HG2#) 3.65 1.85 1.85  !     noesy.236
assign (RESID 27 AND NAME HB2) (RESID 16 AND NAME HB1) 3.65 1.85 1.85  !     noesy.232

assign (RESID 15 AND NAME HB) (RESID 16 AND NAME HA) 3.65 1.85 1.85  !     noesy.385
assign (RESID 15 AND NAME HB) (RESID 25 AND NAME HB2) 3.65 1.85 1.85  !     noesy.460
assign (RESID 15 AND NAME HB) (RESID 25 AND NAME HB1) 3.65 1.85 1.85  !     noesy.461
assign (RESID 15 AND NAME HB) (RESID 16 AND NAME HB2) 3.65 1.85 1.85  !     noesy.382

assign (RESID 17 AND NAME HA) (RESID 12 AND NAME HB#) 3.65 1.85 1.85  !     noesy.106  
assign (RESID 12 AND NAME HB#) (RESID 17 AND NAME HA) 3.65 1.85 1.85  !     noesy.216  
assign (RESID 13 AND NAME HA) (RESID 22 AND NAME HG2#) 3.65 1.85 1.85  !     noesy.442  
assign (RESID 30 AND NAME HB) (RESID 15 AND NAME HG2#) 3.65 1.85 1.85  !     noesy.493  
assign (RESID 14 AND NAME HD#) (RESID 22 AND NAME HG2#) 3.65 1.85 1.85  !     noesy.496
assign (RESID 22 AND NAME HG2#) (RESID 15 AND NAME HG2#) 3.65 1.85 1.85  !     noesy.519
assign (RESID 16 AND NAME HA) (RESID 15 AND NAME HA) 3.65 1.85 1.85  !     noesy.520
assign (RESID 16 AND NAME HB1) (RESID 27 AND NAME HB2) 3.65 1.85 1.85  !     noesy.524  
assign (RESID 24 AND NAME HG#) (RESID 21 AND NAME HB2) 3.65 1.85 1.85  !     noesy.529
assign (RESID 15 AND NAME HA) (RESID 14 AND NAME HB#) 3.65 1.85 1.85  !     noesy.479
assign (RESID 22 AND NAME HG2#) (RESID 15 AND NAME HG1#) 3.65 1.85 1.85  !     noesy.516  
assign (RESID 12 AND NAME HA) (RESID 11 AND NAME HA) 3.65 1.85 1.85  !     noesy.556
assign (RESID 27 AND NAME HA) (RESID 30 AND NAME HG2#) 3.65 1.85 1.85  !     noesy.547
assing (RESID 21 AND NAME HA) (RESID 11 AND NAME HG2#) 3.65 1.85 1.85  !     noesy.464


!! Table of 15N NOE peaks. Ambiguities have been resolved by considering structures based only on unambiguous NOEs.
!! 1. Ambigious NOES to sites on the same sidechain have been left in place. 
assign (RESID 10 AND NAME HN) (RESID 10 AND NAME HA) 2.90 1.10 1.10  !     Nnoesy2013.86
assign (RESID 10 AND NAME HN) (RESID 10 AND NAME HB) 2.40 0.60 0.60  !     Nnoesy2013.89
assign (RESID 11 AND NAME HN) (RESID 11 AND NAME HA) 2.40 0.60 0.60  !     Nnoesy2013.62
assign (RESID 11 AND NAME HN) (RESID 11 AND NAME HG2#) 3.65 1.85 1.85  !     Nnoesy2013.68
assign (RESID 11 AND NAME HN) (RESID 11 AND NAME HB) 2.40 0.60 0.60  !     Nnoesy2013.63
assign (RESID 11 AND NAME HN) (RESID 11 AND NAME HG1#) 2.40 0.60 0.60  !     Nnoesy2013.67
assign (RESID 12 AND NAME HN) (RESID 12 AND NAME HA) 2.90 1.10 1.10  !     Nnoesy2013.192
assign (RESID 13 AND NAME HN) (RESID 13 AND NAME HB2) 2.40 0.60 0.60  !     Nnoesy2013.37
assign (RESID 13 AND NAME HN) (RESID 13 AND NAME HB1) 2.40 0.60 0.60  !     Nnoesy2013.36
assign (RESID 13 AND NAME HN) (RESID 13 AND NAME HA) 2.40 0.60 0.60  !     Nnoesy2013.30
assign (RESID 14 AND NAME HN) (RESID 14 AND NAME HB#) 2.40 0.60 0.60  !     Nnoesy2013.14
assign (RESID 14 AND NAME HN) (RESID 14 AND NAME HA) 2.40 0.60 0.60  !     Nnoesy2013.7
assign (RESID 14 AND NAME HN) (RESID 14 AND NAME HD#) 3.65 1.85 1.85  !     Nnoesy2013.9
assign (RESID 15 AND NAME HN) (RESID 15 AND NAME HG1#) 2.90 1.10 1.10  !     Nnoesy2013.108
assign (RESID 15 AND NAME HN) (RESID 15 AND NAME HG1#) 2.90 1.10 1.10  !     Nnoesy2013.106
assign (RESID 15 AND NAME HN) (RESID 15 AND NAME HA) 2.40 0.60 0.60  !     Nnoesy2013.102
assign (RESID 15 AND NAME HN) (RESID 15 AND NAME HG2#) 3.65 1.85 1.85  !     Nnoesy2013.109
assign (RESID 16 AND NAME HN) (RESID 16 AND NAME HA) 2.90 1.10 1.10  !     Nnoesy2013.219
assign (RESID 16 AND NAME HN) (RESID 16 AND NAME HB2) 2.90 1.10 1.10  !     Nnoesy2013.225
assign (RESID 16 AND NAME HN) (RESID 16 AND NAME HB1) 2.40 0.60 0.60  !     Nnoesy2013.226
assign (RESID 17 AND NAME HN) (RESID 17 AND NAME HB2) 2.90 1.10 1.10  !     Nnoesy2013.263
assign (RESID 17 AND NAME HN) (RESID 17 AND NAME HD#) 3.65 1.85 1.85  !     Nnoesy2013.265
assign (RESID 17 AND NAME HN) (RESID 17 AND NAME HG#) 2.40 0.60 0.60  !     Nnoesy2013.266
assign (RESID 17 AND NAME HN) (RESID 17 AND NAME HB1) 2.90 1.10 1.10  !     Nnoesy2013.264
assign (RESID 17 AND NAME HN) (RESID 17 AND NAME HA) 2.40 0.60 0.60  !     Nnoesy2013.257
assign (RESID 18 AND NAME HN) (RESID 18 AND NAME HA#) 2.40 0.60 0.60  !     Nnoesy2013.305
assign (RESID 18 AND NAME HN) (RESID 18 AND NAME HA#) 2.40 0.60 0.60  !     Nnoesy2013.304
assign (RESID 19 AND NAME HN) (RESID 19 AND NAME HB1) 2.40 0.60 0.60  !     Nnoesy2013.186
assign (RESID 19 AND NAME HN) (RESID 19 AND NAME HA) 2.40 0.60 0.60  !     Nnoesy2013.183
assign (RESID 20 AND NAME HN) (RESID 20 AND NAME HA) 2.90 1.10 1.10  !     Nnoesy2013.275
assign (RESID 20 AND NAME HN) (RESID 20 AND NAME HB2) 3.65 1.85 1.85  !     Nnoesy2013.280
assign (RESID 20 AND NAME HN) (RESID 20 AND NAME HB1) 3.65 1.85 1.85  !     Nnoesy2013.279
assign (RESID 20 AND NAME HN) (RESID 20 AND NAME HD2) 3.65 1.85 1.85  !     Nnoesy2013.273
assign (RESID 21 AND NAME HN) (RESID 21 AND NAME HA) 2.90 1.10 1.10  !     Nnoesy2013.240
assign (RESID 21 AND NAME HN) (RESID 21 AND NAME HB1) 2.90 1.10 1.10  !     Nnoesy2013.242
assign (RESID 22 AND NAME HN) (RESID 22 AND NAME HA) 3.65 1.85 1.85  !     Nnoesy2013.132
assign (RESID 23 AND NAME HN) (RESID 23 AND NAME HA) 2.90 1.10 1.10  !     Nnoesy2013.327
assign (RESID 23 AND NAME HN) (RESID 23 AND NAME HG2#) 2.90 1.10 1.10  !     Nnoesy2013.332
assign (RESID 24 AND NAME HN) (RESID 24 AND NAME HA) 2.40 0.60 0.60  !     Nnoesy2013.159
assign (RESID 24 AND NAME HN) (RESID 24 AND NAME HD#) 3.65 1.85 1.85  !     Nnoesy2013.164
assign (RESID 24 AND NAME HN) (RESID 24 AND NAME HB2) 2.90 1.10 1.10  !     Nnoesy2013.166
assign (RESID 25 AND NAME HN) (RESID 25 AND NAME HA) 3.65 1.85 1.85  !     Nnoesy2013.73
assign (RESID 25 AND NAME HN) (RESID 25 AND NAME HB2) 2.90 1.10 1.10  !     Nnoesy2013.74
assign (RESID 25 AND NAME HN) (RESID 25 AND NAME HB1) 2.90 1.10 1.10  !     Nnoesy2013.75
assign (RESID 27 AND NAME HN) (RESID 27 AND NAME HB1) 3.65 1.85 1.85  !     Nnoesy2013.116
assign (RESID 27 AND NAME HN) (RESID 27 AND NAME HB2) 2.90 1.10 1.10  !     Nnoesy2013.118
assign (RESID 27 AND NAME HN) (RESID 27 AND NAME HD1) 3.65 1.85 1.85  !     Nnoesy2013.113
OR     (RESID 27 AND NAME HN) (RESID 27 AND NAME HD2)                 !     Nnoesy2013.113     tyr-hd1
assign (RESID 28 AND NAME HN) (RESID 28 AND NAME HG#) 2.40 0.60 0.60  !     Nnoesy2013.147
assign (RESID 28 AND NAME HN) (RESID 28 AND NAME HB#) 2.40 0.60 0.60  !     Nnoesy2013.146
assign (RESID 28 AND NAME HN) (RESID 28 AND NAME HA) 2.40 0.60 0.60  !     Nnoesy2013.142
assign (RESID 29 AND NAME HN) (RESID 29 AND NAME HA) 2.40 0.60 0.60  !     Nnoesy2013.205
assign (RESID 29 AND NAME HN) (RESID 29 AND NAME HB2) 2.40 0.60 0.60  !     Nnoesy2013.208
assign (RESID 29 AND NAME HN) (RESID 29 AND NAME HB1) 2.40 0.60 0.60  !     Nnoesy2013.209
assign (RESID 30 AND NAME HN) (RESID 30 AND NAME HA) 2.90 1.10 1.10  !     Nnoesy2013.289
assign (RESID 30 AND NAME HN) (RESID 30 AND NAME HG2#) 2.90 1.10 1.10  !     Nnoesy2013.295
assign (RESID 11 AND NAME HN) (RESID 10 AND NAME HA) 2.40 0.60 0.60  !     Nnoesy2013.61
assign (RESID 11 AND NAME HN) (RESID 10 AND NAME HG2#) 2.90 1.10 1.10  !     Nnoesy2013.66
    OR (RESID 11 AND NAME HN) (RESID 10 AND NAME HD1#)                 !     Nnoesy2013.66
assign (RESID 11 AND NAME HN) (RESID 10 AND NAME HG1#) 3.65 1.85 1.85  !     Nnoesy2013.65
assign (RESID 10 AND NAME HN) (RESID 11 AND NAME HA) 3.65 1.85 1.85  !     Nnoesy2013.87
assign (RESID 10 AND NAME HN) (RESID 11 AND NAME HG1#) 3.65 1.85 1.85  !     Nnoesy2013.93
assign (RESID 11 AND NAME HN) (RESID 10 AND NAME HN) 2.90 1.10 1.10  !     Nnoesy2013.58
assign (RESID 12 AND NAME HN) (RESID 11 AND NAME HB) 2.90 1.10 1.10  !     Nnoesy2013.198
assign (RESID 12 AND NAME HN) (RESID 11 AND NAME HG2#) 3.65 1.85 1.85  !     Nnoesy2013.201
assign (RESID 12 AND NAME HN) (RESID 11 AND NAME HG1#) 3.65 1.85 1.85  !     Nnoesy2013.200
assign (RESID 12 AND NAME HN) (RESID 11 AND NAME HN) 3.65 1.85 1.85  !     Nnoesy2013.189
assign (RESID 11 AND NAME HN) (RESID 12 AND NAME HN) 3.65 1.85 1.85  !     Nnoesy2013.59
assign (RESID 12 AND NAME HN) (RESID 11 AND NAME HA) 2.40 0.60 0.60  !     Nnoesy2013.195
assign (RESID 12 AND NAME HN) (RESID 13 AND NAME HN) 3.65 1.85 1.85  !     Nnoesy2013.190
assign (RESID 13 AND NAME HN) (RESID 12 AND NAME HA) 2.40 0.60 0.60  !     Nnoesy2013.29
assign (RESID 13 AND NAME HN) (RESID 12 AND NAME HB#) 2.40 0.60 0.60  !     Nnoesy2013.34
assign (RESID 13 AND NAME HN) (RESID 17 AND NAME HN) 3.65 1.85 1.85  !     Nnoesy2013.26
assign (RESID 13 AND NAME HN) (RESID 12 AND NAME HN) 3.65 1.85 1.85 !     Nnoesy2013.26
assign (RESID 14 AND NAME HN) (RESID 13 AND NAME HA) 2.40 0.60 0.60  !     Nnoesy2013.6
assign (RESID 14 AND NAME HN) (RESID 13 AND NAME HN) 3.65 1.85 1.85  !     Nnoesy2013.3
assign (RESID 14 AND NAME HN) (RESID 13 AND NAME HB1) 3.65 1.85 1.85  !     Nnoesy2013.12
assign (RESID 14 AND NAME HN) (RESID 13 AND NAME HB2) 2.90 1.10 1.10  !     Nnoesy2013.13
assign (RESID 13 AND NAME HN) (RESID 14 AND NAME HA) 3.65 1.85 1.85  !     Nnoesy2013.31
assign (RESID 14 AND NAME HN) (RESID 15 AND NAME HA) 3.65 1.85 1.85  !     Nnoesy2013.8
assign (RESID 15 AND NAME HN) (RESID 14 AND NAME HN) 2.40 0.60 0.60  !     Nnoesy2013.95
assign (RESID 15 AND NAME HN) (RESID 14 AND NAME HA) 2.90 1.10 1.10  !     Nnoesy2013.101
assign (RESID 14 AND NAME HN) (RESID 15 AND NAME HD1#) 3.65 1.85 1.85  !     Nnoesy2013.19
assign (RESID 14 AND NAME HN) (RESID 15 AND NAME HG2#) 3.65 1.85 1.85  !     Nnoesy2013.20
assign (RESID 14 AND NAME HN) (RESID 15 AND NAME HN) 2.40 0.60 0.60  !     Nnoesy2013.1
assign (RESID 14 AND NAME HN) (RESID 15 AND NAME HG1#) 3.65 1.85 1.85  !     Nnoesy2013.16
assign (RESID 16 AND NAME HN) (RESID 15 AND NAME HG2#) 2.90 1.10 1.10  !     Nnoesy2013.233
assign (RESID 16 AND NAME HN) (RESID 15 AND NAME HD1#) 3.65 1.85 1.85  !     Nnoesy2013.232
assign (RESID 15 AND NAME HN) (RESID 16 AND NAME HA) 3.65 1.85 1.85  !     Nnoesy2013.99
assign (RESID 16 AND NAME HN) (RESID 15 AND NAME HN) 2.40 0.60 0.60  !     Nnoesy2013.217
assign (RESID 15 AND NAME HN) (RESID 16 AND NAME HN) 2.40 0.60 0.60  !     Nnoesy2013.96
assign (RESID 16 AND NAME HN) (RESID 15 AND NAME HA) 3.65 1.85 1.85  !     Nnoesy2013.222
assign (RESID 16 AND NAME HN) (RESID 17 AND NAME HN) 2.40 0.60 0.60  !     Nnoesy2013.218
assign (RESID 16 AND NAME HN) (RESID 17 AND NAME HA) 2.90 1.10 1.10  !     Nnoesy2013.220
assign (RESID 17 AND NAME HN) (RESID 16 AND NAME HN) 2.40 0.60 0.60  !     Nnoesy2013.253
assign (RESID 17 AND NAME HN) (RESID 16 AND NAME HA) 2.90 1.10 1.10  !     Nnoesy2013.256
assign (RESID 17 AND NAME HN) (RESID 16 AND NAME HB2) 3.65 1.85 1.85  !     Nnoesy2013.260
assign (RESID 18 AND NAME HN) (RESID 17 AND NAME HN) 2.40 0.60 0.60  !     Nnoesy2013.302
assign (RESID 18 AND NAME HN) (RESID 17 AND NAME HB2) 3.65 1.85 1.85  !     Nnoesy2013.311
assign (RESID 18 AND NAME HN) (RESID 17 AND NAME HA) 2.90 1.10 1.10  !     Nnoesy2013.303
assign (RESID 17 AND NAME HN) (RESID 18 AND NAME HN) 2.90 1.10 1.10  !     Nnoesy2013.254
assign (RESID 18 AND NAME HN) (RESID 17 AND NAME HB1) 3.65 1.85 1.85  !     Nnoesy2013.310
assign (RESID 18 AND NAME HN) (RESID 19 AND NAME HN) 3.65 1.85 1.85  !     Nnoesy2013.301
assign (RESID 19 AND NAME HN) (RESID 18 AND NAME HN) 3.65 1.85 1.85  !     Nnoesy2013.179
assign (RESID 19 AND NAME HN) (RESID 18 AND NAME HA#) 2.40 0.60 0.60  !     Nnoesy2013.184
assign (RESID 19 AND NAME HN) (RESID 18 AND NAME HA#) 2.40 0.60 0.60  !     Nnoesy2013.185
assign (RESID 19 AND NAME HN) (RESID 20 AND NAME HE1) 3.65 1.85 1.85  !     Nnoesy2013.181
assign (RESID 19 AND NAME HN) (RESID 20 AND NAME HN) 3.65 1.85 1.85  !     Nnoesy2013.182
assign (RESID 20 AND NAME HN) (RESID 21 AND NAME HN) 3.65 1.85 1.85  !     Nnoesy2013.271
assign (RESID 20 AND NAME HN) (RESID 19 AND NAME HN) 3.65 1.85 1.85  !     Nnoesy2013.271
assign (RESID 20 AND NAME HN) (RESID 19 AND NAME HA) 2.40 0.60 0.60  !     Nnoesy2013.274
assign (RESID 21 AND NAME HN) (RESID 20 AND NAME HA) 2.40 0.60 0.60  !     Nnoesy2013.241
assign (RESID 21 AND NAME HN) (RESID 20 AND NAME HB1) 2.90 1.10 1.10  !     Nnoesy2013.243
assign (RESID 21 AND NAME HN) (RESID 20 AND NAME HB2) 2.40 0.60 0.60  !     Nnoesy2013.244
assign (RESID 21 AND NAME HN) (RESID 20 AND NAME HN) 2.90 1.10 1.10  !     Nnoesy2013.238
assign (RESID 22 AND NAME HN) (RESID 21 AND NAME HA) 2.90 1.10 1.10  !     Nnoesy2013.133
assign (RESID 21 AND NAME HN) (RESID 22 AND NAME HN) 3.65 1.85 1.85  !     Nnoesy2013.236
assign (RESID 23 AND NAME HN) (RESID 22 AND NAME HN) 3.65 1.85 1.85  !     Nnoesy2013.323
assign (RESID 23 AND NAME HN) (RESID 22 AND NAME HG2#) 3.65 1.85 1.85  !     Nnoesy2013.331
assign (RESID 23 AND NAME HN) (RESID 22 AND NAME HA) 3.65 1.85 1.85  !     Nnoesy2013.324
assign (RESID 22 AND NAME HN) (RESID 23 AND NAME HN) 3.65 1.85 1.85  !     Nnoesy2013.131
assign (RESID 24 AND NAME HN) (RESID 23 AND NAME HA) 2.90 1.10 1.10  !     Nnoesy2013.161
assign (RESID 24 AND NAME HN) (RESID 23 AND NAME HN) 2.90 1.10 1.10  !     Nnoesy2013.154
assign (RESID 23 AND NAME HN) (RESID 24 AND NAME HN) 2.90 1.10 1.10  !     Nnoesy2013.322
assign (RESID 24 AND NAME HN) (RESID 23 AND NAME HG2#) 3.65 1.85 1.85  !     Nnoesy2013.169
assign (RESID 25 AND NAME HN) (RESID 24 AND NAME HA) 3.65 1.85 1.85  !     Nnoesy2013.72
assign (RESID 24 AND NAME HN) (RESID 25 AND NAME HB2) 3.65 1.85 1.85  !     Nnoesy2013.162
assign (RESID 24 AND NAME HN) (RESID 25 AND NAME HN) 2.40 0.60 0.60  !     Nnoesy2013.155
assign (RESID 25 AND NAME HN) (RESID 24 AND NAME HN) 2.40 0.60 0.60  !     Nnoesy2013.70
assign (RESID 25 AND NAME HN) (RESID 24 AND NAME HB1) 3.65 1.85 1.85  !     Nnoesy2013.77
    OR (RESID 25 AND NAME HN) (RESID 24 AND NAME HG#)                 !     Nnoesy2013.77
assign (RESID 27 AND NAME HN) (RESID 26 AND NAME HD#) 2.90 1.10 1.10  !     Nnoesy2013.115
assign (RESID 27 AND NAME HN) (RESID 26 AND NAME HA) 3.65 1.85 1.85  !     Nnoesy2013.114
assign (RESID 27 AND NAME HN) (RESID 26 AND NAME HG#) 3.65 1.85 1.85  !     Nnoesy2013.122
    OR (RESID 27 AND NAME HN) (RESID 26 AND NAME HB#)                 !     Nnoesy2013.122
assign (RESID 28 AND NAME HN) (RESID 27 AND NAME HN) 2.40 0.60 0.60  !     Nnoesy2013.137
assign (RESID 28 AND NAME HN) (RESID 27 AND NAME HB1) 3.65 1.85 1.85  !     Nnoesy2013.144
assign (RESID 27 AND NAME HN) (RESID 28 AND NAME HN) 2.90 1.10 1.10  !     Nnoesy2013.112
assign (RESID 28 AND NAME HN) (RESID 27 AND NAME HA) 2.40 0.60 0.60  !     Nnoesy2013.150
assign (RESID 27 AND NAME HN) (RESID 28 AND NAME HA) 3.65 1.85 1.85  !     Nnoesy2013.117
assign (RESID 28 AND NAME HN) (RESID 27 AND NAME HD1) 3.65 1.85 1.85  !     Nnoesy2013.138
OR     (RESID 28 AND NAME HN) (RESID 27 AND NAME HD2)                 !     Nnoesy2013.138    tyr-hd1
assign (RESID 28 AND NAME HN) (RESID 29 AND NAME HN) 2.40 0.60 0.60  !     Nnoesy2013.136
assign (RESID 29 AND NAME HN) (RESID 28 AND NAME HA) 2.40 0.60 0.60  !     Nnoesy2013.207
assign (RESID 29 AND NAME HN) (RESID 28 AND NAME HN) 2.90 1.10 1.10  !     Nnoesy2013.204
assign (RESID 29 AND NAME HN) (RESID 28 AND NAME HG#) 2.90 1.10 1.10  !     Nnoesy2013.212
assign (RESID 29 AND NAME HN) (RESID 28 AND NAME HD#) 3.65 1.85 1.85  !     Nnoesy2013.211
assign (RESID 29 AND NAME HN) (RESID 28 AND NAME HB#) 2.90 1.10 1.10  !     Nnoesy2013.210
assign (RESID 30 AND NAME HN) (RESID 29 AND NAME HA) 2.40 0.60 0.60  !     Nnoesy2013.288
assign (RESID 30 AND NAME HN) (RESID 29 AND NAME HB2) 3.65 1.85 1.85  !     Nnoesy2013.291
assign (RESID 30 AND NAME HN) (RESID 29 AND NAME HB1) 2.90 1.10 1.10  !     Nnoesy2013.292
assign (RESID 30 AND NAME HN) (RESID 29 AND NAME HN) 2.40 0.60 0.60  !     Nnoesy2013.287
assign (RESID 29 AND NAME HN) (RESID 30 AND NAME HN) 2.40 0.60 0.60  !     Nnoesy2013.203
assign (RESID 29 AND NAME HN) (RESID 30 AND NAME HA) 3.65 1.85 1.85  !     Nnoesy2013.206
assign (RESID 30 AND NAME HN) (RESID 31 AND NAME HN) 2.40 0.60 0.60  !     Nnoesy2013.286
assign (RESID 12 AND NAME HN) (RESID 10 AND NAME HG2#) 3.65 1.85 1.85  !     Nnoesy2013.199
    OR (RESID 12 AND NAME HN) (RESID 10 AND NAME HD1#)                 !     Nnoesy2013.199
assign (RESID 13 AND NAME HN) (RESID 11 AND NAME HA) 3.65 1.85 1.85  !     Nnoesy2013.33
assign (RESID 13 AND NAME HN) (RESID 11 AND NAME HG2#) 3.65 1.85 1.85  !     Nnoesy2013.41
assign (RESID 13 AND NAME HN) (RESID 11 AND NAME HG1#) 3.65 1.85 1.85  !     Nnoesy2013.40
assign (RESID 13 AND NAME HN) (RESID 16 AND NAME HN) 3.65 1.85 1.85  !     Nnoesy2013.24
assign (RESID 15 AND NAME HN) (RESID 13 AND NAME HA) 3.65 1.85 1.85  !     Nnoesy2013.100
assign (RESID 17 AND NAME HN) (RESID 13 AND NAME HB1) 2.40 0.60 0.60  !     Nnoesy2013.261
assign (RESID 16 AND NAME HN) (RESID 13 AND NAME HN) 3.65 1.85 1.85  !     Nnoesy2013.234
assign (RESID 17 AND NAME HN) (RESID 13 AND NAME HN) 2.90 1.10 1.10  !     Nnoesy2013.252
assign (RESID 16 AND NAME HN) (RESID 14 AND NAME HA) 3.65 1.85 1.85  !     Nnoesy2013.221
assign (RESID 14 AND NAME HN) (RESID 17 AND NAME HG#) 3.65 1.85 1.85  !     Nnoesy2013.18
assign (RESID 14 AND NAME HN) (RESID 16 AND NAME HN) 3.65 1.85 1.85  !     Nnoesy2013.2
assign (RESID 14 AND NAME HN) (RESID 17 AND NAME HN) 3.65 1.85 1.85  !     Nnoesy2013.4
assign (RESID 17 AND NAME HN) (RESID 15 AND NAME HG2#) 3.65 1.85 1.85  !     Nnoesy2013.269
assign (RESID 17 AND NAME HN) (RESID 15 AND NAME HD1#) 3.65 1.85 1.85  !     Nnoesy2013.268
assign (RESID 17 AND NAME HN) (RESID 15 AND NAME HA) 3.65 1.85 1.85  !     Nnoesy2013.258
assign (RESID 15 AND NAME HN) (RESID 17 AND NAME HG#) 3.65 1.85 1.85  !     Nnoesy2013.110
assign (RESID 15 AND NAME HN) (RESID 17 AND NAME HN) 3.65 1.85 1.85  !     Nnoesy2013.97
assign (RESID 17 AND NAME HN) (RESID 15 AND NAME HN) 2.90 1.10 1.10  !     Nnoesy2013.255
assign (RESID 18 AND NAME HN) (RESID 16 AND NAME HB2) 3.65 1.85 1.85  !     Nnoesy2013.306
assign (RESID 16 AND NAME HN) (RESID 18 AND NAME HA#) 3.65 1.85 1.85  !     Nnoesy2013.223
assign (RESID 16 AND NAME HN) (RESID 18 AND NAME HN) 3.65 1.85 1.85  !     Nnoesy2013.216
assign (RESID 18 AND NAME HN) (RESID 16 AND NAME HN) 3.65 1.85 1.85  !     Nnoesy2013.299
assign (RESID 20 AND NAME HN) (RESID 17 AND NAME HA) 3.65 1.85 1.85  !     Nnoesy2013.276
assign (RESID 20 AND NAME HN) (RESID 18 AND NAME HA#) 3.65 1.85 1.85  !     Nnoesy2013.277
assign (RESID 24 AND NAME HN) (RESID 21 AND NAME HB1) 2.90 1.10 1.10  !     Nnoesy2013.163
assign (RESID 23 AND NAME HN) (RESID 21 AND NAME HB1) 2.90 1.10 1.10  !     Nnoesy2013.328
assign (RESID 24 AND NAME HN) (RESID 21 AND NAME HN) 3.65 1.85 1.85  !     Nnoesy2013.152
assign (RESID 24 AND NAME HN) (RESID 21 AND NAME HA) 3.65 1.85 1.85  !     Nnoesy2013.158
assign (RESID 24 AND NAME HN) (RESID 21 AND NAME HB2) 2.90 1.10 1.10  !     Nnoesy2013.165
assign (RESID 21 AND NAME HN) (RESID 24 AND NAME HB2) 3.65 1.85 1.85  !     Nnoesy2013.246
assign (RESID 21 AND NAME HN) (RESID 24 AND NAME HN) 3.65 1.85 1.85  !     Nnoesy2013.237
assign (RESID 23 AND NAME HN) (RESID 21 AND NAME HB2) 3.65 1.85 1.85  !     Nnoesy2013.329
assign (RESID 24 AND NAME HN) (RESID 22 AND NAME HN) 3.65 1.85 1.85  !     Nnoesy2013.151
assign (RESID 24 AND NAME HN) (RESID 22 AND NAME HA) 3.65 1.85 1.85  !     Nnoesy2013.157
assign (RESID 25 AND NAME HN) (RESID 22 AND NAME HA) 3.65 1.85 1.85  !     Nnoesy2013.79
assign (RESID 28 AND NAME HN) (RESID 25 AND NAME HB1) 2.90 1.10 1.10  !     Nnoesy2013.145
assign (RESID 30 AND NAME HN) (RESID 28 AND NAME HG#) 3.65 1.85 1.85  !     Nnoesy2013.294
assign (RESID 30 AND NAME HN) (RESID 28 AND NAME HD#) 3.65 1.85 1.85  !     Nnoesy2013.293
assign (RESID 30 AND NAME HN) (RESID 28 AND NAME HA) 3.65 1.85 1.85  !     Nnoesy2013.290
assign (RESID 20 AND NAME HN) (RESID 11 AND NAME HG2#) 3.65 1.85 1.85  !     Nnoesy2013.284
assign (RESID 20 AND NAME HN) (RESID 11 AND NAME HG1#) 3.65 1.85 1.85  !     Nnoesy2013.283
assign (RESID 21 AND NAME HN) (RESID 11 AND NAME HG1#) 3.65 1.85 1.85  !     Nnoesy2013.248
assign (RESID 21 AND NAME HN) (RESID 11 AND NAME HG2#) 3.65 1.85 1.85  !     Nnoesy2013.249
assign (RESID 18 AND NAME HN) (RESID 13 AND NAME HB1) 2.40 0.60 0.60  !     Nnoesy2013.308
assign (RESID 19 AND NAME HN) (RESID 13 AND NAME HN) 3.65 1.85 1.85  !     Nnoesy2013.187
assign (RESID 20 AND NAME HN) (RESID 13 AND NAME HN) 3.65 1.85 1.85  !     Nnoesy2013.272
assign (RESID 13 AND NAME HN) (RESID 18 AND NAME HN) 2.90 1.10 1.10  !     Nnoesy2013.23
assign (RESID 13 AND NAME HN) (RESID 20 AND NAME HN) 2.90 1.10 1.10  !     Nnoesy2013.27
assign (RESID 18 AND NAME HN) (RESID 13 AND NAME HN) 3.65 1.85 1.85  !     Nnoesy2013.300
assign (RESID 13 AND NAME HN) (RESID 20 AND NAME HD2) 3.65 1.85 1.85  !     Nnoesy2013.28
assign (RESID 13 AND NAME HN) (RESID 19 AND NAME HN) 3.65 1.85 1.85  !     Nnoesy2013.43
assign (RESID 14 AND NAME HN) (RESID 25 AND NAME HB1) 3.65 1.85 1.85  !     Nnoesy2013.11
assign (RESID 14 AND NAME HN) (RESID 22 AND NAME HG2#) 2.90 1.10 1.10  !     Nnoesy2013.17
assign (RESID 14 AND NAME HN) (RESID 22 AND NAME HA) 3.65 1.85 1.85  !     Nnoesy2013.5
assign (RESID 15 AND NAME HN) (RESID 22 AND NAME HA) 3.65 1.85 1.85  !     Nnoesy2013.98
assign (RESID 15 AND NAME HN) (RESID 22 AND NAME HG2#) 2.90 1.10 1.10  !     Nnoesy2013.107
assign (RESID 28 AND NAME HN) (RESID 15 AND NAME HD1#) 3.65 1.85 1.85  !     Nnoesy2013.149
assign (RESID 25 AND NAME HN) (RESID 20 AND NAME HD2) 3.65 1.85 1.85  !     Nnoesy2013.71


assign (RESID 25 AND NAME HN) (RESID 15 AND NAME HD1#) 3.65 1.85 1.85  !     Nnoesy2013.78.sep05
assign (RESID 25 AND NAME HN) (RESID 23 AND NAME HN) 3.65 1.85 1.85  !     Nnoesy2013.342.sep05
assign (RESID 27 AND NAME HN) (RESID 15 AND NAME HG2#) 3.65 1.85 1.85  !     Nnoesy2013.123.sep05
assign (RESID 16 AND NAME HN) (RESID 17 AND NAME HG#) 3.65 1.85 1.85  !     Nnoesy2013.231.sep05
assign (RESID 16 AND NAME HN) (RESID 17 AND NAME HD#) 3.65 1.85 1.85  !     Nnoesy2013.229.sep05
assign (RESID 16 AND NAME HN) (RESID 17 AND NAME HB1) 3.65 1.85 1.85  !     Nnoesy2013.228.sep05
assign (RESID 16 AND NAME HN) (RESID 17 AND NAME HB2) 3.65 1.85 1.85  !     Nnoesy2013.227.sep05
assign (RESID 21 AND NAME HN) (RESID 24 AND NAME HG#) 3.65 1.85 1.85  !     Nnoesy2013.247.sep05
assign (RESID 17 AND NAME HN) (RESID 18 AND NAME HA#) 3.65 1.85 1.85  !     Nnoesy2013.259.sep05
assign (RESID 20 AND NAME HN) (RESID 13 AND NAME HB1) 3.65 1.85 1.85  !     Nnoesy2013.281.sep05
assign (RESID 20 AND NAME HN) (RESID 13 AND NAME HB2) 3.65 1.85 1.85  !     Nnoesy2013.281.sep05


!! Table of 13C arom NOE peaks. Ambiguities have been resolved by considering structures based only on unambiguous NOEs
assign (RESID 20 AND NAME HB1) (RESID 20 AND NAME HD2) 3.65 1.85 1.85  !     aromnoesy.113
assign (RESID 20 AND NAME HB2) (RESID 20 AND NAME HD2) 3.65 1.85 1.85  !     aromnoesy.65
assign (RESID 21 AND NAME HB1) (RESID 21 AND NAME HE3) 3.65 1.85 1.85  !     aromnoesy.71
assign (RESID 21 AND NAME HB2) (RESID 21 AND NAME HE3) 3.65 1.85 1.85  !     aromnoesy.112
assign (RESID 21 AND NAME HB2) (RESID 21 AND NAME HD1) 3.65 1.85 1.85  !     aromnoesy.111
assign (RESID 21 AND NAME HB1) (RESID 21 AND NAME HD1) 3.65 1.85 1.85  !     aromnoesy.70
assign (RESID 21 AND NAME HA)  (RESID 21 AND NAME HD1) 2.90 1.10 1.10  !     aromnoesy.68
assign (RESID 21 AND NAME HA)  (RESID 21 AND NAME HE3) 2.90 1.10 1.10  !     aromnoesy.69
assign (RESID 27 AND NAME HA)  (RESID 27 AND NAME HD1) 2.90 1.10 1.10  !     aromnoesy.127
OR     (RESID 27 AND NAME HA)  (RESID 27 AND NAME HD2)
assign (RESID 27 AND NAME HA)  (RESID 27 AND NAME HE1) 3.65 1.85 1.85  !     aromnoesy.66
OR     (RESID 27 AND NAME HA)  (RESID 27 AND NAME HE2)
assign (RESID 27 AND NAME HB1) (RESID 27 AND NAME HD1) 2.90 1.10 1.10  !     aromnoesy.73
OR     (RESID 27 AND NAME HB1) (RESID 27 AND NAME HD2)
assign (RESID 27 AND NAME HB2) (RESID 27 AND NAME HD1) 2.90 1.10 1.10  !     aromnoesy.93
OR     (RESID 27 AND NAME HB2) (RESID 27 AND NAME HD2)
assign (RESID 27 AND NAME HB1) (RESID 27 AND NAME HE1) 3.65 1.85 1.85  !     aromnoesy.72
OR     (RESID 27 AND NAME HB1) (RESID 27 AND NAME HE2)
assign (RESID 27 AND NAME HB2) (RESID 27 AND NAME HE1) 3.65 1.85 1.85  !     aromnoesy.94
OR     (RESID 27 AND NAME HB2) (RESID 27 AND NAME HE2)

assign (RESID 26 AND NAME HG#) (RESID 27 AND NAME HE1) 3.65 1.85 1.85  !     aromnoesy.134
OR     (RESID 26 AND NAME HG#) (RESID 27 AND NAME HE2)
assign (RESID 26 AND NAME HG#) (RESID 27 AND NAME HE1) 3.65 1.85 1.85  !     aromnoesy.140
OR     (RESID 26 AND NAME HG#) (RESID 27 AND NAME HE2)
assign (RESID 26 AND NAME HD#) (RESID 27 AND NAME HD1) 3.65 1.85 1.85  !     aromnoesy.86
OR     (RESID 26 AND NAME HD#) (RESID 27 AND NAME HD2)
assign (RESID 26 AND NAME HB#) (RESID 27 AND NAME HD1) 3.65 1.85 1.85  !     aromnoesy.142
OR     (RESID 26 AND NAME HB#) (RESID 27 AND NAME HD2)
assign (RESID 26 AND NAME HB#) (RESID 27 AND NAME HE1) 3.65 1.85 1.85  !     aromnoesy.143
OR     (RESID 26 AND NAME HB#) (RESID 27 AND NAME HE2)
assign (RESID 26 AND NAME HD#) (RESID 27 AND NAME HD1) 3.65 1.85 1.85  !     aromnoesy.87
OR     (RESID 26 AND NAME HD#) (RESID 27 AND NAME HD2)

assign (RESID 18 AND NAME HA#) (RESID 20 AND NAME HE1) 3.65 1.85 1.85  !     aromnoesy.90
assign (RESID 18 AND NAME HA#) (RESID 20 AND NAME HE1) 2.90 1.10 1.10  !     aromnoesy.91
assign (RESID 13 AND NAME HB2) (RESID 20 AND NAME HD2) 2.90 1.10 1.10  !     aromnoesy.116
assign (RESID 13 AND NAME HB1) (RESID 20 AND NAME HD2) 2.90 1.10 1.10  !     aromnoesy.115
assign (RESID 15 AND NAME HG2#) (RESID 27 AND NAME HD1) 3.65 1.85 1.85  !     aromnoesy.12
OR     (RESID 15 AND NAME HG2#) (RESID 27 AND NAME HD2)
assign (RESID 16 AND NAME HB2) (RESID 27 AND NAME HE1) 3.65 1.85 1.85  !     aromnoesy.101
OR     (RESID 16 AND NAME HB2) (RESID 27 AND NAME HE1)
assign (RESID 16 AND NAME HB2) (RESID 27 AND NAME HD1) 2.90 1.10 1.10  !     aromnoesy.100
OR     (RESID 16 AND NAME HB2) (RESID 27 AND NAME HD2) 
assign (RESID 16 AND NAME HB1) (RESID 27 AND NAME HD1) 2.90 1.10 1.10  !     aromnoesy.103
OR     (RESID 16 AND NAME HB1) (RESID 27 AND NAME HD2) 
assign (RESID 16 AND NAME HB1) (RESID 27 AND NAME HE1) 3.65 1.85 1.85  !     aromnoesy.102
OR     (RESID 16 AND NAME HB1) (RESID 27 AND NAME HE2)
assign (RESID 25 AND NAME HA)  (RESID 20 AND NAME HD2) 2.90 1.10 1.10  !     aromnoesy.141
assign (RESID 26 AND NAME HD#) (RESID 20 AND NAME HD2) 3.65 1.85 1.85  !     aromnoesy.85
assign (RESID 26 AND NAME HD#) (RESID 20 AND NAME HE1) 3.65 1.85 1.85  !     aromnoesy.89
assign (RESID 26 AND NAME HD#) (RESID 20 AND NAME HE1) 2.90 1.10 1.10  !     aromnoesy.88
assign (RESID 25 AND NAME HB1) (RESID 20 AND NAME HD2) 3.65 1.85 1.85  !     aromnoesy.105
assign (RESID 25 AND NAME HB2) (RESID 20 AND NAME HD2) 3.65 1.85 1.85  !     aromnoesy.104
assign (RESID 20 AND NAME HA)  (RESID 21 AND NAME HD1) 3.65 1.85 1.85  !     aromnoesy.118
assign (RESID 13 AND NAME HB2) (RESID 20 AND NAME HE1) 3.65 1.85 1.85  !     aromnoesy.163
assign (RESID 26 AND NAME HG#) (RESID 27 AND NAME HD1) 3.65 1.85 1.85  !     aromnoesy.139
OR     (RESID 26 AND NAME HG#) (RESID 27 AND NAME HD2)
assign (RESID 25 AND NAME HA)  (RESID 20 AND NAME HE1) 3.65 1.85 1.85  !     aromnoesy.108
assign (RESID 20 AND NAME HA)  (RESID 20 AND NAME HD2) 3.65 1.85 1.85  !     aromnoesy.106

! primary Zn-SG/NE2 data from page 30 of
! http://www.ncbi.nlm.nih.gov/pmc/articles/PMC2941202/#!po=34.6154
! values are mean plus/minus 2 SD
!! Zn -SG/NE2 restraints
assign  (resid 300 and resname ZN2)  (resid 13  and name   SG)  2.33  0.22  0.22
assign  (resid 300 and resname ZN2)  (resid 16  and name   SG)  2.33  0.22  0.22
assign  (resid 300 and resname ZN2)  (resid 25  and name   SG)  2.33  0.22  0.22
assign  (resid 300 and resname ZN2)  (resid 20 and name NE2)    2.13  0.23  0.23
    
! these restraints stolen from JBNMR Santiveri et al, 2013    
!! Zn - CB restraints
assign  (resid 300 and resname ZN2)  (resid 13  and name   CB)  3.55  0.25  0.25
assign  (resid 300 and resname ZN2)  (resid 16  and name   CB)  3.55  0.25  0.25
assign  (resid 300 and resname ZN2)  (resid 25  and name   CB)  3.55  0.25  0.25

!! SG-SG restraints
assign  (resid 16  and name   SG)   (resid 25  and name   SG)  3.90  0.30  0.30
assign  (resid 13  and name   SG)   (resid 16  and name   SG)  3.90  0.30  0.30
assign  (resid 13  and name   SG)   (resid 25  and name   SG)  3.90  0.30  0.30

!! SG-NE2 restraints
assign  (resid 16  and name   SG)   (resid 20  and name  NE2)  3.85  0.35  0.35
assign  (resid 13  and name   SG)   (resid 20  and name  NE2)  3.85  0.35  0.35
assign  (resid 25  and name   SG)   (resid 20  and name  NE2)  3.85  0.35  0.35

! chi 1 180
assign (resid   13 and name N    ) (resid   13 and name CA    )
       (resid   13 and name CB   ) (resid   13 and name SG    )    1.0 180.0   50.0 2
assign (resid   25 and name N    ) (resid   25 and name CA    )
       (resid   25 and name CB   ) (resid   25 and name SG    )    1.0 180.0   50.0 2

! chi 1  plus 60
assign (resid   16 and name N    ) (resid   16 and name CA    )
       (resid   16 and name CB   ) (resid   16 and name SG    )    1.0 60.0   50.0 2
assign (resid   20 and name N    ) (resid   20 and name CA    )
       (resid   20 and name CB   ) (resid   20 and name CG    )    1.0 60.0   50.0 2
assign (resid   24 and name N    ) (resid   24 and name CA    )
       (resid   24 and name CB   ) (resid   24 and name CG    )    1.0 60.0   50.0 2
assign (resid   29 and name N    ) (resid   29 and name CA    )
       (resid   29 and name CB   ) (resid   29 and name CG    )    1.0 60.0   50.0 2

! chi 1  minus 60
assign (resid   17 and name N    ) (resid   17 and name CA    )
       (resid   17 and name CB   ) (resid   17 and name CG    )    1.0 -60.0   50.0 2
assign (resid   21 and name N    ) (resid   21 and name CA    )
       (resid   21 and name CB   ) (resid   21 and name CG    )    1.0 -60.0   50.0 2
assign (resid   27 and name N    ) (resid   27 and name CA    )
       (resid   27 and name CB   ) (resid   27 and name CG    )    1.0 -60.0   50.0 2
       
! chi 1 cannot be 180, must be either +60 or -60, because there is a peak in the HNHB

assign (resid   14 and name N    ) (resid   14 and name CA    )
       (resid   14 and name CB   ) (resid   14 and name CG    )    1.0  0.0 150.0 2
assign (resid   19 and name N    ) (resid   19 and name CA    )
       (resid   19 and name CB   ) (resid   19 and name CG    )    1.0  0.0 150.0 2
assign (resid   28 and name N    ) (resid   28 and name CA    )
       (resid   28 and name CB   ) (resid   28 and name CG    )    1.0  0.0 150.0 2


! positive phi based on hn-ha noesy and jhnha
assign (resid   16 and name C ) (resid   17 and name N )        
       (resid   17 and name CA) (resid   17 and name C )  1.0  60.0  30.0 2   ! jhnha of 7.5 Hz, strong HNHA NOE

! backbone dihedrals more than 9.2 Hz
assign (resid   14 and name C ) (resid   15 and name N )        
       (resid   15 and name CA) (resid   15 and name C )  1.0 -120.0 30.0 2  ! jhnha of 9.5 Hz
assign (resid   15 and name C ) (resid   16 and name N )        
       (resid   16 and name CA) (resid   16 and name C )  1.0 -120.0 30.0 2  ! jhnha of 10.6 Hz
assign (resid   23 and name C ) (resid   24 and name N )        
       (resid   24 and name CA) (resid   24 and name C )  1.0 -120.0 30.0 2  ! jhnha of 9.7 Hz
assign (resid   26 and name C ) (resid   27 and name N )        
       (resid   27 and name CA) (resid   27 and name C )  1.0 -120.0 30.0 2  ! jhnha of 10.0 Hz
       
! backbone dihedrals between 8.6-9.2 Hz
assign (resid   10 and name C ) (resid   11 and name N )        
       (resid   11 and name CA) (resid   11 and name C )  1.0 -120.0 40.0 2  ! jhnha of 9.1 Hz
assign (resid   11 and name C ) (resid   12 and name N )        
       (resid   12 and name CA) (resid   12 and name C )  1.0 -120.0 40.0 2  ! jhnha of 8.6 Hz
assign (resid   29 and name C ) (resid   30 and name N )        
       (resid   30 and name CA) (resid   30 and name C )  1.0 -120.0 40.0 2  ! jhnha of 8.8 Hz

! backbone dihedrals less than 4.6 Hz
assign (resid   12 and name C ) (resid   13 and name N )        
       (resid   13 and name CA) (resid   13 and name C )  1.0 -65.0 25.0 2  ! jhnha of 4.6 Hz
assign (resid   27 and name C ) (resid   28 and name N )        
       (resid   28 and name CA) (resid   28 and name C )  1.0 -60.0 25.0 2  ! jhnha of 4.1 Hz
  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   LYS   9           HT1      LYS   9 -10.802  -2.828   3.639
    2    H2   LYS   9           HT2      LYS   9 -10.557  -4.504   3.514
    3    H3   LYS   9           HT3      LYS   9 -10.981  -3.814   5.007
    4    HA   LYS   9           HA       LYS   9 -12.930  -4.821   4.163
    5    HB2  LYS   9           HB2      LYS   9 -12.982  -1.843   3.584
    6    HB3  LYS   9           HB1      LYS   9 -14.394  -2.853   3.887
    7    HG2  LYS   9           HG2      LYS   9 -12.151  -2.737   5.905
    8    HG3  LYS   9           HG1      LYS   9 -13.374  -1.470   5.867
    9    HD2  LYS   9           HD2      LYS   9 -15.143  -3.243   6.054
   10    HD3  LYS   9           HD1      LYS   9 -13.862  -4.438   6.260
   11    HE2  LYS   9           HE2      LYS   9 -14.127  -1.996   8.026
   12    HE3  LYS   9           HE1      LYS   9 -14.867  -3.550   8.417
   13    HZ1  LYS   9           HZ1      LYS   9 -12.028  -2.817   8.307
   14    HZ2  LYS   9           HZ2      LYS   9 -12.472  -4.418   7.950
   15    HZ3  LYS   9           HZ3      LYS   9 -12.859  -3.742   9.461
   16    H    ILE  10           HN       ILE  10 -12.562  -2.162   1.849
   17    HA   ILE  10           HA       ILE  10 -12.526  -4.040  -0.403
   18    HB   ILE  10           HB       ILE  10 -14.919  -3.439   0.239
   19   HG12  ILE  10          HG12      ILE  10 -13.952  -2.623  -2.520
   20   HG13  ILE  10          HG11      ILE  10 -14.231  -4.285  -1.999
   21   HG21  ILE  10          HG21      ILE  10 -15.748  -1.271  -0.136
   22   HG22  ILE  10          HG22      ILE  10 -14.344  -0.793  -1.088
   23   HG23  ILE  10          HG23      ILE  10 -14.203  -0.973   0.661
   24   HD11  ILE  10          HD11      ILE  10 -16.608  -3.634  -1.465
   25   HD12  ILE  10          HD12      ILE  10 -16.206  -3.545  -3.179
   26   HD13  ILE  10          HD13      ILE  10 -16.288  -2.071  -2.216
   27    H    VAL  11           HN       VAL  11 -10.954  -3.418  -1.698
   28    HA   VAL  11           HA       VAL  11  -9.817  -0.762  -1.544
   29    HB   VAL  11           HB       VAL  11  -8.340  -2.672  -1.835
   30   HG11  VAL  11          HG11      VAL  11  -9.629  -3.061  -4.547
   31   HG12  VAL  11          HG12      VAL  11 -10.051  -4.028  -3.135
   32   HG13  VAL  11          HG13      VAL  11  -8.413  -4.082  -3.783
   33   HG21  VAL  11          HG21      VAL  11  -6.983  -1.772  -3.580
   34   HG22  VAL  11          HG22      VAL  11  -7.873  -0.400  -2.919
   35   HG23  VAL  11          HG23      VAL  11  -8.385  -1.134  -4.438
   36    H    SER  12           HN       SER  12 -10.148   0.886  -2.797
   37    HA   SER  12           HA       SER  12 -11.238   0.590  -5.476
   38    HB2  SER  12           HB2      SER  12 -12.721   2.293  -3.476
   39    HB3  SER  12           HB1      SER  12 -13.159   1.958  -5.149
   40    HG   SER  12           HG       SER  12 -12.828  -0.366  -3.968
   41    H    CYS  13           HN       CYS  13 -10.136   1.868  -6.679
   42    HA   CYS  13           HA       CYS  13  -8.354   3.856  -5.729
   43    HB2  CYS  13           HB2      CYS  13  -8.204   2.516  -7.895
   44    HB3  CYS  13           HB1      CYS  13  -9.390   3.638  -8.551
   45    H    ARG  14           HN       ARG  14  -8.406   6.159  -6.553
   46    HA   ARG  14           HA       ARG  14 -11.164   7.268  -6.410
   47    HB2  ARG  14           HB2      ARG  14  -8.603   8.378  -5.236
   48    HB3  ARG  14           HB1      ARG  14 -10.153   9.219  -5.255
   49    HG2  ARG  14           HG2      ARG  14 -11.170   7.369  -3.968
   50    HG3  ARG  14           HG1      ARG  14  -9.609   6.547  -3.929
   51    HD2  ARG  14           HD2      ARG  14  -8.621   8.420  -2.704
   52    HD3  ARG  14           HD1      ARG  14 -10.137   9.310  -2.801
   53    HE   ARG  14           HE       ARG  14 -10.492   6.749  -1.564
   54   HH11  ARG  14          HH21      ARG  14  -9.363   9.987  -1.094
   55   HH12  ARG  14          HH22      ARG  14  -9.660   9.989   0.612
   56   HH21  ARG  14          HH11      ARG  14 -10.884   6.746   0.673
   57   HH22  ARG  14          HH12      ARG  14 -10.521   8.155   1.613
   58    H    ILE  15           HN       ILE  15  -9.208   6.593  -8.680
   59    HA   ILE  15           HA       ILE  15  -9.368   9.233 -10.030
   60    HB   ILE  15           HB       ILE  15  -7.121   7.219 -10.298
   61   HG12  ILE  15          HG12      ILE  15  -6.967  10.011  -9.140
   62   HG13  ILE  15          HG11      ILE  15  -7.252   8.596  -8.128
   63   HG21  ILE  15          HG21      ILE  15  -7.420   8.364 -12.376
   64   HG22  ILE  15          HG22      ILE  15  -6.091   9.187 -11.559
   65   HG23  ILE  15          HG23      ILE  15  -7.702   9.905 -11.565
   66   HD11  ILE  15          HD11      ILE  15  -5.174   7.565  -9.036
   67   HD12  ILE  15          HD12      ILE  15  -4.860   9.076  -8.182
   68   HD13  ILE  15          HD13      ILE  15  -4.869   9.046  -9.945
   69    H    CYS  16           HN       CYS  16  -9.264   5.718 -10.308
   70    HA   CYS  16           HA       CYS  16 -10.792   5.894 -12.837
   71    HB2  CYS  16           HB2      CYS  16  -9.514   4.006 -13.704
   72    HB3  CYS  16           HB1      CYS  16  -8.423   5.326 -13.281
   73    H    LYS  17           HN       LYS  17 -10.413   4.583  -9.699
   74    HA   LYS  17           HA       LYS  17 -11.669   3.127  -8.462
   75    HB2  LYS  17           HB2      LYS  17 -13.703   3.255 -10.687
   76    HB3  LYS  17           HB1      LYS  17 -13.976   2.940  -8.977
   77    HG2  LYS  17           HG2      LYS  17 -13.267   5.220  -8.413
   78    HG3  LYS  17           HG1      LYS  17 -12.936   5.550 -10.114
   79    HD2  LYS  17           HD2      LYS  17 -15.232   5.398 -10.703
   80    HD3  LYS  17           HD1      LYS  17 -15.658   4.656  -9.161
   81    HE2  LYS  17           HE2      LYS  17 -16.259   7.104  -9.338
   82    HE3  LYS  17           HE1      LYS  17 -15.220   6.708  -7.969
   83    HZ1  LYS  17           HZ1      LYS  17 -13.331   7.502  -9.116
   84    HZ2  LYS  17           HZ2      LYS  17 -14.530   8.691  -9.300
   85    HZ3  LYS  17           HZ3      LYS  17 -14.173   7.635 -10.582
   86    H    GLY  18           HN       GLY  18  -9.703   1.898  -9.808
   87    HA2  GLY  18           HA2      GLY  18 -10.835  -0.415 -11.237
   88    HA3  GLY  18           HA1      GLY  18  -9.131   0.017 -11.136
   89    H    ASP  19           HN       ASP  19  -8.053  -1.515 -10.081
   90    HA   ASP  19           HA       ASP  19  -9.202  -2.626  -7.577
   91    HB2  ASP  19           HB2      ASP  19  -8.178  -4.756  -8.110
   92    HB3  ASP  19           HB1      ASP  19  -9.206  -4.264  -9.453
   93    H    HIS  20           HN       HIS  20  -7.883  -0.552  -6.962
   94    HA   HIS  20           HA       HIS  20  -5.637  -1.350  -5.503
   95    HB2  HIS  20           HB2      HIS  20  -3.931   0.064  -6.845
   96    HB3  HIS  20           HB1      HIS  20  -4.311  -1.548  -7.441
   97    HD2  HIS  20           HD2      HIS  20  -5.673   2.129  -8.216
   98    HE1  HIS  20           HE1      HIS  20  -5.842  -0.203 -11.730
   99    H    TRP  21           HN       TRP  21  -5.060   0.220  -4.057
  100    HA   TRP  21           HA       TRP  21  -6.788   2.296  -3.464
  101    HB2  TRP  21           HB2      TRP  21  -3.868   1.903  -2.796
  102    HB3  TRP  21           HB1      TRP  21  -4.801   3.260  -2.166
  103    HD1  TRP  21           HD1      TRP  21  -4.398  -0.502  -1.880
  104    HE1  TRP  21           HE1      TRP  21  -5.767  -1.349   0.132
  105    HE3  TRP  21           HE3      TRP  21  -6.948   3.759  -0.693
  106    HZ2  TRP  21           HZ2      TRP  21  -7.690  -0.352   2.000
  107    HZ3  TRP  21           HZ3      TRP  21  -8.540   3.783   1.206
  108    HH2  TRP  21           HH2      TRP  21  -8.915   1.736   2.553
  109    H    THR  22           HN       THR  22  -5.716   4.678  -3.219
  110    HA   THR  22           HA       THR  22  -5.576   5.653  -5.938
  111    HB   THR  22           HB       THR  22  -5.271   7.228  -3.375
  112    HG1  THR  22           HG1      THR  22  -7.304   5.796  -4.105
  113   HG21  THR  22          HG21      THR  22  -6.242   9.029  -4.838
  114   HG22  THR  22          HG22      THR  22  -6.079   7.930  -6.208
  115   HG23  THR  22          HG23      THR  22  -4.644   8.482  -5.344
  116    H    THR  23           HN       THR  23  -3.332   4.827  -3.459
  117    HA   THR  23           HA       THR  23  -1.189   6.518  -4.384
  118    HB   THR  23           HB       THR  23   0.189   5.272  -2.797
  119    HG1  THR  23           HG1      THR  23  -1.202   3.644  -1.572
  120   HG21  THR  23          HG21      THR  23  -1.322   7.040  -1.947
  121   HG22  THR  23          HG22      THR  23  -1.090   5.756  -0.759
  122   HG23  THR  23          HG23      THR  23  -2.580   5.829  -1.699
  123    H    ARG  24           HN       ARG  24  -1.958   3.051  -4.627
  124    HA   ARG  24           HA       ARG  24   0.257   2.624  -6.491
  125    HB2  ARG  24           HB2      ARG  24  -0.844   0.219  -6.419
  126    HB3  ARG  24           HB1      ARG  24   0.098   0.805  -5.047
  127    HG2  ARG  24           HG2      ARG  24  -1.816   1.302  -3.771
  128    HG3  ARG  24           HG1      ARG  24  -2.875   1.302  -5.180
  129    HD2  ARG  24           HD2      ARG  24  -3.232  -0.744  -3.897
  130    HD3  ARG  24           HD1      ARG  24  -2.480  -1.142  -5.438
  131    HE   ARG  24           HE       ARG  24  -0.508  -0.744  -3.411
  132   HH11  ARG  24          HH21      ARG  24  -2.908  -2.937  -4.594
  133   HH12  ARG  24          HH22      ARG  24  -2.113  -4.352  -3.988
  134   HH21  ARG  24          HH11      ARG  24   0.541  -2.593  -2.612
  135   HH22  ARG  24          HH12      ARG  24  -0.159  -4.157  -2.865
  136    H    CYS  25           HN       CYS  25  -1.948   4.371  -7.290
  137    HA   CYS  25           HA       CYS  25  -3.540   2.868  -9.183
  138    HB2  CYS  25           HB2      CYS  25  -4.608   4.748  -8.170
  139    HB3  CYS  25           HB1      CYS  25  -3.270   5.815  -8.589
  140    HA   PRO  26           HA       PRO  26  -0.444   3.312 -12.403
  141    HB2  PRO  26           HB2      PRO  26  -1.895   2.527 -14.570
  142    HB3  PRO  26           HB1      PRO  26  -1.361   1.382 -13.321
  143    HG2  PRO  26           HG2      PRO  26  -4.032   2.682 -13.670
  144    HG3  PRO  26           HG1      PRO  26  -3.647   0.994 -13.280
  145    HD2  PRO  26           HD2      PRO  26  -4.385   2.814 -11.371
  146    HD3  PRO  26           HD1      PRO  26  -3.292   1.453 -11.028
  147    H    TYR  27           HN       TYR  27  -2.639   5.484 -11.693
  148    HA   TYR  27           HA       TYR  27  -1.881   7.292 -13.867
  149    HB2  TYR  27           HB2      TYR  27  -4.781   6.821 -13.127
  150    HB3  TYR  27           HB1      TYR  27  -4.178   7.993 -14.299
  151    HD1  TYR  27           HD2      TYR  27  -2.477   6.911 -16.099
  152    HD2  TYR  27           HD1      TYR  27  -5.568   4.791 -13.993
  153    HE1  TYR  27           HE2      TYR  27  -2.497   5.177 -17.871
  154    HE2  TYR  27           HE1      TYR  27  -5.586   3.059 -15.768
  155    HH   TYR  27           HH       TYR  27  -4.101   3.487 -18.770
  156    H    LYS  28           HN       LYS  28  -0.888   7.403 -11.361
  157    HA   LYS  28           HA       LYS  28  -2.476   9.168  -9.692
  158    HB2  LYS  28           HB2      LYS  28  -0.179   9.251  -8.412
  159    HB3  LYS  28           HB1      LYS  28  -1.150   7.782  -8.369
  160    HG2  LYS  28           HG2      LYS  28   1.271   7.358  -8.850
  161    HG3  LYS  28           HG1      LYS  28   0.197   6.769 -10.115
  162    HD2  LYS  28           HD2      LYS  28   0.723   8.594 -11.555
  163    HD3  LYS  28           HD1      LYS  28   1.482   9.502 -10.246
  164    HE2  LYS  28           HE2      LYS  28   2.530   6.821 -11.162
  165    HE3  LYS  28           HE1      LYS  28   3.072   8.339 -11.880
  166    HZ1  LYS  28           HZ1      LYS  28   4.558   8.281 -10.221
  167    HZ2  LYS  28           HZ2      LYS  28   3.634   7.221  -9.268
  168    HZ3  LYS  28           HZ3      LYS  28   3.286   8.883  -9.275
  169    H    ASP  29           HN       ASP  29  -1.450   9.867 -12.486
  170    HA   ASP  29           HA       ASP  29   0.472  11.875 -12.321
  171    HB2  ASP  29           HB2      ASP  29  -0.052  12.257 -14.546
  172    HB3  ASP  29           HB1      ASP  29  -0.631  10.622 -14.331
  173    H    THR  30           HN       THR  30  -2.372  11.803 -10.786
  174    HA   THR  30           HA       THR  30  -3.264  14.523 -11.181
  175    HB   THR  30           HB       THR  30  -4.819  14.002  -9.309
  176    HG1  THR  30           HG1      THR  30  -2.995  12.081  -8.914
  177   HG21  THR  30          HG21      THR  30  -5.346  13.418 -11.678
  178   HG22  THR  30          HG22      THR  30  -6.102  12.322 -10.520
  179   HG23  THR  30          HG23      THR  30  -4.661  11.817 -11.402
  180    H    LEU  31           HN       LEU  31  -0.474  13.873 -10.166
  181    HA   LEU  31           HA       LEU  31  -0.394  14.826  -7.454
  182    HB2  LEU  31           HB2      LEU  31   1.708  14.331  -9.561
  183    HB3  LEU  31           HB1      LEU  31   2.112  15.019  -7.990
  184    HG   LEU  31           HG       LEU  31   0.477  12.483  -8.123
  185   HD11  LEU  31          HD11      LEU  31   2.665  11.226  -7.954
  186   HD12  LEU  31          HD12      LEU  31   3.480  12.713  -8.439
  187   HD13  LEU  31          HD13      LEU  31   2.344  11.931  -9.538
  188   HD21  LEU  31          HD21      LEU  31   0.745  13.516  -5.930
  189   HD22  LEU  31          HD22      LEU  31   2.488  13.641  -6.159
  190   HD23  LEU  31          HD23      LEU  31   1.733  12.060  -5.984
  191    H    GLY  32           HN       GLY  32   0.560  16.213 -10.599
  192    HA2  GLY  32           HA2      GLY  32   0.497  18.407 -11.331
  193    HA3  GLY  32           HA1      GLY  32  -0.332  18.836  -9.838
  Start of MODEL    2
    1    H1   LYS   9           HT1      LYS   9 -11.951  -6.246   4.200
    2    H2   LYS   9           HT2      LYS   9 -13.431  -6.060   3.387
    3    H3   LYS   9           HT3      LYS   9 -12.472  -4.701   3.734
    4    HA   LYS   9           HA       LYS   9 -10.779  -5.415   2.224
    5    HB2  LYS   9           HB2      LYS   9 -11.467  -7.493   0.782
    6    HB3  LYS   9           HB1      LYS   9 -10.764  -7.757   2.377
    7    HG2  LYS   9           HG2      LYS   9 -12.887  -8.186   3.363
    8    HG3  LYS   9           HG1      LYS   9 -13.750  -7.553   1.960
    9    HD2  LYS   9           HD2      LYS   9 -12.830  -9.411   0.587
   10    HD3  LYS   9           HD1      LYS   9 -12.053 -10.065   2.029
   11    HE2  LYS   9           HE2      LYS   9 -14.158 -10.493   3.083
   12    HE3  LYS   9           HE1      LYS   9 -15.029  -9.549   1.875
   13    HZ1  LYS   9           HZ1      LYS   9 -13.419 -11.853   1.022
   14    HZ2  LYS   9           HZ2      LYS   9 -14.795 -11.172   0.295
   15    HZ3  LYS   9           HZ3      LYS   9 -14.952 -12.119   1.697
   16    H    ILE  10           HN       ILE  10 -11.546  -3.469   1.360
   17    HA   ILE  10           HA       ILE  10 -13.346  -3.776  -0.942
   18    HB   ILE  10           HB       ILE  10 -13.740  -1.523   1.031
   19   HG12  ILE  10          HG12      ILE  10 -15.209  -4.169   0.798
   20   HG13  ILE  10          HG11      ILE  10 -14.308  -3.583   2.196
   21   HG21  ILE  10          HG21      ILE  10 -15.716  -1.079  -0.235
   22   HG22  ILE  10          HG22      ILE  10 -15.604  -2.622  -1.082
   23   HG23  ILE  10          HG23      ILE  10 -14.439  -1.343  -1.422
   24   HD11  ILE  10          HD11      ILE  10 -16.900  -2.511   1.074
   25   HD12  ILE  10          HD12      ILE  10 -15.909  -1.582   2.199
   26   HD13  ILE  10          HD13      ILE  10 -16.590  -3.131   2.696
   27    H    VAL  11           HN       VAL  11 -11.168  -3.589  -1.914
   28    HA   VAL  11           HA       VAL  11  -9.802  -1.042  -1.734
   29    HB   VAL  11           HB       VAL  11  -8.507  -3.070  -2.108
   30   HG11  VAL  11          HG11      VAL  11  -8.757  -4.421  -4.074
   31   HG12  VAL  11          HG12      VAL  11  -9.866  -3.263  -4.806
   32   HG13  VAL  11          HG13      VAL  11 -10.378  -4.213  -3.411
   33   HG21  VAL  11          HG21      VAL  11  -7.118  -2.241  -3.866
   34   HG22  VAL  11          HG22      VAL  11  -7.863  -0.818  -3.138
   35   HG23  VAL  11          HG23      VAL  11  -8.480  -1.453  -4.664
   36    H    SER  12           HN       SER  12 -10.037   0.658  -2.934
   37    HA   SER  12           HA       SER  12 -11.135   0.539  -5.606
   38    HB2  SER  12           HB2      SER  12 -12.615   2.157  -3.533
   39    HB3  SER  12           HB1      SER  12 -13.021   1.956  -5.235
   40    HG   SER  12           HG       SER  12 -13.012  -0.024  -3.198
   41    H    CYS  13           HN       CYS  13  -9.983   1.861  -6.725
   42    HA   CYS  13           HA       CYS  13  -8.127   3.698  -5.676
   43    HB2  CYS  13           HB2      CYS  13  -8.191   2.560  -7.990
   44    HB3  CYS  13           HB1      CYS  13  -9.256   3.879  -8.460
   45    H    ARG  14           HN       ARG  14  -8.296   6.063  -6.966
   46    HA   ARG  14           HA       ARG  14 -10.930   7.236  -6.330
   47    HB2  ARG  14           HB2      ARG  14  -9.076   7.405  -4.437
   48    HB3  ARG  14           HB1      ARG  14  -8.469   8.717  -5.442
   49    HG2  ARG  14           HG2      ARG  14 -10.850   9.647  -5.429
   50    HG3  ARG  14           HG1      ARG  14 -11.203   8.470  -4.163
   51    HD2  ARG  14           HD2      ARG  14  -9.425   9.409  -2.761
   52    HD3  ARG  14           HD1      ARG  14  -9.001  10.550  -4.034
   53    HE   ARG  14           HE       ARG  14 -10.844  11.838  -3.429
   54   HH11  ARG  14          HH21      ARG  14 -10.984   8.685  -2.012
   55   HH12  ARG  14          HH22      ARG  14 -12.331   9.053  -0.988
   56   HH21  ARG  14          HH11      ARG  14 -12.612  12.330  -2.089
   57   HH22  ARG  14          HH12      ARG  14 -13.253  11.117  -1.032
   58    H    ILE  15           HN       ILE  15  -9.008   6.644  -8.695
   59    HA   ILE  15           HA       ILE  15  -9.294   9.308  -9.974
   60    HB   ILE  15           HB       ILE  15  -7.013   7.357 -10.381
   61   HG12  ILE  15          HG12      ILE  15  -6.869  10.113  -9.138
   62   HG13  ILE  15          HG11      ILE  15  -7.102   8.665  -8.160
   63   HG21  ILE  15          HG21      ILE  15  -6.075   9.398 -11.605
   64   HG22  ILE  15          HG22      ILE  15  -7.707  10.064 -11.538
   65   HG23  ILE  15          HG23      ILE  15  -7.403   8.560 -12.406
   66   HD11  ILE  15          HD11      ILE  15  -4.820   9.037 -10.115
   67   HD12  ILE  15          HD12      ILE  15  -5.031   7.706  -8.978
   68   HD13  ILE  15          HD13      ILE  15  -4.695   9.332  -8.381
   69    H    CYS  16           HN       CYS  16  -9.197   5.813 -10.275
   70    HA   CYS  16           HA       CYS  16 -10.807   5.984 -12.749
   71    HB2  CYS  16           HB2      CYS  16  -9.531   4.212 -13.754
   72    HB3  CYS  16           HB1      CYS  16  -8.392   5.450 -13.224
   73    H    LYS  17           HN       LYS  17 -10.331   4.723  -9.626
   74    HA   LYS  17           HA       LYS  17 -11.513   3.249  -8.344
   75    HB2  LYS  17           HB2      LYS  17 -13.574   3.246 -10.550
   76    HB3  LYS  17           HB1      LYS  17 -13.817   2.952  -8.831
   77    HG2  LYS  17           HG2      LYS  17 -13.205   5.267  -8.313
   78    HG3  LYS  17           HG1      LYS  17 -12.885   5.582 -10.019
   79    HD2  LYS  17           HD2      LYS  17 -15.171   5.346 -10.607
   80    HD3  LYS  17           HD1      LYS  17 -15.574   4.594  -9.063
   81    HE2  LYS  17           HE2      LYS  17 -16.332   6.918  -9.054
   82    HE3  LYS  17           HE1      LYS  17 -15.002   6.731  -7.912
   83    HZ1  LYS  17           HZ1      LYS  17 -14.944   8.687  -9.540
   84    HZ2  LYS  17           HZ2      LYS  17 -14.494   7.535 -10.705
   85    HZ3  LYS  17           HZ3      LYS  17 -13.526   7.782  -9.330
   86    H    GLY  18           HN       GLY  18  -9.511   2.091  -9.725
   87    HA2  GLY  18           HA2      GLY  18 -10.559  -0.307 -11.070
   88    HA3  GLY  18           HA1      GLY  18  -8.875   0.204 -11.008
   89    H    ASP  19           HN       ASP  19  -8.305  -1.937 -10.359
   90    HA   ASP  19           HA       ASP  19  -9.196  -2.827  -7.706
   91    HB2  ASP  19           HB2      ASP  19  -8.894  -4.283  -9.901
   92    HB3  ASP  19           HB1      ASP  19  -7.216  -4.352  -9.377
   93    H    HIS  20           HN       HIS  20  -7.943  -0.698  -7.078
   94    HA   HIS  20           HA       HIS  20  -5.704  -1.459  -5.567
   95    HB2  HIS  20           HB2      HIS  20  -4.011   0.009  -6.809
   96    HB3  HIS  20           HB1      HIS  20  -4.372  -1.559  -7.527
   97    HD2  HIS  20           HD2      HIS  20  -5.613   2.192  -8.082
   98    HE1  HIS  20           HE1      HIS  20  -5.965   0.055 -11.705
   99    H    TRP  21           HN       TRP  21  -5.278   0.053  -4.043
  100    HA   TRP  21           HA       TRP  21  -7.081   2.117  -3.537
  101    HB2  TRP  21           HB2      TRP  21  -4.265   1.626  -2.560
  102    HB3  TRP  21           HB1      TRP  21  -5.239   2.974  -1.977
  103    HD1  TRP  21           HD1      TRP  21  -5.083  -0.844  -1.972
  104    HE1  TRP  21           HE1      TRP  21  -6.634  -1.734  -0.115
  105    HE3  TRP  21           HE3      TRP  21  -7.329   3.511  -0.535
  106    HZ2  TRP  21           HZ2      TRP  21  -8.571  -0.732   1.735
  107    HZ3  TRP  21           HZ3      TRP  21  -9.021   3.515   1.275
  108    HH2  TRP  21           HH2      TRP  21  -9.644   1.401   2.411
  109    H    THR  22           HN       THR  22  -5.836   4.434  -3.002
  110    HA   THR  22           HA       THR  22  -5.462   5.564  -5.644
  111    HB   THR  22           HB       THR  22  -5.147   7.048  -3.037
  112    HG1  THR  22           HG1      THR  22  -7.316   5.727  -3.996
  113   HG21  THR  22          HG21      THR  22  -6.292   7.841  -5.731
  114   HG22  THR  22          HG22      THR  22  -4.645   8.187  -5.202
  115   HG23  THR  22          HG23      THR  22  -6.014   8.908  -4.354
  116    H    THR  23           HN       THR  23  -3.509   4.919  -2.779
  117    HA   THR  23           HA       THR  23  -1.190   6.324  -3.598
  118    HB   THR  23           HB       THR  23  -1.162   3.851  -1.873
  119    HG1  THR  23           HG1      THR  23  -2.587   4.859  -0.717
  120   HG21  THR  23          HG21      THR  23   1.009   4.843  -2.340
  121   HG22  THR  23          HG22      THR  23   0.573   5.191  -0.669
  122   HG23  THR  23          HG23      THR  23   0.411   6.442  -1.901
  123    H    ARG  24           HN       ARG  24  -2.669   3.701  -4.990
  124    HA   ARG  24           HA       ARG  24  -0.197   2.953  -6.421
  125    HB2  ARG  24           HB2      ARG  24  -1.201   0.523  -6.330
  126    HB3  ARG  24           HB1      ARG  24  -0.263   1.132  -4.963
  127    HG2  ARG  24           HG2      ARG  24  -2.220   1.624  -3.701
  128    HG3  ARG  24           HG1      ARG  24  -3.267   1.433  -5.107
  129    HD2  ARG  24           HD2      ARG  24  -3.452  -0.556  -3.722
  130    HD3  ARG  24           HD1      ARG  24  -2.609  -0.978  -5.208
  131    HE   ARG  24           HE       ARG  24  -0.717  -0.257  -3.230
  132   HH11  ARG  24          HH21      ARG  24  -3.005  -2.716  -4.062
  133   HH12  ARG  24          HH22      ARG  24  -2.138  -3.986  -3.265
  134   HH21  ARG  24          HH11      ARG  24   0.426  -1.917  -2.182
  135   HH22  ARG  24          HH12      ARG  24  -0.195  -3.534  -2.200
  136    H    CYS  25           HN       CYS  25  -1.729   4.652  -7.641
  137    HA   CYS  25           HA       CYS  25  -3.718   3.209  -9.271
  138    HB2  CYS  25           HB2      CYS  25  -4.454   5.327  -8.286
  139    HB3  CYS  25           HB1      CYS  25  -3.110   6.166  -9.056
  140    HA   PRO  26           HA       PRO  26  -0.572   3.152 -12.487
  141    HB2  PRO  26           HB2      PRO  26  -2.066   2.268 -14.584
  142    HB3  PRO  26           HB1      PRO  26  -1.599   1.206 -13.240
  143    HG2  PRO  26           HG2      PRO  26  -4.193   2.614 -13.720
  144    HG3  PRO  26           HG1      PRO  26  -3.901   0.952 -13.168
  145    HD2  PRO  26           HD2      PRO  26  -4.537   2.992 -11.450
  146    HD3  PRO  26           HD1      PRO  26  -3.541   1.603 -10.967
  147    H    TYR  27           HN       TYR  27  -2.793   5.435 -12.030
  148    HA   TYR  27           HA       TYR  27  -1.848   7.075 -14.262
  149    HB2  TYR  27           HB2      TYR  27  -4.800   6.717 -13.697
  150    HB3  TYR  27           HB1      TYR  27  -4.082   7.769 -14.915
  151    HD1  TYR  27           HD2      TYR  27  -2.297   6.499 -16.495
  152    HD2  TYR  27           HD1      TYR  27  -5.582   4.637 -14.442
  153    HE1  TYR  27           HE2      TYR  27  -2.245   4.623 -18.113
  154    HE2  TYR  27           HE1      TYR  27  -5.528   2.761 -16.063
  155    HH   TYR  27           HH       TYR  27  -3.046   2.030 -17.947
  156    H    LYS  28           HN       LYS  28  -0.820   7.703 -12.061
  157    HA   LYS  28           HA       LYS  28  -2.511   9.349 -10.358
  158    HB2  LYS  28           HB2      LYS  28  -0.322   9.834  -9.190
  159    HB3  LYS  28           HB1      LYS  28  -0.813   8.143  -9.191
  160    HG2  LYS  28           HG2      LYS  28   0.903   9.032 -11.483
  161    HG3  LYS  28           HG1      LYS  28   1.684   8.941  -9.906
  162    HD2  LYS  28           HD2      LYS  28   1.091   6.619  -9.658
  163    HD3  LYS  28           HD1      LYS  28   0.072   6.667 -11.093
  164    HE2  LYS  28           HE2      LYS  28   3.081   7.029 -11.016
  165    HE3  LYS  28           HE1      LYS  28   2.212   5.639 -11.663
  166    HZ1  LYS  28           HZ1      LYS  28   2.707   8.206 -12.854
  167    HZ2  LYS  28           HZ2      LYS  28   1.079   7.729 -12.954
  168    HZ3  LYS  28           HZ3      LYS  28   2.300   6.731 -13.587
  169    H    ASP  29           HN       ASP  29  -1.957   9.979 -13.262
  170    HA   ASP  29           HA       ASP  29  -0.265  12.174 -13.498
  171    HB2  ASP  29           HB2      ASP  29  -1.208  12.404 -15.613
  172    HB3  ASP  29           HB1      ASP  29  -1.492  10.716 -15.261
  173    H    THR  30           HN       THR  30  -2.828  11.883 -11.543
  174    HA   THR  30           HA       THR  30  -4.046  14.485 -11.878
  175    HB   THR  30           HB       THR  30  -5.380  13.900  -9.954
  176    HG1  THR  30           HG1      THR  30  -4.246  11.474  -9.474
  177   HG21  THR  30          HG21      THR  30  -5.886  12.756 -12.105
  178   HG22  THR  30          HG22      THR  30  -6.330  11.779 -10.706
  179   HG23  THR  30          HG23      THR  30  -4.859  11.412 -11.605
  180    H    LEU  31           HN       LEU  31  -1.459  13.088 -10.009
  181    HA   LEU  31           HA       LEU  31  -1.282  15.265  -8.123
  182    HB2  LEU  31           HB2      LEU  31   0.913  13.288  -8.729
  183    HB3  LEU  31           HB1      LEU  31   0.566  14.118  -7.211
  184    HG   LEU  31           HG       LEU  31  -1.129  11.972  -8.519
  185   HD11  LEU  31          HD11      LEU  31   0.507  12.062  -5.967
  186   HD12  LEU  31          HD12      LEU  31   0.829  11.071  -7.390
  187   HD13  LEU  31          HD13      LEU  31  -0.593  10.752  -6.396
  188   HD21  LEU  31          HD21      LEU  31  -1.588  13.759  -6.120
  189   HD22  LEU  31          HD22      LEU  31  -2.411  12.209  -6.299
  190   HD23  LEU  31          HD23      LEU  31  -2.661  13.482  -7.493
  191    H    GLY  32           HN       GLY  32   1.156  14.077 -10.440
  192    HA2  GLY  32           HA2      GLY  32   2.727  15.192 -11.697
  193    HA3  GLY  32           HA1      GLY  32   1.492  16.429 -11.908
  Start of MODEL    3
    1    H1   LYS   9           HT1      LYS   9  -9.841  -6.746   2.172
    2    H2   LYS   9           HT2      LYS   9  -9.065  -5.385   1.516
    3    H3   LYS   9           HT3      LYS   9 -10.593  -5.855   0.941
    4    HA   LYS   9           HA       LYS   9 -11.168  -5.548   3.512
    5    HB2  LYS   9           HB2      LYS   9  -8.953  -3.593   2.827
    6    HB3  LYS   9           HB1      LYS   9 -10.039  -3.416   4.207
    7    HG2  LYS   9           HG2      LYS   9  -9.220  -5.390   5.245
    8    HG3  LYS   9           HG1      LYS   9  -8.429  -5.935   3.765
    9    HD2  LYS   9           HD2      LYS   9  -6.831  -4.985   5.447
   10    HD3  LYS   9           HD1      LYS   9  -6.806  -4.134   3.903
   11    HE2  LYS   9           HE2      LYS   9  -8.578  -3.201   6.161
   12    HE3  LYS   9           HE1      LYS   9  -6.890  -2.704   6.063
   13    HZ1  LYS   9           HZ1      LYS   9  -9.135  -1.860   4.490
   14    HZ2  LYS   9           HZ2      LYS   9  -7.804  -2.324   3.541
   15    HZ3  LYS   9           HZ3      LYS   9  -7.630  -1.112   4.718
   16    H    ILE  10           HN       ILE  10 -10.209  -2.564   1.990
   17    HA   ILE  10           HA       ILE  10 -12.761  -2.288   0.567
   18    HB   ILE  10           HB       ILE  10 -11.895  -0.168   2.536
   19   HG12  ILE  10          HG12      ILE  10 -13.806  -2.490   2.951
   20   HG13  ILE  10          HG11      ILE  10 -12.324  -2.169   3.853
   21   HG21  ILE  10          HG21      ILE  10 -14.076   0.719   2.171
   22   HG22  ILE  10          HG22      ILE  10 -14.634  -0.767   1.401
   23   HG23  ILE  10          HG23      ILE  10 -13.485   0.279   0.568
   24   HD11  ILE  10          HD11      ILE  10 -14.887  -0.566   3.868
   25   HD12  ILE  10          HD12      ILE  10 -13.369   0.073   4.501
   26   HD13  ILE  10          HD13      ILE  10 -14.096  -1.359   5.230
   27    H    VAL  11           HN       VAL  11 -10.478  -2.599  -0.747
   28    HA   VAL  11           HA       VAL  11  -9.128  -0.086  -1.241
   29    HB   VAL  11           HB       VAL  11  -7.880  -2.162  -1.441
   30   HG11  VAL  11          HG11      VAL  11  -9.614  -2.839  -3.825
   31   HG12  VAL  11          HG12      VAL  11  -9.934  -3.484  -2.216
   32   HG13  VAL  11          HG13      VAL  11  -8.417  -3.863  -3.031
   33   HG21  VAL  11          HG21      VAL  11  -6.792  -1.687  -3.509
   34   HG22  VAL  11          HG22      VAL  11  -7.447  -0.145  -2.959
   35   HG23  VAL  11          HG23      VAL  11  -8.273  -1.053  -4.226
   36    H    SER  12           HN       SER  12  -9.632   1.397  -2.618
   37    HA   SER  12           HA       SER  12 -11.027   0.845  -5.075
   38    HB2  SER  12           HB2      SER  12 -12.408   2.642  -3.085
   39    HB3  SER  12           HB1      SER  12 -12.978   2.161  -4.680
   40    HG   SER  12           HG       SER  12 -13.542   0.260  -3.912
   41    H    CYS  13           HN       CYS  13 -10.127   2.072  -6.491
   42    HA   CYS  13           HA       CYS  13  -8.494   4.336  -5.785
   43    HB2  CYS  13           HB2      CYS  13  -7.702   2.976  -7.570
   44    HB3  CYS  13           HB1      CYS  13  -9.250   3.044  -8.406
   45    H    ARG  14           HN       ARG  14  -8.785   6.506  -6.690
   46    HA   ARG  14           HA       ARG  14 -11.662   7.209  -7.002
   47    HB2  ARG  14           HB2      ARG  14 -11.198   9.313  -5.967
   48    HB3  ARG  14           HB1      ARG  14 -10.478   8.069  -4.947
   49    HG2  ARG  14           HG2      ARG  14  -8.288   8.482  -6.161
   50    HG3  ARG  14           HG1      ARG  14  -9.053   9.875  -6.924
   51    HD2  ARG  14           HD2      ARG  14  -8.964   9.510  -3.922
   52    HD3  ARG  14           HD1      ARG  14  -7.717  10.375  -4.815
   53    HE   ARG  14           HE       ARG  14 -10.273  11.396  -5.506
   54   HH11  ARG  14          HH21      ARG  14  -7.965  11.267  -2.931
   55   HH12  ARG  14          HH22      ARG  14  -8.435  12.787  -2.248
   56   HH21  ARG  14          HH11      ARG  14 -10.897  13.389  -4.615
   57   HH22  ARG  14          HH12      ARG  14 -10.096  13.989  -3.200
   58    H    ILE  15           HN       ILE  15  -8.677   7.091  -8.573
   59    HA   ILE  15           HA       ILE  15  -9.202   9.325 -10.381
   60    HB   ILE  15           HB       ILE  15  -6.999   7.248 -10.419
   61   HG12  ILE  15          HG12      ILE  15  -6.794  10.114  -9.468
   62   HG13  ILE  15          HG11      ILE  15  -7.188   8.801  -8.360
   63   HG21  ILE  15          HG21      ILE  15  -7.483   9.834 -11.907
   64   HG22  ILE  15          HG22      ILE  15  -7.173   8.234 -12.580
   65   HG23  ILE  15          HG23      ILE  15  -5.878   9.116 -11.769
   66   HD11  ILE  15          HD11      ILE  15  -5.117   7.618  -9.064
   67   HD12  ILE  15          HD12      ILE  15  -4.775   9.190  -8.339
   68   HD13  ILE  15          HD13      ILE  15  -4.708   8.992 -10.090
   69    H    CYS  16           HN       CYS  16  -9.314   5.815 -10.328
   70    HA   CYS  16           HA       CYS  16 -10.749   5.836 -12.907
   71    HB2  CYS  16           HB2      CYS  16  -9.463   4.029 -13.770
   72    HB3  CYS  16           HB1      CYS  16  -8.303   5.221 -13.180
   73    H    LYS  17           HN       LYS  17 -10.281   4.532  -9.723
   74    HA   LYS  17           HA       LYS  17 -11.577   3.149  -8.439
   75    HB2  LYS  17           HB2      LYS  17 -13.679   3.233 -10.594
   76    HB3  LYS  17           HB1      LYS  17 -13.889   3.075  -8.851
   77    HG2  LYS  17           HG2      LYS  17 -12.780   5.417  -8.707
   78    HG3  LYS  17           HG1      LYS  17 -13.127   5.532 -10.431
   79    HD2  LYS  17           HD2      LYS  17 -15.535   4.912  -9.846
   80    HD3  LYS  17           HD1      LYS  17 -15.093   5.199  -8.163
   81    HE2  LYS  17           HE2      LYS  17 -14.774   7.220 -10.400
   82    HE3  LYS  17           HE1      LYS  17 -16.095   7.214  -9.230
   83    HZ1  LYS  17           HZ1      LYS  17 -14.240   7.230  -7.497
   84    HZ2  LYS  17           HZ2      LYS  17 -14.551   8.675  -8.334
   85    HZ3  LYS  17           HZ3      LYS  17 -13.221   7.710  -8.766
   86    H    GLY  18           HN       GLY  18  -9.676   1.835  -9.752
   87    HA2  GLY  18           HA2      GLY  18 -10.882  -0.454 -11.163
   88    HA3  GLY  18           HA1      GLY  18  -9.164  -0.075 -11.070
   89    H    ASP  19           HN       ASP  19  -8.153  -1.658 -10.021
   90    HA   ASP  19           HA       ASP  19  -9.312  -2.674  -7.481
   91    HB2  ASP  19           HB2      ASP  19  -8.408  -4.861  -7.997
   92    HB3  ASP  19           HB1      ASP  19  -9.431  -4.337  -9.333
   93    H    HIS  20           HN       HIS  20  -7.885  -0.663  -6.915
   94    HA   HIS  20           HA       HIS  20  -5.612  -1.581  -5.535
   95    HB2  HIS  20           HB2      HIS  20  -3.901  -0.233  -6.841
   96    HB3  HIS  20           HB1      HIS  20  -4.446  -1.715  -7.621
   97    HD2  HIS  20           HD2      HIS  20  -5.379   2.153  -7.861
   98    HE1  HIS  20           HE1      HIS  20  -6.134   0.310 -11.580
   99    H    TRP  21           HN       TRP  21  -4.965  -0.076  -4.043
  100    HA   TRP  21           HA       TRP  21  -6.636   2.033  -3.361
  101    HB2  TRP  21           HB2      TRP  21  -3.723   1.540  -2.728
  102    HB3  TRP  21           HB1      TRP  21  -4.629   2.882  -2.035
  103    HD1  TRP  21           HD1      TRP  21  -4.890  -0.967  -2.317
  104    HE1  TRP  21           HE1      TRP  21  -6.038  -1.852  -0.186
  105    HE3  TRP  21           HE3      TRP  21  -5.928   3.451   0.023
  106    HZ2  TRP  21           HZ2      TRP  21  -7.239  -0.822   2.197
  107    HZ3  TRP  21           HZ3      TRP  21  -7.074   3.471   2.221
  108    HH2  TRP  21           HH2      TRP  21  -7.730   1.341   3.310
  109    H    THR  22           HN       THR  22  -5.754   4.395  -3.154
  110    HA   THR  22           HA       THR  22  -5.439   5.372  -5.840
  111    HB   THR  22           HB       THR  22  -5.390   7.612  -4.702
  112    HG1  THR  22           HG1      THR  22  -5.748   5.983  -2.408
  113   HG21  THR  22          HG21      THR  22  -7.491   6.418  -5.412
  114   HG22  THR  22          HG22      THR  22  -7.718   7.536  -4.067
  115   HG23  THR  22          HG23      THR  22  -7.629   5.801  -3.765
  116    H    THR  23           HN       THR  23  -3.280   4.410  -3.392
  117    HA   THR  23           HA       THR  23  -1.113   6.182  -4.134
  118    HB   THR  23           HB       THR  23   0.221   4.634  -2.642
  119    HG1  THR  23           HG1      THR  23  -2.160   3.582  -1.703
  120   HG21  THR  23          HG21      THR  23  -2.335   5.837  -1.545
  121   HG22  THR  23          HG22      THR  23  -0.806   6.684  -1.780
  122   HG23  THR  23          HG23      THR  23  -0.927   5.397  -0.580
  123    H    ARG  24           HN       ARG  24  -2.005   2.798  -4.704
  124    HA   ARG  24           HA       ARG  24   0.329   2.406  -6.439
  125    HB2  ARG  24           HB2      ARG  24  -0.981   0.044  -6.601
  126    HB3  ARG  24           HB1      ARG  24   0.096   0.440  -5.261
  127    HG2  ARG  24           HG2      ARG  24  -1.725   1.079  -3.855
  128    HG3  ARG  24           HG1      ARG  24  -2.863   1.061  -5.200
  129    HD2  ARG  24           HD2      ARG  24  -3.179  -0.971  -3.926
  130    HD3  ARG  24           HD1      ARG  24  -2.420  -1.401  -5.455
  131    HE   ARG  24           HE       ARG  24  -0.527  -0.923  -3.324
  132   HH11  ARG  24          HH21      ARG  24  -2.640  -3.189  -4.864
  133   HH12  ARG  24          HH22      ARG  24  -1.760  -4.582  -4.333
  134   HH21  ARG  24          HH11      ARG  24   0.634  -2.746  -2.624
  135   HH22  ARG  24          HH12      ARG  24   0.094  -4.332  -3.064
  136    H    CYS  25           HN       CYS  25  -2.161   4.133  -7.061
  137    HA   CYS  25           HA       CYS  25  -3.365   2.774  -9.304
  138    HB2  CYS  25           HB2      CYS  25  -4.693   4.380  -8.051
  139    HB3  CYS  25           HB1      CYS  25  -3.533   5.658  -8.403
  140    HA   PRO  26           HA       PRO  26  -0.085   4.082 -12.081
  141    HB2  PRO  26           HB2      PRO  26  -1.172   3.360 -14.469
  142    HB3  PRO  26           HB1      PRO  26  -0.580   2.164 -13.298
  143    HG2  PRO  26           HG2      PRO  26  -3.382   3.076 -13.807
  144    HG3  PRO  26           HG1      PRO  26  -2.764   1.431 -13.561
  145    HD2  PRO  26           HD2      PRO  26  -3.969   2.868 -11.564
  146    HD3  PRO  26           HD1      PRO  26  -2.712   1.652 -11.249
  147    H    TYR  27           HN       TYR  27  -3.312   5.300 -12.146
  148    HA   TYR  27           HA       TYR  27  -2.737   7.391 -14.109
  149    HB2  TYR  27           HB2      TYR  27  -5.212   6.851 -12.451
  150    HB3  TYR  27           HB1      TYR  27  -5.080   8.046 -13.742
  151    HD1  TYR  27           HD2      TYR  27  -4.615   7.292 -16.095
  152    HD2  TYR  27           HD1      TYR  27  -5.535   4.532 -12.935
  153    HE1  TYR  27           HE2      TYR  27  -5.134   5.542 -17.775
  154    HE2  TYR  27           HE1      TYR  27  -6.054   2.782 -14.615
  155    HH   TYR  27           HH       TYR  27  -5.183   2.456 -17.257
  156    H    LYS  28           HN       LYS  28  -1.369   7.183 -11.427
  157    HA   LYS  28           HA       LYS  28  -2.339   9.347  -9.836
  158    HB2  LYS  28           HB2      LYS  28  -0.463   8.958  -8.446
  159    HB3  LYS  28           HB1      LYS  28  -0.928   7.372  -9.049
  160    HG2  LYS  28           HG2      LYS  28   1.354   9.102 -10.049
  161    HG3  LYS  28           HG1      LYS  28   1.476   7.564  -9.209
  162    HD2  LYS  28           HD2      LYS  28   0.212   6.520 -11.141
  163    HD3  LYS  28           HD1      LYS  28   0.418   8.049 -12.000
  164    HE2  LYS  28           HE2      LYS  28   2.570   6.162 -11.029
  165    HE3  LYS  28           HE1      LYS  28   2.241   6.669 -12.685
  166    HZ1  LYS  28           HZ1      LYS  28   3.885   8.120 -12.237
  167    HZ2  LYS  28           HZ2      LYS  28   3.641   8.068 -10.557
  168    HZ3  LYS  28           HZ3      LYS  28   2.633   9.023 -11.536
  169    H    ASP  29           HN       ASP  29  -1.560   9.719 -12.780
  170    HA   ASP  29           HA       ASP  29   0.666  11.381 -12.962
  171    HB2  ASP  29           HB2      ASP  29  -0.087  11.801 -15.127
  172    HB3  ASP  29           HB1      ASP  29  -0.792  10.242 -14.771
  173    H    THR  30           HN       THR  30  -2.011  11.839 -11.182
  174    HA   THR  30           HA       THR  30  -2.406  14.682 -11.613
  175    HB   THR  30           HB       THR  30  -4.017  14.517  -9.788
  176    HG1  THR  30           HG1      THR  30  -3.606  11.793  -9.506
  177   HG21  THR  30          HG21      THR  30  -4.775  13.788 -11.985
  178   HG22  THR  30          HG22      THR  30  -5.482  12.741 -10.753
  179   HG23  THR  30          HG23      THR  30  -4.113  12.177 -11.710
  180    H    LEU  31           HN       LEU  31  -1.914  13.085  -8.490
  181    HA   LEU  31           HA       LEU  31  -0.418  15.324  -7.488
  182    HB2  LEU  31           HB2      LEU  31  -0.600  12.625  -6.158
  183    HB3  LEU  31           HB1      LEU  31  -0.455  14.216  -5.409
  184    HG   LEU  31           HG       LEU  31  -2.860  13.140  -6.910
  185   HD11  LEU  31          HD11      LEU  31  -2.353  13.841  -4.003
  186   HD12  LEU  31          HD12      LEU  31  -2.705  12.243  -4.663
  187   HD13  LEU  31          HD13      LEU  31  -3.949  13.493  -4.668
  188   HD21  LEU  31          HD21      LEU  31  -2.756  15.467  -7.418
  189   HD22  LEU  31          HD22      LEU  31  -2.208  15.876  -5.793
  190   HD23  LEU  31          HD23      LEU  31  -3.870  15.348  -6.056
  191    H    GLY  32           HN       GLY  32   1.647  14.587  -6.105
  192    HA2  GLY  32           HA2      GLY  32   3.906  14.169  -6.276
  193    HA3  GLY  32           HA1      GLY  32   3.403  12.629  -6.966
  Start of MODEL    4
    1    H1   LYS   9           HT1      LYS   9 -10.033  -4.321   2.277
    2    H2   LYS   9           HT2      LYS   9  -8.769  -4.910   1.306
    3    H3   LYS   9           HT3      LYS   9  -9.343  -5.833   2.612
    4    HA   LYS   9           HA       LYS   9 -10.083  -6.426   0.227
    5    HB2  LYS   9           HB2      LYS   9 -12.279  -6.117   2.278
    6    HB3  LYS   9           HB1      LYS   9 -12.031  -7.422   1.122
    7    HG2  LYS   9           HG2      LYS   9 -11.188  -8.479   3.001
    8    HG3  LYS   9           HG1      LYS   9  -9.713  -7.674   2.475
    9    HD2  LYS   9           HD2      LYS   9  -9.789  -7.046   4.724
   10    HD3  LYS   9           HD1      LYS   9 -10.610  -5.681   3.970
   11    HE2  LYS   9           HE2      LYS   9 -12.786  -7.057   4.358
   12    HE3  LYS   9           HE1      LYS   9 -11.810  -7.990   5.491
   13    HZ1  LYS   9           HZ1      LYS   9 -11.235  -5.381   6.067
   14    HZ2  LYS   9           HZ2      LYS   9 -12.257  -6.406   6.958
   15    HZ3  LYS   9           HZ3      LYS   9 -12.906  -5.373   5.777
   16    H    ILE  10           HN       ILE  10 -11.718  -3.776   1.960
   17    HA   ILE  10           HA       ILE  10 -13.410  -3.116  -0.265
   18    HB   ILE  10           HB       ILE  10 -12.748  -1.293   2.049
   19   HG12  ILE  10          HG12      ILE  10 -14.671  -3.641   1.977
   20   HG13  ILE  10          HG11      ILE  10 -13.236  -3.500   2.991
   21   HG21  ILE  10          HG21      ILE  10 -15.373  -1.752   0.618
   22   HG22  ILE  10          HG22      ILE  10 -14.189  -0.576   0.050
   23   HG23  ILE  10          HG23      ILE  10 -14.919  -0.393   1.646
   24   HD11  ILE  10          HD11      ILE  10 -14.284  -1.369   3.938
   25   HD12  ILE  10          HD12      ILE  10 -15.071  -2.882   4.388
   26   HD13  ILE  10          HD13      ILE  10 -15.773  -1.862   3.133
   27    H    VAL  11           HN       VAL  11 -10.971  -3.235  -1.364
   28    HA   VAL  11           HA       VAL  11  -9.666  -0.650  -1.405
   29    HB   VAL  11           HB       VAL  11  -8.337  -2.668  -1.716
   30   HG11  VAL  11          HG11      VAL  11  -8.642  -4.145  -3.575
   31   HG12  VAL  11          HG12      VAL  11  -9.797  -3.052  -4.337
   32   HG13  VAL  11          HG13      VAL  11 -10.242  -3.920  -2.868
   33   HG21  VAL  11          HG21      VAL  11  -8.463  -1.209  -4.363
   34   HG22  VAL  11          HG22      VAL  11  -7.047  -1.909  -3.575
   35   HG23  VAL  11          HG23      VAL  11  -7.804  -0.463  -2.907
   36    H    SER  12           HN       SER  12 -10.012   0.966  -2.685
   37    HA   SER  12           HA       SER  12 -11.221   0.656  -5.293
   38    HB2  SER  12           HB2      SER  12 -13.031   2.318  -4.772
   39    HB3  SER  12           HB1      SER  12 -13.261   0.726  -4.054
   40    HG   SER  12           HG       SER  12 -13.397   2.869  -2.748
   41    H    CYS  13           HN       CYS  13 -10.174   1.946  -6.543
   42    HA   CYS  13           HA       CYS  13  -8.396   3.967  -5.619
   43    HB2  CYS  13           HB2      CYS  13  -8.258   2.562  -7.771
   44    HB3  CYS  13           HB1      CYS  13  -9.400   3.716  -8.448
   45    H    ARG  14           HN       ARG  14  -8.526   6.230  -6.781
   46    HA   ARG  14           HA       ARG  14 -11.307   7.267  -6.627
   47    HB2  ARG  14           HB2      ARG  14  -8.839   8.362  -5.270
   48    HB3  ARG  14           HB1      ARG  14 -10.295   9.322  -5.530
   49    HG2  ARG  14           HG2      ARG  14 -11.610   7.561  -4.325
   50    HG3  ARG  14           HG1      ARG  14 -10.095   6.734  -3.963
   51    HD2  ARG  14           HD2      ARG  14 -10.550   9.627  -3.226
   52    HD3  ARG  14           HD1      ARG  14 -11.010   8.309  -2.153
   53    HE   ARG  14           HE       ARG  14  -8.316   9.203  -2.737
   54   HH11  ARG  14          HH21      ARG  14 -10.363   6.629  -1.663
   55   HH12  ARG  14          HH22      ARG  14  -9.116   5.824  -0.771
   56   HH21  ARG  14          HH11      ARG  14  -6.675   8.153  -1.569
   57   HH22  ARG  14          HH12      ARG  14  -7.028   6.687  -0.718
   58    H    ILE  15           HN       ILE  15  -9.284   6.599  -8.796
   59    HA   ILE  15           HA       ILE  15  -9.425   9.208 -10.202
   60    HB   ILE  15           HB       ILE  15  -7.151   7.212 -10.373
   61   HG12  ILE  15          HG12      ILE  15  -7.072  10.012  -9.223
   62   HG13  ILE  15          HG11      ILE  15  -7.353   8.593  -8.215
   63   HG21  ILE  15          HG21      ILE  15  -7.694   9.898 -11.659
   64   HG22  ILE  15          HG22      ILE  15  -7.425   8.353 -12.467
   65   HG23  ILE  15          HG23      ILE  15  -6.096   9.155 -11.628
   66   HD11  ILE  15          HD11      ILE  15  -4.955   9.199  -8.266
   67   HD12  ILE  15          HD12      ILE  15  -4.953   9.001 -10.018
   68   HD13  ILE  15          HD13      ILE  15  -5.236   7.609  -8.975
   69    H    CYS  16           HN       CYS  16  -9.294   5.691 -10.386
   70    HA   CYS  16           HA       CYS  16 -10.759   5.793 -12.956
   71    HB2  CYS  16           HB2      CYS  16  -9.446   3.930 -13.778
   72    HB3  CYS  16           HB1      CYS  16  -8.356   5.234 -13.303
   73    H    LYS  17           HN       LYS  17 -10.337   4.426  -9.804
   74    HA   LYS  17           HA       LYS  17 -11.613   2.976  -8.576
   75    HB2  LYS  17           HB2      LYS  17 -13.686   3.114 -10.757
   76    HB3  LYS  17           HB1      LYS  17 -13.921   2.866  -9.029
   77    HG2  LYS  17           HG2      LYS  17 -12.892   5.199  -8.715
   78    HG3  LYS  17           HG1      LYS  17 -13.127   5.410 -10.449
   79    HD2  LYS  17           HD2      LYS  17 -15.280   4.788  -8.407
   80    HD3  LYS  17           HD1      LYS  17 -15.057   6.315  -9.263
   81    HE2  LYS  17           HE2      LYS  17 -15.939   3.654 -10.380
   82    HE3  LYS  17           HE1      LYS  17 -16.754   5.214 -10.490
   83    HZ1  LYS  17           HZ1      LYS  17 -14.983   6.019 -11.900
   84    HZ2  LYS  17           HZ2      LYS  17 -15.660   4.611 -12.567
   85    HZ3  LYS  17           HZ3      LYS  17 -14.161   4.541 -11.770
   86    H    GLY  18           HN       GLY  18  -9.673   1.813 -10.138
   87    HA2  GLY  18           HA2      GLY  18 -10.836  -0.440 -11.586
   88    HA3  GLY  18           HA1      GLY  18  -9.121  -0.082 -11.402
   89    H    ASP  19           HN       ASP  19  -7.977  -1.182  -9.917
   90    HA   ASP  19           HA       ASP  19  -9.322  -2.466  -7.654
   91    HB2  ASP  19           HB2      ASP  19  -9.140  -3.973  -9.825
   92    HB3  ASP  19           HB1      ASP  19  -7.473  -4.169  -9.303
   93    H    HIS  20           HN       HIS  20  -7.941  -0.489  -6.963
   94    HA   HIS  20           HA       HIS  20  -5.759  -1.392  -5.471
   95    HB2  HIS  20           HB2      HIS  20  -3.978  -0.005  -6.744
   96    HB3  HIS  20           HB1      HIS  20  -4.396  -1.593  -7.383
   97    HD2  HIS  20           HD2      HIS  20  -5.689   2.124  -8.099
   98    HE1  HIS  20           HE1      HIS  20  -5.759  -0.108 -11.680
   99    H    TRP  21           HN       TRP  21  -5.080   0.163  -4.028
  100    HA   TRP  21           HA       TRP  21  -6.786   2.326  -3.496
  101    HB2  TRP  21           HB2      TRP  21  -4.005   1.619  -2.563
  102    HB3  TRP  21           HB1      TRP  21  -4.795   3.100  -2.026
  103    HD1  TRP  21           HD1      TRP  21  -5.215  -0.717  -1.935
  104    HE1  TRP  21           HE1      TRP  21  -6.745  -1.326   0.048
  105    HE3  TRP  21           HE3      TRP  21  -6.579   3.961  -0.407
  106    HZ2  TRP  21           HZ2      TRP  21  -8.338  -0.002   2.022
  107    HZ3  TRP  21           HZ3      TRP  21  -8.102   4.257   1.525
  108    HH2  TRP  21           HH2      TRP  21  -8.982   2.284   2.741
  109    H    THR  22           HN       THR  22  -5.432   4.585  -3.061
  110    HA   THR  22           HA       THR  22  -5.024   5.618  -5.736
  111    HB   THR  22           HB       THR  22  -4.702   7.791  -4.514
  112    HG1  THR  22           HG1      THR  22  -5.552   6.402  -2.226
  113   HG21  THR  22          HG21      THR  22  -7.169   6.210  -3.742
  114   HG22  THR  22          HG22      THR  22  -6.923   7.004  -5.298
  115   HG23  THR  22          HG23      THR  22  -7.040   7.966  -3.824
  116    H    THR  23           HN       THR  23  -3.074   4.924  -2.885
  117    HA   THR  23           HA       THR  23  -0.689   6.178  -3.790
  118    HB   THR  23           HB       THR  23   0.410   4.770  -2.053
  119    HG1  THR  23           HG1      THR  23  -2.075   3.529  -2.224
  120   HG21  THR  23          HG21      THR  23  -0.607   6.890  -1.407
  121   HG22  THR  23          HG22      THR  23  -0.895   5.696  -0.142
  122   HG23  THR  23          HG23      THR  23  -2.187   6.119  -1.266
  123    H    ARG  24           HN       ARG  24  -2.314   3.713  -5.188
  124    HA   ARG  24           HA       ARG  24   0.122   2.699  -6.498
  125    HB2  ARG  24           HB2      ARG  24  -1.077   0.348  -6.339
  126    HB3  ARG  24           HB1      ARG  24  -0.092   0.931  -4.996
  127    HG2  ARG  24           HG2      ARG  24  -2.003   1.637  -3.763
  128    HG3  ARG  24           HG1      ARG  24  -3.064   1.454  -5.158
  129    HD2  ARG  24           HD2      ARG  24  -3.392  -0.448  -3.684
  130    HD3  ARG  24           HD1      ARG  24  -2.578  -1.000  -5.145
  131    HE   ARG  24           HE       ARG  24  -0.766  -0.289  -3.006
  132   HH11  ARG  24          HH21      ARG  24  -2.768  -2.733  -4.417
  133   HH12  ARG  24          HH22      ARG  24  -1.873  -4.052  -3.740
  134   HH21  ARG  24          HH11      ARG  24   0.413  -2.014  -2.114
  135   HH22  ARG  24          HH12      ARG  24  -0.072  -3.645  -2.436
  136    H    CYS  25           HN       CYS  25  -1.996   4.526  -7.323
  137    HA   CYS  25           HA       CYS  25  -3.674   3.042  -9.167
  138    HB2  CYS  25           HB2      CYS  25  -4.609   5.025  -8.144
  139    HB3  CYS  25           HB1      CYS  25  -3.271   6.009  -8.732
  140    HA   PRO  26           HA       PRO  26  -0.531   3.301 -12.366
  141    HB2  PRO  26           HB2      PRO  26  -1.973   2.468 -14.520
  142    HB3  PRO  26           HB1      PRO  26  -1.473   1.358 -13.227
  143    HG2  PRO  26           HG2      PRO  26  -4.117   2.686 -13.654
  144    HG3  PRO  26           HG1      PRO  26  -3.763   1.011 -13.191
  145    HD2  PRO  26           HD2      PRO  26  -4.490   2.926 -11.371
  146    HD3  PRO  26           HD1      PRO  26  -3.440   1.554 -10.956
  147    H    TYR  27           HN       TYR  27  -2.776   5.506 -11.789
  148    HA   TYR  27           HA       TYR  27  -1.901   7.258 -13.962
  149    HB2  TYR  27           HB2      TYR  27  -4.837   6.779 -13.399
  150    HB3  TYR  27           HB1      TYR  27  -4.167   7.931 -14.553
  151    HD1  TYR  27           HD2      TYR  27  -2.366   6.844 -16.230
  152    HD2  TYR  27           HD1      TYR  27  -5.521   4.703 -14.246
  153    HE1  TYR  27           HE2      TYR  27  -2.249   5.070 -17.958
  154    HE2  TYR  27           HE1      TYR  27  -5.403   2.930 -15.975
  155    HH   TYR  27           HH       TYR  27  -4.551   2.947 -18.571
  156    H    LYS  28           HN       LYS  28  -0.930   7.681 -11.612
  157    HA   LYS  28           HA       LYS  28  -2.625   9.240  -9.875
  158    HB2  LYS  28           HB2      LYS  28  -0.482   9.726  -8.673
  159    HB3  LYS  28           HB1      LYS  28  -0.834   8.009  -8.837
  160    HG2  LYS  28           HG2      LYS  28   0.786   9.254 -11.033
  161    HG3  LYS  28           HG1      LYS  28   1.586   9.079  -9.474
  162    HD2  LYS  28           HD2      LYS  28   0.084   6.733 -10.620
  163    HD3  LYS  28           HD1      LYS  28   1.691   7.111 -11.233
  164    HE2  LYS  28           HE2      LYS  28   2.685   6.823  -9.083
  165    HE3  LYS  28           HE1      LYS  28   1.118   6.832  -8.276
  166    HZ1  LYS  28           HZ1      LYS  28   0.925   4.664  -8.598
  167    HZ2  LYS  28           HZ2      LYS  28   2.508   4.635  -9.211
  168    HZ3  LYS  28           HZ3      LYS  28   1.190   4.823 -10.266
  169    H    ASP  29           HN       ASP  29  -2.110  10.034 -12.758
  170    HA   ASP  29           HA       ASP  29  -0.517  12.300 -12.905
  171    HB2  ASP  29           HB2      ASP  29  -1.536  12.633 -14.977
  172    HB3  ASP  29           HB1      ASP  29  -1.716  10.912 -14.728
  173    H    THR  30           HN       THR  30  -3.091  11.803 -10.972
  174    HA   THR  30           HA       THR  30  -4.242  14.484 -11.083
  175    HB   THR  30           HB       THR  30  -5.800  13.695  -9.439
  176    HG1  THR  30           HG1      THR  30  -5.441  11.906  -8.254
  177   HG21  THR  30          HG21      THR  30  -6.800  11.884 -10.612
  178   HG22  THR  30          HG22      THR  30  -5.239  11.294 -11.184
  179   HG23  THR  30          HG23      THR  30  -5.909  12.790 -11.834
  180    H    LEU  31           HN       LEU  31  -2.208  12.535  -8.937
  181    HA   LEU  31           HA       LEU  31  -2.018  14.538  -6.896
  182    HB2  LEU  31           HB2      LEU  31  -0.015  12.329  -7.335
  183    HB3  LEU  31           HB1      LEU  31  -0.522  13.073  -5.817
  184    HG   LEU  31           HG       LEU  31  -2.214  11.301  -7.604
  185   HD11  LEU  31          HD11      LEU  31  -1.111  10.923  -4.802
  186   HD12  LEU  31          HD12      LEU  31  -0.551  10.089  -6.252
  187   HD13  LEU  31          HD13      LEU  31  -2.179   9.795  -5.638
  188   HD21  LEU  31          HD21      LEU  31  -3.818  11.517  -5.605
  189   HD22  LEU  31          HD22      LEU  31  -3.696  12.917  -6.670
  190   HD23  LEU  31          HD23      LEU  31  -2.850  12.910  -5.122
  191    H    GLY  32           HN       GLY  32   0.053  13.513  -9.589
  192    HA2  GLY  32           HA2      GLY  32   2.298  15.074  -9.096
  193    HA3  GLY  32           HA1      GLY  32   1.741  14.616 -10.703
  Start of MODEL    5
    1    H1   LYS   9           HT1      LYS   9 -14.354  -5.802   4.210
    2    H2   LYS   9           HT2      LYS   9 -13.145  -6.846   3.630
    3    H3   LYS   9           HT3      LYS   9 -14.465  -6.439   2.642
    4    HA   LYS   9           HA       LYS   9 -13.524  -4.008   3.181
    5    HB2  LYS   9           HB2      LYS   9 -11.055  -5.705   2.794
    6    HB3  LYS   9           HB1      LYS   9 -11.154  -4.003   3.246
    7    HG2  LYS   9           HG2      LYS   9 -11.980  -6.374   4.946
    8    HG3  LYS   9           HG1      LYS   9 -10.608  -5.303   5.227
    9    HD2  LYS   9           HD2      LYS   9 -12.325  -3.391   5.311
   10    HD3  LYS   9           HD1      LYS   9 -13.552  -4.653   5.434
   11    HE2  LYS   9           HE2      LYS   9 -12.176  -5.590   7.382
   12    HE3  LYS   9           HE1      LYS   9 -11.294  -4.063   7.354
   13    HZ1  LYS   9           HZ1      LYS   9 -13.154  -4.021   8.913
   14    HZ2  LYS   9           HZ2      LYS   9 -14.238  -4.335   7.643
   15    HZ3  LYS   9           HZ3      LYS   9 -13.358  -2.881   7.673
   16    H    ILE  10           HN       ILE  10 -13.113  -2.959   1.235
   17    HA   ILE  10           HA       ILE  10 -12.680  -4.565  -1.182
   18    HB   ILE  10           HB       ILE  10 -15.168  -4.276  -0.718
   19   HG12  ILE  10          HG12      ILE  10 -14.065  -3.061  -3.271
   20   HG13  ILE  10          HG11      ILE  10 -14.202  -4.791  -2.955
   21   HG21  ILE  10          HG21      ILE  10 -14.757  -1.812   0.021
   22   HG22  ILE  10          HG22      ILE  10 -16.192  -2.175  -0.936
   23   HG23  ILE  10          HG23      ILE  10 -14.780  -1.455  -1.706
   24   HD11  ILE  10          HD11      ILE  10 -16.148  -4.185  -4.215
   25   HD12  ILE  10          HD12      ILE  10 -16.445  -2.775  -3.198
   26   HD13  ILE  10          HD13      ILE  10 -16.684  -4.396  -2.548
   27    H    VAL  11           HN       VAL  11 -11.062  -3.657  -2.229
   28    HA   VAL  11           HA       VAL  11 -10.250  -0.930  -1.712
   29    HB   VAL  11           HB       VAL  11  -8.550  -2.644  -2.018
   30   HG11  VAL  11          HG11      VAL  11  -8.276  -3.834  -4.092
   31   HG12  VAL  11          HG12      VAL  11  -9.523  -2.865  -4.877
   32   HG13  VAL  11          HG13      VAL  11  -9.964  -4.017  -3.617
   33   HG21  VAL  11          HG21      VAL  11  -8.223  -0.238  -2.814
   34   HG22  VAL  11          HG22      VAL  11  -8.517  -0.841  -4.446
   35   HG23  VAL  11          HG23      VAL  11  -7.138  -1.435  -3.522
   36    H    SER  12           HN       SER  12 -10.611   0.800  -2.856
   37    HA   SER  12           HA       SER  12 -11.583   0.592  -5.621
   38    HB2  SER  12           HB2      SER  12 -12.989   2.308  -3.575
   39    HB3  SER  12           HB1      SER  12 -13.439   2.041  -5.256
   40    HG   SER  12           HG       SER  12 -13.737  -0.180  -4.707
   41    H    CYS  13           HN       CYS  13 -10.399   1.828  -6.785
   42    HA   CYS  13           HA       CYS  13  -8.570   3.748  -5.768
   43    HB2  CYS  13           HB2      CYS  13  -8.405   2.393  -7.939
   44    HB3  CYS  13           HB1      CYS  13  -9.493   3.590  -8.631
   45    H    ARG  14           HN       ARG  14  -8.516   6.036  -6.279
   46    HA   ARG  14           HA       ARG  14 -11.227   7.247  -6.422
   47    HB2  ARG  14           HB2      ARG  14  -9.510   7.421  -4.315
   48    HB3  ARG  14           HB1      ARG  14  -8.971   8.814  -5.242
   49    HG2  ARG  14           HG2      ARG  14 -11.861   8.296  -4.455
   50    HG3  ARG  14           HG1      ARG  14 -10.764   9.361  -3.579
   51    HD2  ARG  14           HD2      ARG  14 -12.057  10.738  -5.067
   52    HD3  ARG  14           HD1      ARG  14 -10.426  10.647  -5.720
   53    HE   ARG  14           HE       ARG  14 -11.296   9.542  -7.565
   54   HH11  ARG  14          HH21      ARG  14 -13.516   9.451  -4.912
   55   HH12  ARG  14          HH22      ARG  14 -14.798   8.736  -5.830
   56   HH21  ARG  14          HH11      ARG  14 -12.972   8.607  -8.775
   57   HH22  ARG  14          HH12      ARG  14 -14.491   8.258  -8.018
   58    H    ILE  15           HN       ILE  15  -9.643   6.532  -8.699
   59    HA   ILE  15           HA       ILE  15  -9.394   9.185  -9.941
   60    HB   ILE  15           HB       ILE  15  -7.258   7.097 -10.389
   61   HG12  ILE  15          HG12      ILE  15  -7.237   9.374  -8.381
   62   HG13  ILE  15          HG11      ILE  15  -7.210   7.653  -7.998
   63   HG21  ILE  15          HG21      ILE  15  -7.668   9.012 -12.008
   64   HG22  ILE  15          HG22      ILE  15  -6.039   8.934 -11.337
   65   HG23  ILE  15          HG23      ILE  15  -7.195  10.107 -10.709
   66   HD11  ILE  15          HD11      ILE  15  -5.088   7.479  -9.361
   67   HD12  ILE  15          HD12      ILE  15  -4.939   8.425  -7.881
   68   HD13  ILE  15          HD13      ILE  15  -5.076   9.240  -9.439
   69    H    CYS  16           HN       CYS  16  -9.282   5.668 -10.361
   70    HA   CYS  16           HA       CYS  16 -10.797   5.952 -12.893
   71    HB2  CYS  16           HB2      CYS  16  -9.521   4.112 -13.828
   72    HB3  CYS  16           HB1      CYS  16  -8.405   5.370 -13.292
   73    H    LYS  17           HN       LYS  17 -10.483   4.540  -9.798
   74    HA   LYS  17           HA       LYS  17 -11.765   3.047  -8.633
   75    HB2  LYS  17           HB2      LYS  17 -13.790   3.203 -10.856
   76    HB3  LYS  17           HB1      LYS  17 -14.058   2.968  -9.130
   77    HG2  LYS  17           HG2      LYS  17 -13.021   5.297  -8.813
   78    HG3  LYS  17           HG1      LYS  17 -13.223   5.497 -10.553
   79    HD2  LYS  17           HD2      LYS  17 -15.414   4.912  -8.541
   80    HD3  LYS  17           HD1      LYS  17 -15.169   6.422  -9.420
   81    HE2  LYS  17           HE2      LYS  17 -16.049   3.746 -10.501
   82    HE3  LYS  17           HE1      LYS  17 -16.851   5.310 -10.657
   83    HZ1  LYS  17           HZ1      LYS  17 -14.522   5.854 -11.795
   84    HZ2  LYS  17           HZ2      LYS  17 -15.860   5.265 -12.662
   85    HZ3  LYS  17           HZ3      LYS  17 -14.629   4.203 -12.169
   86    H    GLY  18           HN       GLY  18  -9.952   1.597  -9.423
   87    HA2  GLY  18           HA2      GLY  18 -11.048  -0.627 -11.068
   88    HA3  GLY  18           HA1      GLY  18  -9.348  -0.162 -11.066
   89    H    ASP  19           HN       ASP  19  -8.106  -1.489  -9.930
   90    HA   ASP  19           HA       ASP  19  -9.144  -2.658  -7.408
   91    HB2  ASP  19           HB2      ASP  19  -8.087  -4.757  -7.944
   92    HB3  ASP  19           HB1      ASP  19  -9.131  -4.308  -9.291
   93    H    HIS  20           HN       HIS  20  -7.860  -0.469  -6.964
   94    HA   HIS  20           HA       HIS  20  -5.572  -1.158  -5.509
   95    HB2  HIS  20           HB2      HIS  20  -3.922   0.219  -6.955
   96    HB3  HIS  20           HB1      HIS  20  -4.284  -1.430  -7.458
   97    HD2  HIS  20           HD2      HIS  20  -5.728   2.175  -8.404
   98    HE1  HIS  20           HE1      HIS  20  -5.935  -0.355 -11.776
   99    H    TRP  21           HN       TRP  21  -5.011   0.472  -4.141
  100    HA   TRP  21           HA       TRP  21  -6.766   2.576  -3.666
  101    HB2  TRP  21           HB2      TRP  21  -3.870   2.197  -2.888
  102    HB3  TRP  21           HB1      TRP  21  -4.841   3.553  -2.315
  103    HD1  TRP  21           HD1      TRP  21  -5.294  -0.295  -2.527
  104    HE1  TRP  21           HE1      TRP  21  -6.393  -1.087  -0.333
  105    HE3  TRP  21           HE3      TRP  21  -5.817   4.186  -0.134
  106    HZ2  TRP  21           HZ2      TRP  21  -7.365   0.032   2.114
  107    HZ3  TRP  21           HZ3      TRP  21  -6.831   4.294   2.124
  108    HH2  TRP  21           HH2      TRP  21  -7.605   2.227   3.250
  109    H    THR  22           HN       THR  22  -5.405   4.916  -3.396
  110    HA   THR  22           HA       THR  22  -5.287   5.848  -6.148
  111    HB   THR  22           HB       THR  22  -5.197   8.072  -5.167
  112    HG1  THR  22           HG1      THR  22  -5.435   7.739  -2.645
  113   HG21  THR  22          HG21      THR  22  -7.124   6.191  -3.783
  114   HG22  THR  22          HG22      THR  22  -7.399   7.075  -5.285
  115   HG23  THR  22          HG23      THR  22  -7.273   7.948  -3.758
  116    H    THR  23           HN       THR  23  -3.082   5.047  -3.588
  117    HA   THR  23           HA       THR  23  -0.848   6.532  -4.623
  118    HB   THR  23           HB       THR  23   0.462   5.218  -2.982
  119    HG1  THR  23           HG1      THR  23  -1.300   3.437  -3.340
  120   HG21  THR  23          HG21      THR  23  -2.161   6.416  -2.070
  121   HG22  THR  23          HG22      THR  23  -0.586   7.205  -2.148
  122   HG23  THR  23          HG23      THR  23  -0.881   5.944  -0.953
  123    H    ARG  24           HN       ARG  24  -1.812   3.104  -4.660
  124    HA   ARG  24           HA       ARG  24   0.379   2.444  -6.483
  125    HB2  ARG  24           HB2      ARG  24  -0.834   0.114  -6.286
  126    HB3  ARG  24           HB1      ARG  24   0.105   0.734  -4.923
  127    HG2  ARG  24           HG2      ARG  24  -1.830   1.432  -3.752
  128    HG3  ARG  24           HG1      ARG  24  -2.848   1.316  -5.188
  129    HD2  ARG  24           HD2      ARG  24  -3.217  -0.585  -3.634
  130    HD3  ARG  24           HD1      ARG  24  -2.608  -1.119  -5.198
  131    HE   ARG  24           HE       ARG  24  -0.408  -0.706  -3.494
  132   HH11  ARG  24          HH21      ARG  24  -3.185  -2.740  -3.848
  133   HH12  ARG  24          HH22      ARG  24  -2.452  -4.108  -3.080
  134   HH21  ARG  24          HH11      ARG  24   0.560  -2.497  -2.485
  135   HH22  ARG  24          HH12      ARG  24  -0.333  -3.971  -2.308
  136    H    CYS  25           HN       CYS  25  -1.947   4.205  -7.259
  137    HA   CYS  25           HA       CYS  25  -3.395   2.619  -9.217
  138    HB2  CYS  25           HB2      CYS  25  -4.676   4.331  -8.174
  139    HB3  CYS  25           HB1      CYS  25  -3.433   5.543  -8.471
  140    HA   PRO  26           HA       PRO  26  -0.322   3.510 -12.366
  141    HB2  PRO  26           HB2      PRO  26  -1.669   2.698 -14.589
  142    HB3  PRO  26           HB1      PRO  26  -1.044   1.549 -13.388
  143    HG2  PRO  26           HG2      PRO  26  -3.821   2.609 -13.715
  144    HG3  PRO  26           HG1      PRO  26  -3.282   0.948 -13.401
  145    HD2  PRO  26           HD2      PRO  26  -4.208   2.595 -11.418
  146    HD3  PRO  26           HD1      PRO  26  -2.997   1.328 -11.125
  147    H    TYR  27           HN       TYR  27  -2.494   5.524 -11.498
  148    HA   TYR  27           HA       TYR  27  -2.030   7.413 -13.681
  149    HB2  TYR  27           HB2      TYR  27  -4.818   6.735 -12.710
  150    HB3  TYR  27           HB1      TYR  27  -4.405   8.028 -13.835
  151    HD1  TYR  27           HD2      TYR  27  -2.833   7.212 -15.868
  152    HD2  TYR  27           HD1      TYR  27  -5.528   4.707 -13.646
  153    HE1  TYR  27           HE2      TYR  27  -2.905   5.610 -17.758
  154    HE2  TYR  27           HE1      TYR  27  -5.597   3.107 -15.539
  155    HH   TYR  27           HH       TYR  27  -4.293   3.868 -18.639
  156    H    LYS  28           HN       LYS  28  -0.950   7.314 -11.094
  157    HA   LYS  28           HA       LYS  28  -2.427   9.085  -9.363
  158    HB2  LYS  28           HB2      LYS  28  -0.090   9.123  -8.160
  159    HB3  LYS  28           HB1      LYS  28  -1.064   7.657  -8.125
  160    HG2  LYS  28           HG2      LYS  28   1.343   7.248  -8.696
  161    HG3  LYS  28           HG1      LYS  28   0.225   6.678  -9.930
  162    HD2  LYS  28           HD2      LYS  28   0.692   8.538 -11.353
  163    HD3  LYS  28           HD1      LYS  28   1.508   9.415 -10.057
  164    HE2  LYS  28           HE2      LYS  28   3.308   7.763 -10.028
  165    HE3  LYS  28           HE1      LYS  28   2.476   6.800 -11.250
  166    HZ1  LYS  28           HZ1      LYS  28   2.566   9.205 -12.422
  167    HZ2  LYS  28           HZ2      LYS  28   3.723   7.985 -12.663
  168    HZ3  LYS  28           HZ3      LYS  28   4.018   9.230 -11.544
  169    H    ASP  29           HN       ASP  29  -1.404   9.809 -12.187
  170    HA   ASP  29           HA       ASP  29   0.462  11.898 -11.898
  171    HB2  ASP  29           HB2      ASP  29   0.187  12.140 -14.179
  172    HB3  ASP  29           HB1      ASP  29  -0.380  10.501 -13.956
  173    H    THR  30           HN       THR  30  -2.376  11.738 -10.505
  174    HA   THR  30           HA       THR  30  -3.534  14.298 -11.181
  175    HB   THR  30           HB       THR  30  -5.077  12.623 -10.494
  176    HG1  THR  30           HG1      THR  30  -5.426  13.629  -8.147
  177   HG21  THR  30          HG21      THR  30  -3.233  12.276  -8.121
  178   HG22  THR  30          HG22      THR  30  -3.634  11.084  -9.357
  179   HG23  THR  30          HG23      THR  30  -4.856  11.586  -8.189
  180    H    LEU  31           HN       LEU  31  -0.751  14.294 -10.234
  181    HA   LEU  31           HA       LEU  31  -0.459  15.109  -7.582
  182    HB2  LEU  31           HB2      LEU  31   1.038  15.741 -10.114
  183    HB3  LEU  31           HB1      LEU  31   1.479  16.556  -8.617
  184    HG   LEU  31           HG       LEU  31   2.787  14.445  -9.108
  185   HD11  LEU  31          HD11      LEU  31   1.252  13.945  -6.572
  186   HD12  LEU  31          HD12      LEU  31   2.164  15.446  -6.721
  187   HD13  LEU  31          HD13      LEU  31   2.987  13.898  -6.867
  188   HD21  LEU  31          HD21      LEU  31   0.706  13.266 -10.016
  189   HD22  LEU  31          HD22      LEU  31   0.241  13.007  -8.335
  190   HD23  LEU  31          HD23      LEU  31   1.739  12.311  -8.954
  191    H    GLY  32           HN       GLY  32  -2.191  16.592 -10.076
  192    HA2  GLY  32           HA2      GLY  32  -3.384  18.559 -10.171
  193    HA3  GLY  32           HA1      GLY  32  -3.084  18.730  -8.444
  Start of MODEL    6
    1    H1   LYS   9           HT1      LYS   9 -12.957  -6.727   2.088
    2    H2   LYS   9           HT2      LYS   9 -11.712  -7.103   3.183
    3    H3   LYS   9           HT3      LYS   9 -11.511  -7.414   1.525
    4    HA   LYS   9           HA       LYS   9 -11.652  -4.771   2.861
    5    HB2  LYS   9           HB2      LYS   9  -9.465  -5.883   2.943
    6    HB3  LYS   9           HB1      LYS   9  -9.525  -6.159   1.202
    7    HG2  LYS   9           HG2      LYS   9  -9.362  -3.838   0.717
    8    HG3  LYS   9           HG1      LYS   9  -9.736  -3.384   2.381
    9    HD2  LYS   9           HD2      LYS   9  -7.305  -3.160   1.843
   10    HD3  LYS   9           HD1      LYS   9  -7.614  -4.298   3.155
   11    HE2  LYS   9           HE2      LYS   9  -7.249  -6.180   1.759
   12    HE3  LYS   9           HE1      LYS   9  -7.390  -5.219   0.286
   13    HZ1  LYS   9           HZ1      LYS   9  -5.306  -4.467   2.186
   14    HZ2  LYS   9           HZ2      LYS   9  -5.297  -4.422   0.487
   15    HZ3  LYS   9           HZ3      LYS   9  -5.065  -5.895   1.302
   16    H    ILE  10           HN       ILE  10 -13.207  -3.700   1.726
   17    HA   ILE  10           HA       ILE  10 -13.544  -4.030  -1.119
   18    HB   ILE  10           HB       ILE  10 -14.713  -1.984   0.782
   19   HG12  ILE  10          HG12      ILE  10 -15.981  -4.479  -0.381
   20   HG13  ILE  10          HG11      ILE  10 -15.228  -4.435   1.214
   21   HG21  ILE  10          HG21      ILE  10 -15.308  -2.723  -2.093
   22   HG22  ILE  10          HG22      ILE  10 -14.883  -1.135  -1.453
   23   HG23  ILE  10          HG23      ILE  10 -16.453  -1.846  -1.077
   24   HD11  ILE  10          HD11      ILE  10 -17.728  -4.045   1.224
   25   HD12  ILE  10          HD12      ILE  10 -17.428  -2.536   0.360
   26   HD13  ILE  10          HD13      ILE  10 -16.784  -2.765   1.986
   27    H    VAL  11           HN       VAL  11 -11.417  -3.494  -1.862
   28    HA   VAL  11           HA       VAL  11 -10.365  -0.832  -1.429
   29    HB   VAL  11           HB       VAL  11  -8.826  -2.696  -1.724
   30   HG11  VAL  11          HG11      VAL  11  -9.870  -2.889  -4.561
   31   HG12  VAL  11          HG12      VAL  11 -10.386  -3.972  -3.269
   32   HG13  VAL  11          HG13      VAL  11  -8.698  -3.948  -3.777
   33   HG21  VAL  11          HG21      VAL  11  -7.348  -1.645  -3.286
   34   HG22  VAL  11          HG22      VAL  11  -8.304  -0.347  -2.574
   35   HG23  VAL  11          HG23      VAL  11  -8.691  -0.944  -4.187
   36    H    SER  12           HN       SER  12 -10.597   0.891  -2.613
   37    HA   SER  12           HA       SER  12 -11.560   0.723  -5.367
   38    HB2  SER  12           HB2      SER  12 -13.000   2.460  -3.366
   39    HB3  SER  12           HB1      SER  12 -13.413   2.177  -5.055
   40    HG   SER  12           HG       SER  12 -14.670   0.742  -4.076
   41    H    CYS  13           HN       CYS  13 -10.345   1.963  -6.498
   42    HA   CYS  13           HA       CYS  13  -8.459   3.790  -5.469
   43    HB2  CYS  13           HB2      CYS  13  -8.519   2.543  -7.748
   44    HB3  CYS  13           HB1      CYS  13  -9.485   3.910  -8.293
   45    H    ARG  14           HN       ARG  14  -8.699   6.026  -7.179
   46    HA   ARG  14           HA       ARG  14 -11.264   7.299  -6.558
   47    HB2  ARG  14           HB2      ARG  14  -8.629   8.366  -5.512
   48    HB3  ARG  14           HB1      ARG  14 -10.179   9.204  -5.429
   49    HG2  ARG  14           HG2      ARG  14 -11.070   7.161  -4.188
   50    HG3  ARG  14           HG1      ARG  14  -9.394   6.626  -4.056
   51    HD2  ARG  14           HD2      ARG  14 -10.117   7.892  -2.050
   52    HD3  ARG  14           HD1      ARG  14  -8.794   8.692  -2.893
   53    HE   ARG  14           HE       ARG  14 -10.232  10.455  -3.348
   54   HH11  ARG  14          HH21      ARG  14 -11.996   7.621  -2.439
   55   HH12  ARG  14          HH22      ARG  14 -13.529   8.425  -2.380
   56   HH21  ARG  14          HH11      ARG  14 -12.238  11.518  -3.272
   57   HH22  ARG  14          HH12      ARG  14 -13.666  10.632  -2.852
   58    H    ILE  15           HN       ILE  15  -9.210   6.562  -8.812
   59    HA   ILE  15           HA       ILE  15  -9.484   9.135 -10.264
   60    HB   ILE  15           HB       ILE  15  -7.111   7.259 -10.436
   61   HG12  ILE  15          HG12      ILE  15  -7.139  10.050  -9.260
   62   HG13  ILE  15          HG11      ILE  15  -7.368   8.617  -8.259
   63   HG21  ILE  15          HG21      ILE  15  -7.785   9.934 -11.684
   64   HG22  ILE  15          HG22      ILE  15  -7.455   8.412 -12.513
   65   HG23  ILE  15          HG23      ILE  15  -6.155   9.261 -11.675
   66   HD11  ILE  15          HD11      ILE  15  -5.223   7.704  -9.101
   67   HD12  ILE  15          HD12      ILE  15  -5.004   9.245  -8.270
   68   HD13  ILE  15          HD13      ILE  15  -4.978   9.181 -10.033
   69    H    CYS  16           HN       CYS  16  -9.252   5.629 -10.346
   70    HA   CYS  16           HA       CYS  16 -10.638   5.612 -12.963
   71    HB2  CYS  16           HB2      CYS  16  -9.258   3.799 -13.717
   72    HB3  CYS  16           HB1      CYS  16  -8.182   5.080 -13.160
   73    H    LYS  17           HN       LYS  17 -10.356   4.448  -9.744
   74    HA   LYS  17           HA       LYS  17 -11.621   2.993  -8.507
   75    HB2  LYS  17           HB2      LYS  17 -13.581   3.007 -10.800
   76    HB3  LYS  17           HB1      LYS  17 -13.905   2.751  -9.087
   77    HG2  LYS  17           HG2      LYS  17 -13.241   5.069  -8.596
   78    HG3  LYS  17           HG1      LYS  17 -12.893   5.338 -10.304
   79    HD2  LYS  17           HD2      LYS  17 -15.179   5.107 -10.918
   80    HD3  LYS  17           HD1      LYS  17 -15.609   4.420  -9.351
   81    HE2  LYS  17           HE2      LYS  17 -14.495   7.216  -9.629
   82    HE3  LYS  17           HE1      LYS  17 -16.224   6.880  -9.710
   83    HZ1  LYS  17           HZ1      LYS  17 -14.387   6.335  -7.447
   84    HZ2  LYS  17           HZ2      LYS  17 -15.971   5.725  -7.532
   85    HZ3  LYS  17           HZ3      LYS  17 -15.704   7.403  -7.474
   86    H    GLY  18           HN       GLY  18  -9.574   1.832  -9.906
   87    HA2  GLY  18           HA2      GLY  18 -10.533  -0.464 -11.397
   88    HA3  GLY  18           HA1      GLY  18  -8.859  -0.102 -10.988
   89    H    ASP  19           HN       ASP  19  -7.997  -1.628  -9.746
   90    HA   ASP  19           HA       ASP  19  -9.613  -2.790  -7.546
   91    HB2  ASP  19           HB2      ASP  19  -8.675  -4.958  -7.985
   92    HB3  ASP  19           HB1      ASP  19  -9.351  -4.351  -9.495
   93    H    HIS  20           HN       HIS  20  -7.943  -0.588  -7.187
   94    HA   HIS  20           HA       HIS  20  -6.075  -1.659  -5.260
   95    HB2  HIS  20           HB2      HIS  20  -4.240  -0.121  -6.286
   96    HB3  HIS  20           HB1      HIS  20  -4.506  -1.696  -7.012
   97    HD2  HIS  20           HD2      HIS  20  -6.058   1.923  -7.711
   98    HE1  HIS  20           HE1      HIS  20  -5.389  -0.056 -11.380
   99    H    TRP  21           HN       TRP  21  -4.679   0.580  -4.690
  100    HA   TRP  21           HA       TRP  21  -6.753   2.397  -3.664
  101    HB2  TRP  21           HB2      TRP  21  -3.869   1.876  -2.928
  102    HB3  TRP  21           HB1      TRP  21  -4.755   3.264  -2.301
  103    HD1  TRP  21           HD1      TRP  21  -5.090  -0.585  -2.466
  104    HE1  TRP  21           HE1      TRP  21  -6.337  -1.374  -0.352
  105    HE3  TRP  21           HE3      TRP  21  -6.139   3.931  -0.323
  106    HZ2  TRP  21           HZ2      TRP  21  -7.611  -0.240   1.945
  107    HZ3  TRP  21           HZ3      TRP  21  -7.369   4.048   1.826
  108    HH2  TRP  21           HH2      TRP  21  -8.105   1.970   2.961
  109    H    THR  22           HN       THR  22  -5.671   4.737  -3.360
  110    HA   THR  22           HA       THR  22  -5.319   5.735  -6.059
  111    HB   THR  22           HB       THR  22  -5.130   7.366  -3.527
  112    HG1  THR  22           HG1      THR  22  -7.081   5.803  -4.035
  113   HG21  THR  22          HG21      THR  22  -6.108   7.923  -6.342
  114   HG22  THR  22          HG22      THR  22  -4.619   8.524  -5.615
  115   HG23  THR  22          HG23      THR  22  -6.180   9.073  -5.008
  116    H    THR  23           HN       THR  23  -3.283   4.506  -3.720
  117    HA   THR  23           HA       THR  23  -1.037   6.285  -4.140
  118    HB   THR  23           HB       THR  23  -0.975   3.544  -2.882
  119    HG1  THR  23           HG1      THR  23  -1.562   6.042  -1.677
  120   HG21  THR  23          HG21      THR  23   0.963   4.360  -1.755
  121   HG22  THR  23          HG22      THR  23   0.634   6.022  -2.247
  122   HG23  THR  23          HG23      THR  23   1.155   4.834  -3.443
  123    H    ARG  24           HN       ARG  24  -1.639   2.828  -4.851
  124    HA   ARG  24           HA       ARG  24   0.569   2.826  -6.776
  125    HB2  ARG  24           HB2      ARG  24   0.298   0.446  -6.843
  126    HB3  ARG  24           HB1      ARG  24   0.160   0.929  -5.151
  127    HG2  ARG  24           HG2      ARG  24  -2.361   1.017  -5.522
  128    HG3  ARG  24           HG1      ARG  24  -2.064   0.183  -7.050
  129    HD2  ARG  24           HD2      ARG  24  -1.391  -0.803  -4.268
  130    HD3  ARG  24           HD1      ARG  24  -2.556  -1.499  -5.390
  131    HE   ARG  24           HE       ARG  24  -0.217  -1.610  -6.779
  132   HH11  ARG  24          HH21      ARG  24  -1.211  -2.564  -3.606
  133   HH12  ARG  24          HH22      ARG  24  -0.106  -3.894  -3.509
  134   HH21  ARG  24          HH11      ARG  24   1.236  -3.351  -6.661
  135   HH22  ARG  24          HH12      ARG  24   1.280  -4.339  -5.238
  136    H    CYS  25           HN       CYS  25  -2.048   4.297  -7.202
  137    HA   CYS  25           HA       CYS  25  -3.489   2.921  -9.223
  138    HB2  CYS  25           HB2      CYS  25  -4.564   4.708  -8.030
  139    HB3  CYS  25           HB1      CYS  25  -3.318   5.853  -8.521
  140    HA   PRO  26           HA       PRO  26  -0.528   3.688 -12.511
  141    HB2  PRO  26           HB2      PRO  26  -1.998   2.906 -14.663
  142    HB3  PRO  26           HB1      PRO  26  -1.360   1.744 -13.479
  143    HG2  PRO  26           HG2      PRO  26  -4.111   2.899 -13.695
  144    HG3  PRO  26           HG1      PRO  26  -3.617   1.222 -13.391
  145    HD2  PRO  26           HD2      PRO  26  -4.396   2.914 -11.384
  146    HD3  PRO  26           HD1      PRO  26  -3.221   1.604 -11.133
  147    H    TYR  27           HN       TYR  27  -2.491   5.817 -11.545
  148    HA   TYR  27           HA       TYR  27  -2.130   7.632 -13.811
  149    HB2  TYR  27           HB2      TYR  27  -4.841   7.057 -12.590
  150    HB3  TYR  27           HB1      TYR  27  -4.495   8.395 -13.685
  151    HD1  TYR  27           HD2      TYR  27  -3.428   7.807 -15.976
  152    HD2  TYR  27           HD1      TYR  27  -5.410   4.940 -13.464
  153    HE1  TYR  27           HE2      TYR  27  -3.729   6.305 -17.926
  154    HE2  TYR  27           HE1      TYR  27  -5.710   3.439 -15.415
  155    HH   TYR  27           HH       TYR  27  -4.507   4.362 -18.646
  156    H    LYS  28           HN       LYS  28  -0.871   7.470 -11.264
  157    HA   LYS  28           HA       LYS  28  -2.068   9.362  -9.475
  158    HB2  LYS  28           HB2      LYS  28  -0.109   9.093  -8.138
  159    HB3  LYS  28           HB1      LYS  28  -0.491   7.507  -8.797
  160    HG2  LYS  28           HG2      LYS  28   1.613   9.411  -9.888
  161    HG3  LYS  28           HG1      LYS  28   1.921   7.959  -8.949
  162    HD2  LYS  28           HD2      LYS  28   0.638   6.692 -10.779
  163    HD3  LYS  28           HD1      LYS  28   0.806   8.160 -11.747
  164    HE2  LYS  28           HE2      LYS  28   2.676   6.815 -12.332
  165    HE3  LYS  28           HE1      LYS  28   3.310   8.035 -11.228
  166    HZ1  LYS  28           HZ1      LYS  28   2.309   5.607  -9.992
  167    HZ2  LYS  28           HZ2      LYS  28   3.693   6.523  -9.630
  168    HZ3  LYS  28           HZ3      LYS  28   3.713   5.424 -10.925
  169    H    ASP  29           HN       ASP  29  -1.386  10.069 -12.363
  170    HA   ASP  29           HA       ASP  29   0.667  11.971 -12.385
  171    HB2  ASP  29           HB2      ASP  29  -0.079  12.424 -14.542
  172    HB3  ASP  29           HB1      ASP  29  -0.630  10.784 -14.292
  173    H    THR  30           HN       THR  30  -1.977  11.999 -10.560
  174    HA   THR  30           HA       THR  30  -1.851  14.867 -10.105
  175    HB   THR  30           HB       THR  30  -3.521  14.868 -11.832
  176    HG1  THR  30           HG1      THR  30  -4.437  16.187 -10.486
  177   HG21  THR  30          HG21      THR  30  -4.924  12.707 -10.237
  178   HG22  THR  30          HG22      THR  30  -4.027  12.439 -11.731
  179   HG23  THR  30          HG23      THR  30  -5.492  13.420 -11.747
  180    H    LEU  31           HN       LEU  31  -0.969  13.043  -8.376
  181    HA   LEU  31           HA       LEU  31  -2.914  11.996  -6.586
  182    HB2  LEU  31           HB2      LEU  31  -0.495  11.249  -6.812
  183    HB3  LEU  31           HB1      LEU  31  -0.054  12.703  -5.921
  184    HG   LEU  31           HG       LEU  31  -1.849  11.848  -4.177
  185   HD11  LEU  31          HD11      LEU  31  -1.111   9.315  -5.680
  186   HD12  LEU  31          HD12      LEU  31  -2.729   9.981  -5.465
  187   HD13  LEU  31          HD13      LEU  31  -1.851   9.337  -4.081
  188   HD21  LEU  31          HD21      LEU  31   0.535  12.052  -3.674
  189   HD22  LEU  31          HD22      LEU  31   0.871  10.549  -4.534
  190   HD23  LEU  31          HD23      LEU  31  -0.068  10.519  -3.042
  191    H    GLY  32           HN       GLY  32  -4.350  13.732  -6.163
  192    HA2  GLY  32           HA2      GLY  32  -3.816  16.286  -5.327
  193    HA3  GLY  32           HA1      GLY  32  -5.179  15.344  -4.729
  Start of MODEL    7
    1    H1   LYS   9           HT1      LYS   9 -11.127  -4.041   4.153
    2    H2   LYS   9           HT2      LYS   9 -11.156  -5.738   4.065
    3    H3   LYS   9           HT3      LYS   9 -12.365  -4.823   3.297
    4    HA   LYS   9           HA       LYS   9  -9.621  -4.259   2.507
    5    HB2  LYS   9           HB2      LYS   9  -9.792  -6.215   0.868
    6    HB3  LYS   9           HB1      LYS   9  -9.441  -6.641   2.544
    7    HG2  LYS   9           HG2      LYS   9 -11.783  -7.185   2.943
    8    HG3  LYS   9           HG1      LYS   9 -12.214  -6.650   1.318
    9    HD2  LYS   9           HD2      LYS   9 -10.753  -8.407   0.362
   10    HD3  LYS   9           HD1      LYS   9 -10.364  -8.958   1.992
   11    HE2  LYS   9           HE2      LYS   9 -12.617  -9.636   2.405
   12    HE3  LYS   9           HE1      LYS   9 -13.207  -8.790   0.975
   13    HZ1  LYS   9           HZ1      LYS   9 -12.414 -10.388  -0.418
   14    HZ2  LYS   9           HZ2      LYS   9 -12.752 -11.353   0.938
   15    HZ3  LYS   9           HZ3      LYS   9 -11.159 -10.854   0.623
   16    H    ILE  10           HN       ILE  10 -12.091  -2.819   2.532
   17    HA   ILE  10           HA       ILE  10 -13.382  -3.024  -0.021
   18    HB   ILE  10           HB       ILE  10 -13.400  -0.609   1.787
   19   HG12  ILE  10          HG12      ILE  10 -13.853  -2.483   3.240
   20   HG13  ILE  10          HG11      ILE  10 -15.400  -1.727   2.862
   21   HG21  ILE  10          HG21      ILE  10 -14.475  -0.432  -0.442
   22   HG22  ILE  10          HG22      ILE  10 -15.655  -0.332   0.864
   23   HG23  ILE  10          HG23      ILE  10 -15.481  -1.828  -0.054
   24   HD11  ILE  10          HD11      ILE  10 -14.252  -4.290   1.751
   25   HD12  ILE  10          HD12      ILE  10 -15.563  -3.438   0.937
   26   HD13  ILE  10          HD13      ILE  10 -15.792  -4.049   2.575
   27    H    VAL  11           HN       VAL  11 -11.266  -3.035  -1.218
   28    HA   VAL  11           HA       VAL  11  -9.859  -0.516  -1.460
   29    HB   VAL  11           HB       VAL  11  -8.629  -2.595  -1.736
   30   HG11  VAL  11          HG11      VAL  11  -9.095  -4.162  -3.481
   31   HG12  VAL  11          HG12      VAL  11 -10.242  -3.066  -4.250
   32   HG13  VAL  11          HG13      VAL  11 -10.646  -3.827  -2.712
   33   HG21  VAL  11          HG21      VAL  11  -7.432  -2.005  -3.725
   34   HG22  VAL  11          HG22      VAL  11  -8.059  -0.494  -3.066
   35   HG23  VAL  11          HG23      VAL  11  -8.860  -1.258  -4.440
   36    H    SER  12           HN       SER  12 -10.239   1.060  -2.776
   37    HA   SER  12           HA       SER  12 -11.528   0.696  -5.327
   38    HB2  SER  12           HB2      SER  12 -13.350   2.343  -4.807
   39    HB3  SER  12           HB1      SER  12 -13.544   0.766  -4.048
   40    HG   SER  12           HG       SER  12 -12.619   3.187  -2.899
   41    H    CYS  13           HN       CYS  13 -10.508   1.966  -6.618
   42    HA   CYS  13           HA       CYS  13  -8.854   4.132  -5.688
   43    HB2  CYS  13           HB2      CYS  13  -8.263   2.598  -7.595
   44    HB3  CYS  13           HB1      CYS  13  -9.513   3.395  -8.543
   45    H    ARG  14           HN       ARG  14  -8.963   6.318  -6.653
   46    HA   ARG  14           HA       ARG  14 -11.787   7.201  -6.986
   47    HB2  ARG  14           HB2      ARG  14 -11.167   9.286  -5.946
   48    HB3  ARG  14           HB1      ARG  14 -10.632   7.973  -4.898
   49    HG2  ARG  14           HG2      ARG  14  -8.367   8.140  -6.052
   50    HG3  ARG  14           HG1      ARG  14  -8.946   9.639  -6.779
   51    HD2  ARG  14           HD2      ARG  14  -7.665  10.047  -4.687
   52    HD3  ARG  14           HD1      ARG  14  -9.331  10.604  -4.570
   53    HE   ARG  14           HE       ARG  14  -9.047   7.918  -3.615
   54   HH11  ARG  14          HH21      ARG  14  -8.547  11.256  -2.858
   55   HH12  ARG  14          HH22      ARG  14  -8.675  11.031  -1.146
   56   HH21  ARG  14          HH11      ARG  14  -9.216   7.613  -1.369
   57   HH22  ARG  14          HH12      ARG  14  -9.055   8.968  -0.303
   58    H    ILE  15           HN       ILE  15  -8.784   6.892  -8.487
   59    HA   ILE  15           HA       ILE  15  -9.115   9.177 -10.282
   60    HB   ILE  15           HB       ILE  15  -7.034   6.979 -10.265
   61   HG12  ILE  15          HG12      ILE  15  -6.686   9.831  -9.317
   62   HG13  ILE  15          HG11      ILE  15  -7.207   8.558  -8.215
   63   HG21  ILE  15          HG21      ILE  15  -7.338   9.578 -11.778
   64   HG22  ILE  15          HG22      ILE  15  -7.078   7.961 -12.431
   65   HG23  ILE  15          HG23      ILE  15  -5.774   8.789 -11.581
   66   HD11  ILE  15          HD11      ILE  15  -4.742   8.263  -9.934
   67   HD12  ILE  15          HD12      ILE  15  -5.200   7.325  -8.514
   68   HD13  ILE  15          HD13      ILE  15  -4.683   9.002  -8.333
   69    H    CYS  16           HN       CYS  16  -9.391   5.666 -10.293
   70    HA   CYS  16           HA       CYS  16 -10.835   5.802 -12.853
   71    HB2  CYS  16           HB2      CYS  16  -9.548   4.073 -13.851
   72    HB3  CYS  16           HB1      CYS  16  -8.385   5.230 -13.202
   73    H    LYS  17           HN       LYS  17 -10.537   4.573  -9.693
   74    HA   LYS  17           HA       LYS  17 -11.803   3.095  -8.477
   75    HB2  LYS  17           HB2      LYS  17 -13.721   3.084 -10.805
   76    HB3  LYS  17           HB1      LYS  17 -14.071   2.818  -9.100
   77    HG2  LYS  17           HG2      LYS  17 -13.462   5.142  -8.587
   78    HG3  LYS  17           HG1      LYS  17 -13.071   5.424 -10.284
   79    HD2  LYS  17           HD2      LYS  17 -15.333   5.165 -10.962
   80    HD3  LYS  17           HD1      LYS  17 -15.798   4.462  -9.412
   81    HE2  LYS  17           HE2      LYS  17 -16.437   6.916  -9.776
   82    HE3  LYS  17           HE1      LYS  17 -15.573   6.549  -8.283
   83    HZ1  LYS  17           HZ1      LYS  17 -13.545   7.300  -9.240
   84    HZ2  LYS  17           HZ2      LYS  17 -14.710   8.507  -9.509
   85    HZ3  LYS  17           HZ3      LYS  17 -14.249   7.469 -10.773
   86    H    GLY  18           HN       GLY  18  -9.718   2.023 -10.023
   87    HA2  GLY  18           HA2      GLY  18 -10.699  -0.372 -11.354
   88    HA3  GLY  18           HA1      GLY  18  -9.015   0.103 -11.154
   89    H    ASP  19           HN       ASP  19  -8.002  -1.481 -10.094
   90    HA   ASP  19           HA       ASP  19  -9.245  -2.574  -7.626
   91    HB2  ASP  19           HB2      ASP  19  -8.194  -4.707  -8.119
   92    HB3  ASP  19           HB1      ASP  19  -9.197  -4.219  -9.483
   93    H    HIS  20           HN       HIS  20  -7.985  -0.583  -6.831
   94    HA   HIS  20           HA       HIS  20  -5.744  -1.429  -5.392
   95    HB2  HIS  20           HB2      HIS  20  -4.059   0.132  -6.555
   96    HB3  HIS  20           HB1      HIS  20  -4.393  -1.409  -7.337
   97    HD2  HIS  20           HD2      HIS  20  -5.947   2.255  -7.679
   98    HE1  HIS  20           HE1      HIS  20  -5.787   0.435 -11.485
   99    H    TRP  21           HN       TRP  21  -4.900   0.233  -4.054
  100    HA   TRP  21           HA       TRP  21  -6.745   2.032  -3.030
  101    HB2  TRP  21           HB2      TRP  21  -3.736   1.886  -2.874
  102    HB3  TRP  21           HB1      TRP  21  -4.620   3.174  -2.061
  103    HD1  TRP  21           HD1      TRP  21  -4.910  -0.688  -2.316
  104    HE1  TRP  21           HE1      TRP  21  -5.501  -1.596   0.024
  105    HE3  TRP  21           HE3      TRP  21  -5.198   3.697   0.283
  106    HZ2  TRP  21           HZ2      TRP  21  -6.027  -0.593   2.652
  107    HZ3  TRP  21           HZ3      TRP  21  -5.745   3.693   2.700
  108    HH2  TRP  21           HH2      TRP  21  -6.160   1.556   3.886
  109    H    THR  22           HN       THR  22  -3.987   3.880  -3.602
  110    HA   THR  22           HA       THR  22  -5.013   5.217  -5.996
  111    HB   THR  22           HB       THR  22  -4.836   7.448  -4.763
  112    HG1  THR  22           HG1      THR  22  -4.497   7.396  -2.697
  113   HG21  THR  22          HG21      THR  22  -6.979   6.357  -5.432
  114   HG22  THR  22          HG22      THR  22  -7.127   7.307  -3.955
  115   HG23  THR  22          HG23      THR  22  -7.019   5.549  -3.865
  116    H    THR  23           HN       THR  23  -2.624   5.165  -3.374
  117    HA   THR  23           HA       THR  23  -0.640   6.659  -4.738
  118    HB   THR  23           HB       THR  23  -0.140   6.503  -2.482
  119    HG1  THR  23           HG1      THR  23   1.773   5.881  -3.139
  120   HG21  THR  23          HG21      THR  23  -0.266   4.217  -1.297
  121   HG22  THR  23          HG22      THR  23  -1.158   3.676  -2.718
  122   HG23  THR  23          HG23      THR  23  -1.789   4.993  -1.729
  123    H    ARG  24           HN       ARG  24  -1.805   3.444  -5.041
  124    HA   ARG  24           HA       ARG  24   0.549   2.622  -6.646
  125    HB2  ARG  24           HB2      ARG  24  -0.817   0.339  -6.486
  126    HB3  ARG  24           HB1      ARG  24   0.211   0.878  -5.157
  127    HG2  ARG  24           HG2      ARG  24  -1.645   1.730  -3.928
  128    HG3  ARG  24           HG1      ARG  24  -2.722   1.589  -5.317
  129    HD2  ARG  24           HD2      ARG  24  -3.149  -0.265  -3.797
  130    HD3  ARG  24           HD1      ARG  24  -2.398  -0.887  -5.263
  131    HE   ARG  24           HE       ARG  24  -0.508  -1.445  -4.012
  132   HH11  ARG  24          HH21      ARG  24  -2.673   0.578  -2.225
  133   HH12  ARG  24          HH22      ARG  24  -1.842   0.374  -0.720
  134   HH21  ARG  24          HH11      ARG  24   0.587  -1.719  -2.042
  135   HH22  ARG  24          HH12      ARG  24   0.004  -0.927  -0.616
  136    H    CYS  25           HN       CYS  25  -2.393   4.065  -7.075
  137    HA   CYS  25           HA       CYS  25  -3.527   2.619  -9.209
  138    HB2  CYS  25           HB2      CYS  25  -4.874   4.279  -8.153
  139    HB3  CYS  25           HB1      CYS  25  -3.680   5.539  -8.448
  140    HA   PRO  26           HA       PRO  26  -0.446   3.618 -12.309
  141    HB2  PRO  26           HB2      PRO  26  -1.740   2.789 -14.559
  142    HB3  PRO  26           HB1      PRO  26  -1.096   1.649 -13.358
  143    HG2  PRO  26           HG2      PRO  26  -3.899   2.631 -13.712
  144    HG3  PRO  26           HG1      PRO  26  -3.316   0.984 -13.404
  145    HD2  PRO  26           HD2      PRO  26  -4.314   2.580 -11.420
  146    HD3  PRO  26           HD1      PRO  26  -3.064   1.353 -11.122
  147    H    TYR  27           HN       TYR  27  -2.521   5.647 -11.428
  148    HA   TYR  27           HA       TYR  27  -2.155   7.486 -13.673
  149    HB2  TYR  27           HB2      TYR  27  -4.890   6.841 -12.545
  150    HB3  TYR  27           HB1      TYR  27  -4.535   8.136 -13.687
  151    HD1  TYR  27           HD2      TYR  27  -3.109   7.347 -15.815
  152    HD2  TYR  27           HD1      TYR  27  -5.616   4.796 -13.434
  153    HE1  TYR  27           HE2      TYR  27  -3.282   5.751 -17.704
  154    HE2  TYR  27           HE1      TYR  27  -5.788   3.201 -15.324
  155    HH   TYR  27           HH       TYR  27  -4.651   3.993 -18.504
  156    H    LYS  28           HN       LYS  28  -1.092   7.273 -10.972
  157    HA   LYS  28           HA       LYS  28  -2.425   9.192  -9.310
  158    HB2  LYS  28           HB2      LYS  28  -0.088   9.139  -8.113
  159    HB3  LYS  28           HB1      LYS  28  -1.125   7.717  -8.054
  160    HG2  LYS  28           HG2      LYS  28   1.266   7.201  -8.621
  161    HG3  LYS  28           HG1      LYS  28   0.119   6.654  -9.837
  162    HD2  LYS  28           HD2      LYS  28   0.652   8.459 -11.300
  163    HD3  LYS  28           HD1      LYS  28   1.517   9.326 -10.028
  164    HE2  LYS  28           HE2      LYS  28   3.309   7.758 -10.040
  165    HE3  LYS  28           HE1      LYS  28   2.386   6.598 -10.996
  166    HZ1  LYS  28           HZ1      LYS  28   2.738   7.743 -12.905
  167    HZ2  LYS  28           HZ2      LYS  28   4.152   8.203 -12.081
  168    HZ3  LYS  28           HZ3      LYS  28   2.817   9.252 -12.136
  169    H    ASP  29           HN       ASP  29  -1.450   9.851 -12.143
  170    HA   ASP  29           HA       ASP  29   0.584  11.729 -12.067
  171    HB2  ASP  29           HB2      ASP  29  -0.099  12.258 -14.229
  172    HB3  ASP  29           HB1      ASP  29  -0.692  10.625 -14.033
  173    H    THR  30           HN       THR  30  -2.227  11.818 -10.416
  174    HA   THR  30           HA       THR  30  -2.857  14.630 -10.648
  175    HB   THR  30           HB       THR  30  -4.456  14.180  -8.832
  176    HG1  THR  30           HG1      THR  30  -4.325  11.599  -8.590
  177   HG21  THR  30          HG21      THR  30  -5.221  13.671 -11.055
  178   HG22  THR  30          HG22      THR  30  -5.739  12.346 -10.012
  179   HG23  THR  30          HG23      THR  30  -4.340  12.143 -11.067
  180    H    LEU  31           HN       LEU  31  -2.293  12.897  -7.614
  181    HA   LEU  31           HA       LEU  31  -1.398  14.976  -6.096
  182    HB2  LEU  31           HB2      LEU  31   0.052  12.370  -5.759
  183    HB3  LEU  31           HB1      LEU  31  -0.685  13.415  -4.545
  184    HG   LEU  31           HG       LEU  31  -2.938  12.726  -5.839
  185   HD11  LEU  31          HD11      LEU  31  -2.907  10.595  -6.842
  186   HD12  LEU  31          HD12      LEU  31  -1.348  10.174  -6.133
  187   HD13  LEU  31          HD13      LEU  31  -1.430  11.337  -7.454
  188   HD21  LEU  31          HD21      LEU  31  -2.575  12.312  -3.468
  189   HD22  LEU  31          HD22      LEU  31  -1.456  10.997  -3.830
  190   HD23  LEU  31          HD23      LEU  31  -3.170  10.828  -4.212
  191    H    GLY  32           HN       GLY  32   0.782  12.742  -7.843
  192    HA2  GLY  32           HA2      GLY  32   3.054  14.481  -7.442
  193    HA3  GLY  32           HA1      GLY  32   3.030  12.985  -8.372
  Start of MODEL    8
    1    H1   LYS   9           HT1      LYS   9  -9.837  -4.902   2.902
    2    H2   LYS   9           HT2      LYS   9  -8.407  -5.385   2.125
    3    H3   LYS   9           HT3      LYS   9  -9.189  -6.441   3.200
    4    HA   LYS   9           HA       LYS   9  -9.455  -6.698   0.626
    5    HB2  LYS   9           HB2      LYS   9 -11.926  -7.447   1.203
    6    HB3  LYS   9           HB1      LYS   9 -10.559  -8.292   1.924
    7    HG2  LYS   9           HG2      LYS   9 -12.267  -7.757   3.620
    8    HG3  LYS   9           HG1      LYS   9 -10.758  -6.911   3.958
    9    HD2  LYS   9           HD2      LYS   9 -11.618  -4.839   3.169
   10    HD3  LYS   9           HD1      LYS   9 -12.979  -5.623   2.367
   11    HE2  LYS   9           HE2      LYS   9 -13.489  -4.453   4.590
   12    HE3  LYS   9           HE1      LYS   9 -14.044  -6.120   4.437
   13    HZ1  LYS   9           HZ1      LYS   9 -11.760  -5.063   5.966
   14    HZ2  LYS   9           HZ2      LYS   9 -11.766  -6.682   5.451
   15    HZ3  LYS   9           HZ3      LYS   9 -12.993  -6.108   6.475
   16    H    ILE  10           HN       ILE  10 -11.789  -6.431  -0.558
   17    HA   ILE  10           HA       ILE  10 -12.786  -4.927  -2.007
   18    HB   ILE  10           HB       ILE  10 -13.576  -4.041   0.760
   19   HG12  ILE  10          HG12      ILE  10 -15.125  -5.607  -1.312
   20   HG13  ILE  10          HG11      ILE  10 -14.108  -6.379  -0.095
   21   HG21  ILE  10          HG21      ILE  10 -14.101  -2.149  -0.588
   22   HG22  ILE  10          HG22      ILE  10 -15.602  -3.073  -0.521
   23   HG23  ILE  10          HG23      ILE  10 -14.576  -3.159  -1.953
   24   HD11  ILE  10          HD11      ILE  10 -15.412  -5.340   1.698
   25   HD12  ILE  10          HD12      ILE  10 -16.486  -6.240   0.626
   26   HD13  ILE  10          HD13      ILE  10 -16.396  -4.483   0.511
   27    H    VAL  11           HN       VAL  11 -11.118  -3.842  -3.033
   28    HA   VAL  11           HA       VAL  11 -10.246  -1.265  -1.848
   29    HB   VAL  11           HB       VAL  11  -8.402  -2.793  -2.282
   30   HG11  VAL  11          HG11      VAL  11  -7.970  -3.717  -4.450
   31   HG12  VAL  11          HG12      VAL  11  -9.227  -2.727  -5.192
   32   HG13  VAL  11          HG13      VAL  11  -9.668  -4.045  -4.105
   33   HG21  VAL  11          HG21      VAL  11  -8.413  -0.720  -4.482
   34   HG22  VAL  11          HG22      VAL  11  -7.041  -1.292  -3.534
   35   HG23  VAL  11          HG23      VAL  11  -8.270  -0.276  -2.782
   36    H    SER  12           HN       SER  12 -10.690   0.562  -2.810
   37    HA   SER  12           HA       SER  12 -11.717   0.544  -5.583
   38    HB2  SER  12           HB2      SER  12 -12.912   2.230  -3.389
   39    HB3  SER  12           HB1      SER  12 -13.489   2.023  -5.039
   40    HG   SER  12           HG       SER  12 -14.615   0.440  -4.238
   41    H    CYS  13           HN       CYS  13 -10.541   1.775  -6.756
   42    HA   CYS  13           HA       CYS  13  -8.635   3.639  -5.710
   43    HB2  CYS  13           HB2      CYS  13  -8.446   2.252  -7.857
   44    HB3  CYS  13           HB1      CYS  13  -9.510   3.451  -8.587
   45    H    ARG  14           HN       ARG  14  -8.544   5.926  -6.269
   46    HA   ARG  14           HA       ARG  14 -11.244   7.158  -6.409
   47    HB2  ARG  14           HB2      ARG  14  -9.619   7.385  -4.317
   48    HB3  ARG  14           HB1      ARG  14  -8.869   8.634  -5.307
   49    HG2  ARG  14           HG2      ARG  14 -11.237   9.581  -5.626
   50    HG3  ARG  14           HG1      ARG  14 -11.726   8.503  -4.318
   51    HD2  ARG  14           HD2      ARG  14 -11.207  10.582  -3.272
   52    HD3  ARG  14           HD1      ARG  14  -9.833   9.529  -2.946
   53    HE   ARG  14           HE       ARG  14  -9.523  11.129  -5.334
   54   HH11  ARG  14          HH21      ARG  14  -9.185  10.964  -1.894
   55   HH12  ARG  14          HH22      ARG  14  -7.947  12.171  -1.819
   56   HH21  ARG  14          HH11      ARG  14  -7.899  12.715  -5.243
   57   HH22  ARG  14          HH12      ARG  14  -7.219  13.164  -3.715
   58    H    ILE  15           HN       ILE  15  -9.274   6.381  -8.592
   59    HA   ILE  15           HA       ILE  15  -9.189   9.030  -9.928
   60    HB   ILE  15           HB       ILE  15  -7.081   6.861 -10.100
   61   HG12  ILE  15          HG12      ILE  15  -6.792   9.663  -8.993
   62   HG13  ILE  15          HG11      ILE  15  -7.194   8.287  -7.966
   63   HG21  ILE  15          HG21      ILE  15  -7.266   7.995 -12.213
   64   HG22  ILE  15          HG22      ILE  15  -5.871   8.686 -11.382
   65   HG23  ILE  15          HG23      ILE  15  -7.399   9.567 -11.423
   66   HD11  ILE  15          HD11      ILE  15  -5.152   7.119  -8.787
   67   HD12  ILE  15          HD12      ILE  15  -4.777   8.624  -7.946
   68   HD13  ILE  15          HD13      ILE  15  -4.729   8.562  -9.708
   69    H    CYS  16           HN       CYS  16  -9.249   5.505 -10.282
   70    HA   CYS  16           HA       CYS  16 -10.772   5.822 -12.800
   71    HB2  CYS  16           HB2      CYS  16  -9.533   3.994 -13.793
   72    HB3  CYS  16           HB1      CYS  16  -8.390   5.223 -13.252
   73    H    LYS  17           HN       LYS  17 -10.572   4.561  -9.696
   74    HA   LYS  17           HA       LYS  17 -11.820   3.054  -8.513
   75    HB2  LYS  17           HB2      LYS  17 -13.728   3.339 -10.842
   76    HB3  LYS  17           HB1      LYS  17 -14.113   2.745  -9.231
   77    HG2  LYS  17           HG2      LYS  17 -13.730   4.874  -8.234
   78    HG3  LYS  17           HG1      LYS  17 -12.947   5.493  -9.688
   79    HD2  LYS  17           HD2      LYS  17 -15.237   6.367  -9.521
   80    HD3  LYS  17           HD1      LYS  17 -15.090   5.297 -10.915
   81    HE2  LYS  17           HE2      LYS  17 -16.003   4.213  -8.253
   82    HE3  LYS  17           HE1      LYS  17 -17.144   5.005  -9.337
   83    HZ1  LYS  17           HZ1      LYS  17 -15.577   3.222 -10.828
   84    HZ2  LYS  17           HZ2      LYS  17 -17.250   3.169 -10.537
   85    HZ3  LYS  17           HZ3      LYS  17 -16.176   2.393  -9.475
   86    H    GLY  18           HN       GLY  18  -9.796   1.931 -10.065
   87    HA2  GLY  18           HA2      GLY  18 -10.892  -0.391 -11.458
   88    HA3  GLY  18           HA1      GLY  18  -9.190   0.029 -11.293
   89    H    ASP  19           HN       ASP  19  -8.003  -1.052  -9.841
   90    HA   ASP  19           HA       ASP  19  -9.268  -2.292  -7.507
   91    HB2  ASP  19           HB2      ASP  19  -9.134  -3.848  -9.648
   92    HB3  ASP  19           HB1      ASP  19  -7.451  -4.017  -9.169
   93    H    HIS  20           HN       HIS  20  -7.887  -0.286  -6.910
   94    HA   HIS  20           HA       HIS  20  -5.677  -1.104  -5.429
   95    HB2  HIS  20           HB2      HIS  20  -3.926   0.225  -6.854
   96    HB3  HIS  20           HB1      HIS  20  -4.310  -1.435  -7.299
   97    HD2  HIS  20           HD2      HIS  20  -5.728   2.136  -8.401
   98    HE1  HIS  20           HE1      HIS  20  -5.788  -0.485 -11.708
   99    H    TRP  21           HN       TRP  21  -5.030   0.505  -4.051
  100    HA   TRP  21           HA       TRP  21  -6.676   2.678  -3.566
  101    HB2  TRP  21           HB2      TRP  21  -3.777   2.209  -2.855
  102    HB3  TRP  21           HB1      TRP  21  -4.684   3.606  -2.274
  103    HD1  TRP  21           HD1      TRP  21  -5.069  -0.249  -2.332
  104    HE1  TRP  21           HE1      TRP  21  -6.221  -0.968  -0.140
  105    HE3  TRP  21           HE3      TRP  21  -5.873   4.328  -0.215
  106    HZ2  TRP  21           HZ2      TRP  21  -7.337   0.239   2.201
  107    HZ3  TRP  21           HZ3      TRP  21  -6.982   4.514   1.994
  108    HH2  TRP  21           HH2      TRP  21  -7.714   2.478   3.204
  109    H    THR  22           HN       THR  22  -5.489   5.018  -3.412
  110    HA   THR  22           HA       THR  22  -5.278   5.861  -6.172
  111    HB   THR  22           HB       THR  22  -5.485   8.052  -5.359
  112    HG1  THR  22           HG1      THR  22  -5.107   8.357  -2.998
  113   HG21  THR  22          HG21      THR  22  -7.460   6.619  -4.846
  114   HG22  THR  22          HG22      THR  22  -7.281   7.960  -3.716
  115   HG23  THR  22          HG23      THR  22  -6.798   6.334  -3.237
  116    H    THR  23           HN       THR  23  -3.105   5.026  -3.637
  117    HA   THR  23           HA       THR  23  -0.866   6.561  -4.617
  118    HB   THR  23           HB       THR  23  -0.751   4.180  -2.768
  119    HG1  THR  23           HG1      THR  23  -1.293   5.515  -1.140
  120   HG21  THR  23          HG21      THR  23   1.380   5.118  -3.646
  121   HG22  THR  23          HG22      THR  23   1.222   5.332  -1.903
  122   HG23  THR  23          HG23      THR  23   0.931   6.691  -2.988
  123    H    ARG  24           HN       ARG  24  -1.787   3.121  -4.658
  124    HA   ARG  24           HA       ARG  24   0.407   2.496  -6.493
  125    HB2  ARG  24           HB2      ARG  24  -0.782   0.144  -6.283
  126    HB3  ARG  24           HB1      ARG  24   0.180   0.774  -4.942
  127    HG2  ARG  24           HG2      ARG  24  -1.735   1.454  -3.728
  128    HG3  ARG  24           HG1      ARG  24  -2.782   1.329  -5.140
  129    HD2  ARG  24           HD2      ARG  24  -1.429  -0.986  -3.726
  130    HD3  ARG  24           HD1      ARG  24  -3.139  -0.578  -3.629
  131    HE   ARG  24           HE       ARG  24  -2.549  -0.888  -6.335
  132   HH11  ARG  24          HH21      ARG  24  -2.482  -2.747  -3.417
  133   HH12  ARG  24          HH22      ARG  24  -2.792  -4.256  -4.208
  134   HH21  ARG  24          HH11      ARG  24  -2.956  -2.864  -7.380
  135   HH22  ARG  24          HH12      ARG  24  -3.060  -4.323  -6.452
  136    H    CYS  25           HN       CYS  25  -1.967   4.211  -7.248
  137    HA   CYS  25           HA       CYS  25  -3.404   2.601  -9.187
  138    HB2  CYS  25           HB2      CYS  25  -4.688   4.303  -8.135
  139    HB3  CYS  25           HB1      CYS  25  -3.465   5.527  -8.461
  140    HA   PRO  26           HA       PRO  26  -0.371   3.489 -12.373
  141    HB2  PRO  26           HB2      PRO  26  -1.736   2.657 -14.578
  142    HB3  PRO  26           HB1      PRO  26  -1.090   1.519 -13.377
  143    HG2  PRO  26           HG2      PRO  26  -3.877   2.559 -13.681
  144    HG3  PRO  26           HG1      PRO  26  -3.325   0.904 -13.361
  145    HD2  PRO  26           HD2      PRO  26  -4.242   2.557 -11.381
  146    HD3  PRO  26           HD1      PRO  26  -3.017   1.301 -11.092
  147    H    TYR  27           HN       TYR  27  -2.520   5.518 -11.502
  148    HA   TYR  27           HA       TYR  27  -2.084   7.375 -13.720
  149    HB2  TYR  27           HB2      TYR  27  -4.860   6.732 -12.688
  150    HB3  TYR  27           HB1      TYR  27  -4.458   8.002 -13.843
  151    HD1  TYR  27           HD2      TYR  27  -2.942   7.151 -15.893
  152    HD2  TYR  27           HD1      TYR  27  -5.581   4.683 -13.567
  153    HE1  TYR  27           HE2      TYR  27  -3.055   5.517 -17.753
  154    HE2  TYR  27           HE1      TYR  27  -5.693   3.050 -15.429
  155    HH   TYR  27           HH       TYR  27  -4.336   3.750 -18.571
  156    H    LYS  28           HN       LYS  28  -1.004   7.255 -11.104
  157    HA   LYS  28           HA       LYS  28  -2.431   9.063  -9.384
  158    HB2  LYS  28           HB2      LYS  28  -0.079   9.098  -8.212
  159    HB3  LYS  28           HB1      LYS  28  -1.055   7.634  -8.160
  160    HG2  LYS  28           HG2      LYS  28   1.346   7.221  -8.763
  161    HG3  LYS  28           HG1      LYS  28   0.208   6.648  -9.977
  162    HD2  LYS  28           HD2      LYS  28   0.657   8.501 -11.414
  163    HD3  LYS  28           HD1      LYS  28   1.497   9.379 -10.135
  164    HE2  LYS  28           HE2      LYS  28   3.295   7.731 -10.131
  165    HE3  LYS  28           HE1      LYS  28   2.438   6.754 -11.322
  166    HZ1  LYS  28           HZ1      LYS  28   3.625   7.919 -12.793
  167    HZ2  LYS  28           HZ2      LYS  28   3.999   9.150 -11.684
  168    HZ3  LYS  28           HZ3      LYS  28   2.512   9.167 -12.506
  169    H    ASP  29           HN       ASP  29  -1.521   9.811 -12.211
  170    HA   ASP  29           HA       ASP  29   0.428  11.774 -12.136
  171    HB2  ASP  29           HB2      ASP  29  -0.331  12.328 -14.271
  172    HB3  ASP  29           HB1      ASP  29  -0.826  10.660 -14.103
  173    H    THR  30           HN       THR  30  -2.373  11.712 -10.454
  174    HA   THR  30           HA       THR  30  -3.078  14.520 -10.598
  175    HB   THR  30           HB       THR  30  -4.738  13.985  -8.911
  176    HG1  THR  30           HG1      THR  30  -4.525  12.316  -7.648
  177   HG21  THR  30          HG21      THR  30  -4.498  11.698 -10.884
  178   HG22  THR  30          HG22      THR  30  -5.148  13.291 -11.272
  179   HG23  THR  30          HG23      THR  30  -5.977  12.262 -10.105
  180    H    LEU  31           HN       LEU  31  -0.824  12.608  -8.894
  181    HA   LEU  31           HA       LEU  31   0.667  13.068  -7.214
  182    HB2  LEU  31           HB2      LEU  31   1.024  15.088  -8.713
  183    HB3  LEU  31           HB1      LEU  31  -0.068  15.967  -7.646
  184    HG   LEU  31           HG       LEU  31   1.521  15.088  -5.730
  185   HD11  LEU  31          HD11      LEU  31   2.908  13.598  -7.051
  186   HD12  LEU  31          HD12      LEU  31   3.898  14.966  -6.553
  187   HD13  LEU  31          HD13      LEU  31   3.276  14.885  -8.199
  188   HD21  LEU  31          HD21      LEU  31   3.030  17.081  -6.131
  189   HD22  LEU  31          HD22      LEU  31   1.304  17.442  -6.202
  190   HD23  LEU  31          HD23      LEU  31   2.236  17.285  -7.692
  191    H    GLY  32           HN       GLY  32  -1.572  15.775  -6.660
  192    HA2  GLY  32           HA2      GLY  32  -3.029  16.207  -4.920
  193    HA3  GLY  32           HA1      GLY  32  -2.892  14.517  -4.446
  Start of MODEL    9
    1    H1   LYS   9           HT1      LYS   9 -10.809  -5.268   2.401
    2    H2   LYS   9           HT2      LYS   9 -11.274  -5.780   3.953
    3    H3   LYS   9           HT3      LYS   9 -11.149  -4.121   3.604
    4    HA   LYS   9           HA       LYS   9 -13.337  -5.911   3.188
    5    HB2  LYS   9           HB2      LYS   9 -12.895  -2.917   3.154
    6    HB3  LYS   9           HB1      LYS   9 -14.476  -3.648   2.880
    7    HG2  LYS   9           HG2      LYS   9 -14.392  -4.744   5.060
    8    HG3  LYS   9           HG1      LYS   9 -12.760  -4.133   5.332
    9    HD2  LYS   9           HD2      LYS   9 -13.515  -1.878   5.472
   10    HD3  LYS   9           HD1      LYS   9 -15.097  -2.289   4.807
   11    HE2  LYS   9           HE2      LYS   9 -15.279  -1.987   7.228
   12    HE3  LYS   9           HE1      LYS   9 -15.551  -3.681   6.819
   13    HZ1  LYS   9           HZ1      LYS   9 -13.773  -2.780   8.645
   14    HZ2  LYS   9           HZ2      LYS   9 -12.789  -3.036   7.283
   15    HZ3  LYS   9           HZ3      LYS   9 -13.727  -4.308   7.908
   16    H    ILE  10           HN       ILE  10 -12.939  -3.042   1.232
   17    HA   ILE  10           HA       ILE  10 -12.650  -4.615  -1.229
   18    HB   ILE  10           HB       ILE  10 -15.103  -4.269  -0.668
   19   HG12  ILE  10          HG12      ILE  10 -15.642  -3.467  -3.009
   20   HG13  ILE  10          HG11      ILE  10 -13.933  -3.097  -3.213
   21   HG21  ILE  10          HG21      ILE  10 -16.072  -2.138  -0.733
   22   HG22  ILE  10          HG22      ILE  10 -14.690  -1.420  -1.558
   23   HG23  ILE  10          HG23      ILE  10 -14.575  -1.846   0.151
   24   HD11  ILE  10          HD11      ILE  10 -13.323  -5.319  -3.340
   25   HD12  ILE  10          HD12      ILE  10 -14.967  -5.456  -3.959
   26   HD13  ILE  10          HD13      ILE  10 -14.625  -5.859  -2.278
   27    H    VAL  11           HN       VAL  11 -11.033  -3.746  -2.309
   28    HA   VAL  11           HA       VAL  11 -10.127  -1.046  -1.793
   29    HB   VAL  11           HB       VAL  11  -8.490  -2.812  -2.169
   30   HG11  VAL  11          HG11      VAL  11  -9.558  -2.959  -4.999
   31   HG12  VAL  11          HG12      VAL  11  -9.991  -4.118  -3.742
   32   HG13  VAL  11          HG13      VAL  11  -8.315  -3.975  -4.270
   33   HG21  VAL  11          HG21      VAL  11  -7.084  -1.618  -3.683
   34   HG22  VAL  11          HG22      VAL  11  -8.125  -0.398  -2.951
   35   HG23  VAL  11          HG23      VAL  11  -8.464  -0.984  -4.579
   36    H    SER  12           HN       SER  12 -10.445   0.703  -2.933
   37    HA   SER  12           HA       SER  12 -11.462   0.555  -5.673
   38    HB2  SER  12           HB2      SER  12 -13.228   2.244  -5.116
   39    HB3  SER  12           HB1      SER  12 -13.531   0.630  -4.479
   40    HG   SER  12           HG       SER  12 -12.061   2.345  -2.868
   41    H    CYS  13           HN       CYS  13 -10.288   1.829  -6.801
   42    HA   CYS  13           HA       CYS  13  -8.482   3.744  -5.744
   43    HB2  CYS  13           HB2      CYS  13  -8.314   2.456  -7.952
   44    HB3  CYS  13           HB1      CYS  13  -9.427   3.651  -8.603
   45    H    ARG  14           HN       ARG  14  -8.453   6.068  -6.447
   46    HA   ARG  14           HA       ARG  14 -11.189   7.232  -6.402
   47    HB2  ARG  14           HB2      ARG  14  -9.543   7.429  -4.321
   48    HB3  ARG  14           HB1      ARG  14  -8.838   8.729  -5.277
   49    HG2  ARG  14           HG2      ARG  14 -11.227   9.631  -5.531
   50    HG3  ARG  14           HG1      ARG  14 -11.680   8.490  -4.264
   51    HD2  ARG  14           HD2      ARG  14  -9.977   9.492  -2.771
   52    HD3  ARG  14           HD1      ARG  14  -9.569  10.653  -4.030
   53    HE   ARG  14           HE       ARG  14 -11.447  11.860  -3.421
   54   HH11  ARG  14          HH21      ARG  14 -11.695   8.584  -2.335
   55   HH12  ARG  14          HH22      ARG  14 -13.166   8.841  -1.457
   56   HH21  ARG  14          HH11      ARG  14 -13.375  12.205  -2.270
   57   HH22  ARG  14          HH12      ARG  14 -14.117  10.891  -1.420
   58    H    ILE  15           HN       ILE  15  -9.592   6.570  -8.734
   59    HA   ILE  15           HA       ILE  15  -9.520   9.237  -9.968
   60    HB   ILE  15           HB       ILE  15  -7.273   7.281 -10.465
   61   HG12  ILE  15          HG12      ILE  15  -7.345   9.547  -8.446
   62   HG13  ILE  15          HG11      ILE  15  -7.220   7.828  -8.069
   63   HG21  ILE  15          HG21      ILE  15  -6.193   9.161 -11.458
   64   HG22  ILE  15          HG22      ILE  15  -7.343  10.291 -10.746
   65   HG23  ILE  15          HG23      ILE  15  -7.857   9.212 -12.043
   66   HD11  ILE  15          HD11      ILE  15  -4.991   8.713  -7.991
   67   HD12  ILE  15          HD12      ILE  15  -5.200   9.534  -9.537
   68   HD13  ILE  15          HD13      ILE  15  -5.119   7.773  -9.477
   69    H    CYS  16           HN       CYS  16  -9.283   5.734 -10.357
   70    HA   CYS  16           HA       CYS  16 -10.783   5.933 -12.906
   71    HB2  CYS  16           HB2      CYS  16  -9.475   4.058 -13.754
   72    HB3  CYS  16           HB1      CYS  16  -8.396   5.372 -13.287
   73    H    LYS  17           HN       LYS  17 -10.425   4.567  -9.781
   74    HA   LYS  17           HA       LYS  17 -11.691   3.083  -8.580
   75    HB2  LYS  17           HB2      LYS  17 -13.730   3.307 -10.791
   76    HB3  LYS  17           HB1      LYS  17 -14.002   2.949  -9.087
   77    HG2  LYS  17           HG2      LYS  17 -13.213   5.204  -8.475
   78    HG3  LYS  17           HG1      LYS  17 -12.946   5.571 -10.179
   79    HD2  LYS  17           HD2      LYS  17 -15.265   5.474 -10.679
   80    HD3  LYS  17           HD1      LYS  17 -15.642   4.684  -9.147
   81    HE2  LYS  17           HE2      LYS  17 -14.446   7.459  -9.288
   82    HE3  LYS  17           HE1      LYS  17 -16.187   7.179  -9.281
   83    HZ1  LYS  17           HZ1      LYS  17 -15.540   5.689  -7.233
   84    HZ2  LYS  17           HZ2      LYS  17 -15.812   7.358  -7.062
   85    HZ3  LYS  17           HZ3      LYS  17 -14.225   6.757  -7.153
   86    H    GLY  18           HN       GLY  18  -9.888   1.629  -9.424
   87    HA2  GLY  18           HA2      GLY  18 -11.022  -0.587 -11.054
   88    HA3  GLY  18           HA1      GLY  18  -9.316  -0.147 -11.037
   89    H    ASP  19           HN       ASP  19  -8.138  -1.575  -9.956
   90    HA   ASP  19           HA       ASP  19  -9.199  -2.718  -7.428
   91    HB2  ASP  19           HB2      ASP  19  -8.157  -4.825  -7.967
   92    HB3  ASP  19           HB1      ASP  19  -9.190  -4.358  -9.318
   93    H    HIS  20           HN       HIS  20  -7.896  -0.550  -6.957
   94    HA   HIS  20           HA       HIS  20  -5.624  -1.267  -5.489
   95    HB2  HIS  20           HB2      HIS  20  -3.948   0.097  -6.895
   96    HB3  HIS  20           HB1      HIS  20  -4.339  -1.527  -7.454
   97    HD2  HIS  20           HD2      HIS  20  -5.689   2.143  -8.292
   98    HE1  HIS  20           HE1      HIS  20  -5.935  -0.270 -11.746
   99    H    TRP  21           HN       TRP  21  -5.056   0.357  -4.106
  100    HA   TRP  21           HA       TRP  21  -6.812   2.463  -3.631
  101    HB2  TRP  21           HB2      TRP  21  -3.929   2.046  -2.830
  102    HB3  TRP  21           HB1      TRP  21  -4.866   3.436  -2.280
  103    HD1  TRP  21           HD1      TRP  21  -4.538  -0.323  -1.866
  104    HE1  TRP  21           HE1      TRP  21  -6.002  -1.085   0.114
  105    HE3  TRP  21           HE3      TRP  21  -7.057   4.014  -0.915
  106    HZ2  TRP  21           HZ2      TRP  21  -7.983   0.003   1.869
  107    HZ3  TRP  21           HZ3      TRP  21  -8.725   4.125   0.915
  108    HH2  TRP  21           HH2      TRP  21  -9.191   2.126   2.307
  109    H    THR  22           HN       THR  22  -5.456   4.803  -3.351
  110    HA   THR  22           HA       THR  22  -5.332   5.742  -6.096
  111    HB   THR  22           HB       THR  22  -5.240   7.957  -5.120
  112    HG1  THR  22           HG1      THR  22  -3.907   7.745  -3.414
  113   HG21  THR  22          HG21      THR  22  -7.290   7.878  -3.734
  114   HG22  THR  22          HG22      THR  22  -7.110   6.130  -3.587
  115   HG23  THR  22          HG23      THR  22  -7.432   6.854  -5.163
  116    H    THR  23           HN       THR  23  -3.123   5.156  -3.427
  117    HA   THR  23           HA       THR  23  -0.886   6.544  -4.484
  118    HB   THR  23           HB       THR  23  -0.859   4.136  -2.660
  119    HG1  THR  23           HG1      THR  23  -1.536   5.415  -1.146
  120   HG21  THR  23          HG21      THR  23   1.343   4.680  -3.477
  121   HG22  THR  23          HG22      THR  23   1.222   5.291  -1.827
  122   HG23  THR  23          HG23      THR  23   1.078   6.399  -3.191
  123    H    ARG  24           HN       ARG  24  -1.857   3.122  -4.634
  124    HA   ARG  24           HA       ARG  24   0.322   2.522  -6.492
  125    HB2  ARG  24           HB2      ARG  24  -0.883   0.188  -6.369
  126    HB3  ARG  24           HB1      ARG  24   0.049   0.763  -4.984
  127    HG2  ARG  24           HG2      ARG  24  -1.886   1.404  -3.788
  128    HG3  ARG  24           HG1      ARG  24  -2.902   1.356  -5.229
  129    HD2  ARG  24           HD2      ARG  24  -3.356  -0.613  -3.869
  130    HD3  ARG  24           HD1      ARG  24  -2.547  -1.110  -5.352
  131    HE   ARG  24           HE       ARG  24  -0.748  -0.636  -3.130
  132   HH11  ARG  24          HH21      ARG  24  -2.805  -2.872  -4.786
  133   HH12  ARG  24          HH22      ARG  24  -1.981  -4.278  -4.199
  134   HH21  ARG  24          HH11      ARG  24   0.336  -2.475  -2.354
  135   HH22  ARG  24          HH12      ARG  24  -0.204  -4.053  -2.821
  136    H    CYS  25           HN       CYS  25  -1.987   4.319  -7.206
  137    HA   CYS  25           HA       CYS  25  -3.539   2.834  -9.132
  138    HB2  CYS  25           HB2      CYS  25  -4.617   4.703  -8.100
  139    HB3  CYS  25           HB1      CYS  25  -3.288   5.780  -8.521
  140    HA   PRO  26           HA       PRO  26  -0.450   3.357 -12.346
  141    HB2  PRO  26           HB2      PRO  26  -1.894   2.595 -14.525
  142    HB3  PRO  26           HB1      PRO  26  -1.343   1.433 -13.299
  143    HG2  PRO  26           HG2      PRO  26  -4.032   2.704 -13.622
  144    HG3  PRO  26           HG1      PRO  26  -3.622   1.016 -13.259
  145    HD2  PRO  26           HD2      PRO  26  -4.382   2.794 -11.322
  146    HD3  PRO  26           HD1      PRO  26  -3.274   1.444 -11.000
  147    H    TYR  27           HN       TYR  27  -2.571   5.532 -11.559
  148    HA   TYR  27           HA       TYR  27  -1.890   7.346 -13.750
  149    HB2  TYR  27           HB2      TYR  27  -4.761   6.859 -12.918
  150    HB3  TYR  27           HB1      TYR  27  -4.207   8.075 -14.068
  151    HD1  TYR  27           HD2      TYR  27  -2.585   7.092 -15.975
  152    HD2  TYR  27           HD1      TYR  27  -5.525   4.829 -13.806
  153    HE1  TYR  27           HE2      TYR  27  -2.646   5.417 -17.802
  154    HE2  TYR  27           HE1      TYR  27  -5.584   3.156 -15.634
  155    HH   TYR  27           HH       TYR  27  -3.778   3.651 -18.639
  156    H    LYS  28           HN       LYS  28  -0.804   7.456 -11.277
  157    HA   LYS  28           HA       LYS  28  -2.323   9.231  -9.561
  158    HB2  LYS  28           HB2      LYS  28   0.156   9.349  -8.480
  159    HB3  LYS  28           HB1      LYS  28  -0.949   8.018  -8.170
  160    HG2  LYS  28           HG2      LYS  28   1.273   7.171  -8.771
  161    HG3  LYS  28           HG1      LYS  28   0.091   6.713  -9.981
  162    HD2  LYS  28           HD2      LYS  28   2.139   7.504 -11.068
  163    HD3  LYS  28           HD1      LYS  28   0.818   8.616 -11.404
  164    HE2  LYS  28           HE2      LYS  28   3.151   9.569 -10.652
  165    HE3  LYS  28           HE1      LYS  28   1.680  10.272  -9.990
  166    HZ1  LYS  28           HZ1      LYS  28   1.973   9.216  -7.979
  167    HZ2  LYS  28           HZ2      LYS  28   3.574   9.590  -8.408
  168    HZ3  LYS  28           HZ3      LYS  28   2.980   8.013  -8.623
  169    H    ASP  29           HN       ASP  29  -1.274   9.835 -12.423
  170    HA   ASP  29           HA       ASP  29   0.565  11.898 -12.350
  171    HB2  ASP  29           HB2      ASP  29  -0.078  12.286 -14.557
  172    HB3  ASP  29           HB1      ASP  29  -0.508  10.609 -14.317
  173    H    THR  30           HN       THR  30  -2.341  11.797 -10.854
  174    HA   THR  30           HA       THR  30  -3.158  14.553 -11.212
  175    HB   THR  30           HB       THR  30  -4.887  12.920 -10.800
  176    HG1  THR  30           HG1      THR  30  -4.632  14.217  -8.324
  177   HG21  THR  30          HG21      THR  30  -3.329  12.305  -8.276
  178   HG22  THR  30          HG22      THR  30  -3.577  11.225  -9.648
  179   HG23  THR  30          HG23      THR  30  -4.941  11.684  -8.628
  180    H    LEU  31           HN       LEU  31  -0.708  13.084  -9.532
  181    HA   LEU  31           HA       LEU  31  -0.812  14.505  -7.055
  182    HB2  LEU  31           HB2      LEU  31   0.465  12.456  -7.202
  183    HB3  LEU  31           HB1      LEU  31   1.457  13.115  -8.499
  184    HG   LEU  31           HG       LEU  31   2.428  14.762  -6.990
  185   HD11  LEU  31          HD11      LEU  31   1.793  14.483  -4.478
  186   HD12  LEU  31          HD12      LEU  31   0.327  13.719  -5.091
  187   HD13  LEU  31          HD13      LEU  31   0.695  15.389  -5.517
  188   HD21  LEU  31          HD21      LEU  31   2.347  11.936  -5.907
  189   HD22  LEU  31          HD22      LEU  31   3.441  13.171  -5.283
  190   HD23  LEU  31          HD23      LEU  31   3.565  12.651  -6.964
  191    H    GLY  32           HN       GLY  32  -0.305  16.564  -6.659
  192    HA2  GLY  32           HA2      GLY  32   0.423  18.376  -8.710
  193    HA3  GLY  32           HA1      GLY  32   0.407  18.729  -6.984
  Start of MODEL   10
    1    H1   LYS   9           HT1      LYS   9 -10.930  -1.690   3.331
    2    H2   LYS   9           HT2      LYS   9  -9.477  -2.460   3.755
    3    H3   LYS   9           HT3      LYS   9 -10.851  -2.634   4.738
    4    HA   LYS   9           HA       LYS   9 -10.052  -4.346   2.769
    5    HB2  LYS   9           HB2      LYS   9 -11.548  -4.705   4.789
    6    HB3  LYS   9           HB1      LYS   9 -12.869  -4.030   3.834
    7    HG2  LYS   9           HG2      LYS   9 -12.260  -5.782   2.053
    8    HG3  LYS   9           HG1      LYS   9 -11.289  -6.552   3.308
    9    HD2  LYS   9           HD2      LYS   9 -14.272  -6.014   3.395
   10    HD3  LYS   9           HD1      LYS   9 -13.483  -7.588   3.304
   11    HE2  LYS   9           HE2      LYS   9 -14.012  -7.369   5.593
   12    HE3  LYS   9           HE1      LYS   9 -12.314  -6.898   5.519
   13    HZ1  LYS   9           HZ1      LYS   9 -12.810  -4.843   6.156
   14    HZ2  LYS   9           HZ2      LYS   9 -14.365  -5.410   6.539
   15    HZ3  LYS   9           HZ3      LYS   9 -14.066  -4.698   5.026
   16    H    ILE  10           HN       ILE  10 -12.569  -1.850   2.599
   17    HA   ILE  10           HA       ILE  10 -13.376  -2.588  -0.072
   18    HB   ILE  10           HB       ILE  10 -13.975  -0.062   1.486
   19   HG12  ILE  10          HG12      ILE  10 -15.623  -2.595   1.223
   20   HG13  ILE  10          HG11      ILE  10 -14.633  -2.212   2.632
   21   HG21  ILE  10          HG21      ILE  10 -15.949   0.010  -0.036
   22   HG22  ILE  10          HG22      ILE  10 -15.300  -1.380  -0.903
   23   HG23  ILE  10          HG23      ILE  10 -14.422   0.149  -0.908
   24   HD11  ILE  10          HD11      ILE  10 -16.974  -0.606   1.567
   25   HD12  ILE  10          HD12      ILE  10 -15.911  -0.063   2.867
   26   HD13  ILE  10          HD13      ILE  10 -16.909  -1.501   3.085
   27    H    VAL  11           HN       VAL  11 -11.294  -2.502  -1.124
   28    HA   VAL  11           HA       VAL  11  -9.912   0.033  -1.342
   29    HB   VAL  11           HB       VAL  11  -8.620  -2.020  -1.429
   30   HG11  VAL  11          HG11      VAL  11 -10.031  -2.648  -4.031
   31   HG12  VAL  11          HG12      VAL  11 -10.510  -3.362  -2.493
   32   HG13  VAL  11          HG13      VAL  11  -8.902  -3.671  -3.146
   33   HG21  VAL  11          HG21      VAL  11  -7.261  -1.477  -3.310
   34   HG22  VAL  11          HG22      VAL  11  -8.018   0.042  -2.831
   35   HG23  VAL  11          HG23      VAL  11  -8.639  -0.851  -4.217
   36    H    SER  12           HN       SER  12 -10.202   1.553  -2.748
   37    HA   SER  12           HA       SER  12 -11.249   1.067  -5.385
   38    HB2  SER  12           HB2      SER  12 -12.885   2.835  -3.573
   39    HB3  SER  12           HB1      SER  12 -13.234   2.371  -5.237
   40    HG   SER  12           HG       SER  12 -13.777   1.069  -2.932
   41    H    CYS  13           HN       CYS  13 -10.128   2.303  -6.622
   42    HA   CYS  13           HA       CYS  13  -8.469   4.421  -5.746
   43    HB2  CYS  13           HB2      CYS  13  -8.188   2.982  -7.829
   44    HB3  CYS  13           HB1      CYS  13  -9.416   3.993  -8.578
   45    H    ARG  14           HN       ARG  14  -8.591   6.679  -6.644
   46    HA   ARG  14           HA       ARG  14 -11.400   7.664  -6.661
   47    HB2  ARG  14           HB2      ARG  14 -10.699   9.603  -5.446
   48    HB3  ARG  14           HB1      ARG  14 -10.063   8.204  -4.584
   49    HG2  ARG  14           HG2      ARG  14  -7.911   8.538  -5.934
   50    HG3  ARG  14           HG1      ARG  14  -8.569  10.106  -6.396
   51    HD2  ARG  14           HD2      ARG  14  -8.208   9.181  -3.534
   52    HD3  ARG  14           HD1      ARG  14  -7.081  10.228  -4.391
   53    HE   ARG  14           HE       ARG  14  -9.604  11.005  -3.252
   54   HH11  ARG  14          HH21      ARG  14  -7.319  11.581  -5.786
   55   HH12  ARG  14          HH22      ARG  14  -7.772  13.238  -6.006
   56   HH21  ARG  14          HH11      ARG  14 -10.204  13.177  -3.534
   57   HH22  ARG  14          HH12      ARG  14  -9.405  14.142  -4.731
   58    H    ILE  15           HN       ILE  15  -9.475   6.921  -8.864
   59    HA   ILE  15           HA       ILE  15  -9.631   9.483 -10.348
   60    HB   ILE  15           HB       ILE  15  -7.370   7.477 -10.531
   61   HG12  ILE  15          HG12      ILE  15  -7.289  10.287  -9.399
   62   HG13  ILE  15          HG11      ILE  15  -7.476   8.854  -8.387
   63   HG21  ILE  15          HG21      ILE  15  -7.800   8.649 -12.628
   64   HG22  ILE  15          HG22      ILE  15  -6.329   9.288 -11.895
   65   HG23  ILE  15          HG23      ILE  15  -7.835  10.199 -11.786
   66   HD11  ILE  15          HD11      ILE  15  -5.158   9.472 -10.237
   67   HD12  ILE  15          HD12      ILE  15  -5.370   7.938  -9.393
   68   HD13  ILE  15          HD13      ILE  15  -5.119   9.423  -8.476
   69    H    CYS  16           HN       CYS  16  -9.496   5.958 -10.440
   70    HA   CYS  16           HA       CYS  16 -11.100   5.978 -12.918
   71    HB2  CYS  16           HB2      CYS  16  -9.722   4.265 -13.898
   72    HB3  CYS  16           HB1      CYS  16  -8.673   5.600 -13.421
   73    H    LYS  17           HN       LYS  17 -10.509   4.754  -9.784
   74    HA   LYS  17           HA       LYS  17 -11.577   3.180  -8.499
   75    HB2  LYS  17           HB2      LYS  17 -13.681   3.104 -10.659
   76    HB3  LYS  17           HB1      LYS  17 -13.873   2.795  -8.934
   77    HG2  LYS  17           HG2      LYS  17 -13.335   5.144  -8.436
   78    HG3  LYS  17           HG1      LYS  17 -13.123   5.467 -10.157
   79    HD2  LYS  17           HD2      LYS  17 -15.423   5.086 -10.620
   80    HD3  LYS  17           HD1      LYS  17 -15.697   4.348  -9.041
   81    HE2  LYS  17           HE2      LYS  17 -16.561   6.675  -9.134
   82    HE3  LYS  17           HE1      LYS  17 -15.277   6.497  -7.937
   83    HZ1  LYS  17           HZ1      LYS  17 -14.849   7.454 -10.713
   84    HZ2  LYS  17           HZ2      LYS  17 -13.705   7.419  -9.457
   85    HZ3  LYS  17           HZ3      LYS  17 -15.033   8.475  -9.372
   86    H    GLY  18           HN       GLY  18  -9.555   2.190 -10.031
   87    HA2  GLY  18           HA2      GLY  18 -10.446  -0.146 -11.507
   88    HA3  GLY  18           HA1      GLY  18  -8.777   0.323 -11.190
   89    H    ASP  19           HN       ASP  19  -7.725  -1.084  -9.953
   90    HA   ASP  19           HA       ASP  19  -9.067  -2.268  -7.614
   91    HB2  ASP  19           HB2      ASP  19  -8.303  -4.487  -8.184
   92    HB3  ASP  19           HB1      ASP  19  -9.225  -3.843  -9.542
   93    H    HIS  20           HN       HIS  20  -7.566  -0.393  -6.863
   94    HA   HIS  20           HA       HIS  20  -5.161  -1.632  -5.833
   95    HB2  HIS  20           HB2      HIS  20  -3.968   0.674  -6.611
   96    HB3  HIS  20           HB1      HIS  20  -3.910  -0.794  -7.579
   97    HD2  HIS  20           HD2      HIS  20  -5.890   2.625  -7.535
   98    HE1  HIS  20           HE1      HIS  20  -6.433   0.798 -11.300
   99    H    TRP  21           HN       TRP  21  -4.021  -0.061  -4.390
  100    HA   TRP  21           HA       TRP  21  -5.919   1.033  -2.525
  101    HB2  TRP  21           HB2      TRP  21  -2.912   0.802  -2.594
  102    HB3  TRP  21           HB1      TRP  21  -3.730   1.702  -1.320
  103    HD1  TRP  21           HD1      TRP  21  -4.072  -1.794  -2.964
  104    HE1  TRP  21           HE1      TRP  21  -4.599  -3.502  -1.105
  105    HE3  TRP  21           HE3      TRP  21  -4.250   1.327   1.074
  106    HZ2  TRP  21           HZ2      TRP  21  -5.036  -3.537   1.722
  107    HZ3  TRP  21           HZ3      TRP  21  -4.723   0.431   3.336
  108    HH2  TRP  21           HH2      TRP  21  -5.116  -1.995   3.665
  109    H    THR  22           HN       THR  22  -5.695   2.311  -5.193
  110    HA   THR  22           HA       THR  22  -5.802   4.432  -6.057
  111    HB   THR  22           HB       THR  22  -5.526   5.525  -3.259
  112    HG1  THR  22           HG1      THR  22  -7.205   3.687  -3.919
  113   HG21  THR  22          HG21      THR  22  -7.062   6.372  -5.730
  114   HG22  THR  22          HG22      THR  22  -5.619   7.150  -5.078
  115   HG23  THR  22          HG23      THR  22  -7.132   7.195  -4.173
  116    H    THR  23           HN       THR  23  -3.687   4.858  -3.211
  117    HA   THR  23           HA       THR  23  -1.863   6.609  -4.214
  118    HB   THR  23           HB       THR  23  -1.011   4.210  -2.595
  119    HG1  THR  23           HG1      THR  23  -1.635   5.720  -0.834
  120   HG21  THR  23          HG21      THR  23   0.775   5.728  -3.294
  121   HG22  THR  23          HG22      THR  23   0.489   5.902  -1.563
  122   HG23  THR  23          HG23      THR  23  -0.135   7.110  -2.684
  123    H    ARG  24           HN       ARG  24  -1.763   3.067  -4.621
  124    HA   ARG  24           HA       ARG  24   0.506   3.295  -6.461
  125    HB2  ARG  24           HB2      ARG  24   0.580   0.892  -6.402
  126    HB3  ARG  24           HB1      ARG  24   0.348   1.462  -4.747
  127    HG2  ARG  24           HG2      ARG  24  -2.178   1.171  -5.194
  128    HG3  ARG  24           HG1      ARG  24  -1.686   0.223  -6.599
  129    HD2  ARG  24           HD2      ARG  24  -0.235  -1.141  -5.009
  130    HD3  ARG  24           HD1      ARG  24  -1.074  -0.330  -3.691
  131    HE   ARG  24           HE       ARG  24  -3.093  -1.312  -5.264
  132   HH11  ARG  24          HH21      ARG  24  -0.272  -2.610  -3.738
  133   HH12  ARG  24          HH22      ARG  24  -0.957  -4.182  -3.495
  134   HH21  ARG  24          HH11      ARG  24  -3.998  -3.371  -4.950
  135   HH22  ARG  24          HH12      ARG  24  -3.068  -4.613  -4.180
  136    H    CYS  25           HN       CYS  25  -2.156   4.415  -7.154
  137    HA   CYS  25           HA       CYS  25  -3.415   2.737  -9.063
  138    HB2  CYS  25           HB2      CYS  25  -4.711   4.531  -8.215
  139    HB3  CYS  25           HB1      CYS  25  -3.459   5.714  -8.577
  140    HA   PRO  26           HA       PRO  26  -0.387   3.267 -12.326
  141    HB2  PRO  26           HB2      PRO  26  -1.805   2.319 -14.455
  142    HB3  PRO  26           HB1      PRO  26  -1.179   1.255 -13.178
  143    HG2  PRO  26           HG2      PRO  26  -3.937   2.354 -13.533
  144    HG3  PRO  26           HG1      PRO  26  -3.430   0.713 -13.091
  145    HD2  PRO  26           HD2      PRO  26  -4.276   2.534 -11.236
  146    HD3  PRO  26           HD1      PRO  26  -3.079   1.275 -10.863
  147    H    TYR  27           HN       TYR  27  -2.753   5.302 -11.695
  148    HA   TYR  27           HA       TYR  27  -2.105   7.088 -13.929
  149    HB2  TYR  27           HB2      TYR  27  -4.970   6.498 -13.141
  150    HB3  TYR  27           HB1      TYR  27  -4.429   7.620 -14.388
  151    HD1  TYR  27           HD2      TYR  27  -2.672   6.488 -16.120
  152    HD2  TYR  27           HD1      TYR  27  -5.691   4.398 -13.886
  153    HE1  TYR  27           HE2      TYR  27  -2.628   4.648 -17.779
  154    HE2  TYR  27           HE1      TYR  27  -5.645   2.559 -15.548
  155    HH   TYR  27           HH       TYR  27  -3.196   2.321 -17.958
  156    H    LYS  28           HN       LYS  28  -1.124   7.315 -11.407
  157    HA   LYS  28           HA       LYS  28  -2.806   9.048  -9.803
  158    HB2  LYS  28           HB2      LYS  28  -0.522   9.302  -8.524
  159    HB3  LYS  28           HB1      LYS  28  -1.405   7.781  -8.438
  160    HG2  LYS  28           HG2      LYS  28   1.037   7.484  -8.902
  161    HG3  LYS  28           HG1      LYS  28   0.004   6.793 -10.147
  162    HD2  LYS  28           HD2      LYS  28   0.426   8.600 -11.645
  163    HD3  LYS  28           HD1      LYS  28   1.127   9.593 -10.364
  164    HE2  LYS  28           HE2      LYS  28   3.076   8.229 -10.237
  165    HE3  LYS  28           HE1      LYS  28   2.332   6.949 -11.196
  166    HZ1  LYS  28           HZ1      LYS  28   3.707   9.294 -12.063
  167    HZ2  LYS  28           HZ2      LYS  28   2.167   9.175 -12.771
  168    HZ3  LYS  28           HZ3      LYS  28   3.285   7.906 -12.941
  169    H    ASP  29           HN       ASP  29  -1.809   9.717 -12.619
  170    HA   ASP  29           HA       ASP  29   0.006  11.804 -12.560
  171    HB2  ASP  29           HB2      ASP  29  -0.667  12.186 -14.754
  172    HB3  ASP  29           HB1      ASP  29  -1.102  10.509 -14.516
  173    H    THR  30           HN       THR  30  -2.859  11.644 -10.998
  174    HA   THR  30           HA       THR  30  -3.736  14.386 -11.321
  175    HB   THR  30           HB       THR  30  -5.383  13.817  -9.585
  176    HG1  THR  30           HG1      THR  30  -4.817  12.337  -8.234
  177   HG21  THR  30          HG21      THR  30  -5.109  11.527 -11.543
  178   HG22  THR  30          HG22      THR  30  -5.672  13.133 -12.008
  179   HG23  THR  30          HG23      THR  30  -6.596  12.176 -10.850
  180    H    LEU  31           HN       LEU  31  -1.548  12.638  -9.304
  181    HA   LEU  31           HA       LEU  31  -1.552  14.362  -7.046
  182    HB2  LEU  31           HB2      LEU  31  -0.521  11.971  -7.377
  183    HB3  LEU  31           HB1      LEU  31   0.899  12.852  -7.932
  184    HG   LEU  31           HG       LEU  31  -0.481  13.219  -5.253
  185   HD11  LEU  31          HD11      LEU  31   2.254  12.081  -5.906
  186   HD12  LEU  31          HD12      LEU  31   0.833  11.099  -5.548
  187   HD13  LEU  31          HD13      LEU  31   1.498  12.170  -4.315
  188   HD21  LEU  31          HD21      LEU  31   1.728  14.549  -4.851
  189   HD22  LEU  31          HD22      LEU  31   0.445  15.330  -5.773
  190   HD23  LEU  31          HD23      LEU  31   1.827  14.621  -6.611
  191    H    GLY  32           HN       GLY  32   0.975  14.031  -9.553
  192    HA2  GLY  32           HA2      GLY  32   1.135  16.865  -9.996
  193    HA3  GLY  32           HA1      GLY  32   2.462  16.269  -9.002
  Start of MODEL   11
    1    H1   LYS   9           HT1      LYS   9 -14.765  -3.972   2.375
    2    H2   LYS   9           HT2      LYS   9 -14.814  -5.125   3.622
    3    H3   LYS   9           HT3      LYS   9 -15.559  -5.450   2.130
    4    HA   LYS   9           HA       LYS   9 -12.643  -5.038   2.492
    5    HB2  LYS   9           HB2      LYS   9 -14.308  -7.560   2.267
    6    HB3  LYS   9           HB1      LYS   9 -12.557  -7.523   2.055
    7    HG2  LYS   9           HG2      LYS   9 -12.334  -6.532   4.331
    8    HG3  LYS   9           HG1      LYS   9 -14.079  -6.692   4.542
    9    HD2  LYS   9           HD2      LYS   9 -13.892  -9.134   4.200
   10    HD3  LYS   9           HD1      LYS   9 -12.145  -8.969   4.020
   11    HE2  LYS   9           HE2      LYS   9 -12.159  -7.861   6.328
   12    HE3  LYS   9           HE1      LYS   9 -13.815  -8.447   6.484
   13    HZ1  LYS   9           HZ1      LYS   9 -13.071 -10.463   6.956
   14    HZ2  LYS   9           HZ2      LYS   9 -11.485  -9.851   6.975
   15    HZ3  LYS   9           HZ3      LYS   9 -12.128 -10.513   5.548
   16    H    ILE  10           HN       ILE  10 -13.410  -3.509   0.635
   17    HA   ILE  10           HA       ILE  10 -12.994  -4.948  -1.886
   18    HB   ILE  10           HB       ILE  10 -15.469  -4.566  -1.483
   19   HG12  ILE  10          HG12      ILE  10 -15.822  -3.597  -3.795
   20   HG13  ILE  10          HG11      ILE  10 -14.095  -3.258  -3.855
   21   HG21  ILE  10          HG21      ILE  10 -16.380  -2.406  -1.473
   22   HG22  ILE  10          HG22      ILE  10 -14.921  -1.677  -2.141
   23   HG23  ILE  10          HG23      ILE  10 -14.946  -2.222  -0.464
   24   HD11  ILE  10          HD11      ILE  10 -15.120  -5.531  -4.833
   25   HD12  ILE  10          HD12      ILE  10 -14.917  -6.057  -3.164
   26   HD13  ILE  10          HD13      ILE  10 -13.526  -5.485  -4.086
   27    H    VAL  11           HN       VAL  11 -11.295  -4.062  -2.819
   28    HA   VAL  11           HA       VAL  11 -10.348  -1.431  -2.073
   29    HB   VAL  11           HB       VAL  11  -8.743  -3.221  -2.469
   30   HG11  VAL  11          HG11      VAL  11  -8.487  -4.281  -4.596
   31   HG12  VAL  11          HG12      VAL  11  -9.575  -3.134  -5.375
   32   HG13  VAL  11          HG13      VAL  11 -10.214  -4.328  -4.246
   33   HG21  VAL  11          HG21      VAL  11  -8.531  -1.215  -4.724
   34   HG22  VAL  11          HG22      VAL  11  -7.215  -1.978  -3.832
   35   HG23  VAL  11          HG23      VAL  11  -8.243  -0.784  -3.039
   36    H    SER  12           HN       SER  12 -10.602   0.394  -3.076
   37    HA   SER  12           HA       SER  12 -11.423   0.476  -5.886
   38    HB2  SER  12           HB2      SER  12 -12.965   1.989  -3.781
   39    HB3  SER  12           HB1      SER  12 -13.299   1.894  -5.508
   40    HG   SER  12           HG       SER  12 -13.187  -0.410  -3.874
   41    H    CYS  13           HN       CYS  13 -10.178   1.829  -6.844
   42    HA   CYS  13           HA       CYS  13  -8.348   3.553  -5.577
   43    HB2  CYS  13           HB2      CYS  13  -8.320   2.562  -7.967
   44    HB3  CYS  13           HB1      CYS  13  -9.309   3.952  -8.400
   45    H    ARG  14           HN       ARG  14  -8.434   5.991  -6.785
   46    HA   ARG  14           HA       ARG  14 -11.068   7.177  -6.201
   47    HB2  ARG  14           HB2      ARG  14  -9.310   7.194  -4.197
   48    HB3  ARG  14           HB1      ARG  14  -8.643   8.558  -5.087
   49    HG2  ARG  14           HG2      ARG  14 -10.190   9.644  -3.717
   50    HG3  ARG  14           HG1      ARG  14 -11.165   9.369  -5.158
   51    HD2  ARG  14           HD2      ARG  14 -11.815   7.119  -3.995
   52    HD3  ARG  14           HD1      ARG  14 -11.218   7.894  -2.530
   53    HE   ARG  14           HE       ARG  14 -12.954   9.717  -3.690
   54   HH11  ARG  14          HH21      ARG  14 -13.048   6.458  -2.528
   55   HH12  ARG  14          HH22      ARG  14 -14.713   6.530  -2.053
   56   HH21  ARG  14          HH11      ARG  14 -15.136   9.818  -3.069
   57   HH22  ARG  14          HH12      ARG  14 -15.894   8.432  -2.359
   58    H    ILE  15           HN       ILE  15  -8.995   6.682  -8.463
   59    HA   ILE  15           HA       ILE  15  -9.173   9.410  -9.618
   60    HB   ILE  15           HB       ILE  15  -6.887   7.452  -9.962
   61   HG12  ILE  15          HG12      ILE  15  -6.792  10.154  -8.600
   62   HG13  ILE  15          HG11      ILE  15  -7.124   8.676  -7.697
   63   HG21  ILE  15          HG21      ILE  15  -5.850   9.539 -11.026
   64   HG22  ILE  15          HG22      ILE  15  -7.481  10.209 -11.053
   65   HG23  ILE  15          HG23      ILE  15  -7.117   8.739 -11.956
   66   HD11  ILE  15          HD11      ILE  15  -4.664   9.228  -9.376
   67   HD12  ILE  15          HD12      ILE  15  -5.012   7.696  -8.574
   68   HD13  ILE  15          HD13      ILE  15  -4.732   9.150  -7.616
   69    H    CYS  16           HN       CYS  16  -9.083   5.930 -10.092
   70    HA   CYS  16           HA       CYS  16 -10.534   6.248 -12.650
   71    HB2  CYS  16           HB2      CYS  16  -9.208   4.539 -13.678
   72    HB3  CYS  16           HB1      CYS  16  -8.085   5.708 -12.983
   73    H    LYS  17           HN       LYS  17 -10.343   4.895  -9.562
   74    HA   LYS  17           HA       LYS  17 -11.624   3.372  -8.439
   75    HB2  LYS  17           HB2      LYS  17 -13.439   3.324 -10.847
   76    HB3  LYS  17           HB1      LYS  17 -13.850   3.042  -9.158
   77    HG2  LYS  17           HG2      LYS  17 -12.971   5.676 -10.373
   78    HG3  LYS  17           HG1      LYS  17 -14.584   5.277  -9.784
   79    HD2  LYS  17           HD2      LYS  17 -13.442   4.800  -7.518
   80    HD3  LYS  17           HD1      LYS  17 -12.050   5.655  -8.184
   81    HE2  LYS  17           HE2      LYS  17 -13.418   7.643  -8.580
   82    HE3  LYS  17           HE1      LYS  17 -14.856   6.794  -8.013
   83    HZ1  LYS  17           HZ1      LYS  17 -14.339   7.442  -5.976
   84    HZ2  LYS  17           HZ2      LYS  17 -12.881   8.134  -6.505
   85    HZ3  LYS  17           HZ3      LYS  17 -12.931   6.499  -6.045
   86    H    GLY  18           HN       GLY  18  -9.439   2.421  -9.948
   87    HA2  GLY  18           HA2      GLY  18 -10.297  -0.017 -11.306
   88    HA3  GLY  18           HA1      GLY  18  -8.641   0.551 -11.113
   89    H    ASP  19           HN       ASP  19  -8.280  -1.759 -10.568
   90    HA   ASP  19           HA       ASP  19  -9.229  -2.634  -7.942
   91    HB2  ASP  19           HB2      ASP  19  -7.896  -4.694  -8.504
   92    HB3  ASP  19           HB1      ASP  19  -9.189  -4.327  -9.644
   93    H    HIS  20           HN       HIS  20  -7.953  -0.549  -7.213
   94    HA   HIS  20           HA       HIS  20  -5.797  -1.391  -5.641
   95    HB2  HIS  20           HB2      HIS  20  -4.010   0.049  -6.809
   96    HB3  HIS  20           HB1      HIS  20  -4.370  -1.521  -7.518
   97    HD2  HIS  20           HD2      HIS  20  -5.647   2.214  -8.173
   98    HE1  HIS  20           HE1      HIS  20  -5.583   0.084 -11.816
   99    H    TRP  21           HN       TRP  21  -5.296   0.123  -4.120
  100    HA   TRP  21           HA       TRP  21  -7.075   2.256  -3.683
  101    HB2  TRP  21           HB2      TRP  21  -4.376   1.582  -2.507
  102    HB3  TRP  21           HB1      TRP  21  -5.315   2.971  -1.968
  103    HD1  TRP  21           HD1      TRP  21  -5.290  -0.834  -1.951
  104    HE1  TRP  21           HE1      TRP  21  -7.056  -1.678  -0.275
  105    HE3  TRP  21           HE3      TRP  21  -7.593   3.577  -0.802
  106    HZ2  TRP  21           HZ2      TRP  21  -9.168  -0.621   1.341
  107    HZ3  TRP  21           HZ3      TRP  21  -9.476   3.630   0.806
  108    HH2  TRP  21           HH2      TRP  21 -10.267   1.538   1.879
  109    H    THR  22           HN       THR  22  -5.632   4.459  -2.969
  110    HA   THR  22           HA       THR  22  -5.087   5.659  -5.544
  111    HB   THR  22           HB       THR  22  -4.808   7.733  -4.254
  112    HG1  THR  22           HG1      THR  22  -4.654   5.874  -2.197
  113   HG21  THR  22          HG21      THR  22  -7.065   7.903  -3.473
  114   HG22  THR  22          HG22      THR  22  -7.156   6.169  -3.167
  115   HG23  THR  22          HG23      THR  22  -7.088   6.771  -4.824
  116    H    THR  23           HN       THR  23  -3.228   5.117  -2.550
  117    HA   THR  23           HA       THR  23  -0.791   6.162  -3.383
  118    HB   THR  23           HB       THR  23  -0.719   5.622  -1.143
  119    HG1  THR  23           HG1      THR  23   0.712   3.948  -0.904
  120   HG21  THR  23          HG21      THR  23  -2.272   3.168  -1.950
  121   HG22  THR  23          HG22      THR  23  -2.759   4.473  -0.871
  122   HG23  THR  23          HG23      THR  23  -1.542   3.307  -0.352
  123    H    ARG  24           HN       ARG  24  -2.466   3.629  -4.768
  124    HA   ARG  24           HA       ARG  24  -0.043   2.723  -6.200
  125    HB2  ARG  24           HB2      ARG  24  -1.156   0.375  -6.144
  126    HB3  ARG  24           HB1      ARG  24  -0.286   0.925  -4.710
  127    HG2  ARG  24           HG2      ARG  24  -2.292   1.479  -3.568
  128    HG3  ARG  24           HG1      ARG  24  -3.254   1.386  -5.042
  129    HD2  ARG  24           HD2      ARG  24  -3.640  -0.622  -3.722
  130    HD3  ARG  24           HD1      ARG  24  -2.740  -1.055  -5.173
  131    HE   ARG  24           HE       ARG  24  -0.826  -0.564  -3.236
  132   HH11  ARG  24          HH21      ARG  24  -3.565  -2.636  -3.657
  133   HH12  ARG  24          HH22      ARG  24  -2.918  -3.918  -2.689
  134   HH21  ARG  24          HH11      ARG  24   0.029  -2.241  -1.965
  135   HH22  ARG  24          HH12      ARG  24  -0.883  -3.695  -1.731
  136    H    CYS  25           HN       CYS  25  -1.638   4.592  -7.272
  137    HA   CYS  25           HA       CYS  25  -3.527   3.210  -9.075
  138    HB2  CYS  25           HB2      CYS  25  -4.454   5.128  -7.905
  139    HB3  CYS  25           HB1      CYS  25  -3.143   6.149  -8.492
  140    HA   PRO  26           HA       PRO  26  -0.043   3.969 -11.937
  141    HB2  PRO  26           HB2      PRO  26  -0.551   2.001 -13.727
  142    HB3  PRO  26           HB1      PRO  26   0.170   1.662 -12.140
  143    HG2  PRO  26           HG2      PRO  26  -2.645   1.297 -13.053
  144    HG3  PRO  26           HG1      PRO  26  -1.662   0.270 -11.997
  145    HD2  PRO  26           HD2      PRO  26  -3.567   2.101 -11.096
  146    HD3  PRO  26           HD1      PRO  26  -2.233   1.468 -10.105
  147    H    TYR  27           HN       TYR  27  -2.536   5.467 -11.947
  148    HA   TYR  27           HA       TYR  27  -2.588   6.220 -14.771
  149    HB2  TYR  27           HB2      TYR  27  -5.129   5.534 -13.271
  150    HB3  TYR  27           HB1      TYR  27  -5.023   6.169 -14.911
  151    HD1  TYR  27           HD2      TYR  27  -3.289   4.773 -16.465
  152    HD2  TYR  27           HD1      TYR  27  -5.428   3.221 -13.075
  153    HE1  TYR  27           HE2      TYR  27  -3.032   2.474 -17.354
  154    HE2  TYR  27           HE1      TYR  27  -5.172   0.924 -13.968
  155    HH   TYR  27           HH       TYR  27  -3.097  -0.070 -15.916
  156    H    LYS  28           HN       LYS  28  -1.738   7.306 -12.105
  157    HA   LYS  28           HA       LYS  28  -3.535   9.415 -11.421
  158    HB2  LYS  28           HB2      LYS  28  -1.353  10.333 -10.288
  159    HB3  LYS  28           HB1      LYS  28  -2.106   8.871  -9.661
  160    HG2  LYS  28           HG2      LYS  28   0.383   8.687  -9.950
  161    HG3  LYS  28           HG1      LYS  28  -0.525   7.468 -10.835
  162    HD2  LYS  28           HD2      LYS  28  -0.212   8.605 -12.915
  163    HD3  LYS  28           HD1      LYS  28   0.362  10.065 -12.107
  164    HE2  LYS  28           HE2      LYS  28   1.799   7.416 -11.878
  165    HE3  LYS  28           HE1      LYS  28   2.165   8.584 -13.146
  166    HZ1  LYS  28           HZ1      LYS  28   2.042   9.646 -10.448
  167    HZ2  LYS  28           HZ2      LYS  28   3.137   9.984 -11.703
  168    HZ3  LYS  28           HZ3      LYS  28   3.331   8.588 -10.754
  169    H    ASP  29           HN       ASP  29  -2.403   9.083 -14.271
  170    HA   ASP  29           HA       ASP  29  -0.795  11.236 -14.929
  171    HB2  ASP  29           HB2      ASP  29  -1.347  10.718 -17.135
  172    HB3  ASP  29           HB1      ASP  29  -1.609   9.202 -16.304
  173    H    THR  30           HN       THR  30  -3.749  11.330 -13.533
  174    HA   THR  30           HA       THR  30  -4.854  13.637 -14.887
  175    HB   THR  30           HB       THR  30  -6.630  13.509 -13.285
  176    HG1  THR  30           HG1      THR  30  -5.165  11.576 -11.850
  177   HG21  THR  30          HG21      THR  30  -7.286  11.139 -13.468
  178   HG22  THR  30          HG22      THR  30  -5.631  10.716 -13.909
  179   HG23  THR  30          HG23      THR  30  -6.601  11.724 -14.983
  180    H    LEU  31           HN       LEU  31  -4.043  13.176 -11.446
  181    HA   LEU  31           HA       LEU  31  -3.137  14.598  -9.892
  182    HB2  LEU  31           HB2      LEU  31  -1.219  14.441 -11.548
  183    HB3  LEU  31           HB1      LEU  31  -1.798  15.956 -12.235
  184    HG   LEU  31           HG       LEU  31  -1.698  16.821  -9.745
  185   HD11  LEU  31          HD11      LEU  31   0.173  14.431  -9.694
  186   HD12  LEU  31          HD12      LEU  31  -1.205  14.722  -8.634
  187   HD13  LEU  31          HD13      LEU  31   0.223  15.745  -8.521
  188   HD21  LEU  31          HD21      LEU  31  -0.285  17.706 -11.530
  189   HD22  LEU  31          HD22      LEU  31   0.778  16.304 -11.422
  190   HD23  LEU  31          HD23      LEU  31   0.695  17.452 -10.086
  191    H    GLY  32           HN       GLY  32  -3.310  16.873 -12.619
  192    HA2  GLY  32           HA2      GLY  32  -5.704  18.138 -12.082
  193    HA3  GLY  32           HA1      GLY  32  -4.527  18.903 -11.018
  Start of MODEL   12
    1    H1   LYS   9           HT1      LYS   9 -10.217  -6.109   3.491
    2    H2   LYS   9           HT2      LYS   9 -11.732  -6.151   2.726
    3    H3   LYS   9           HT3      LYS   9 -11.155  -4.700   3.396
    4    HA   LYS   9           HA       LYS   9  -9.258  -4.818   1.789
    5    HB2  LYS   9           HB2      LYS   9 -11.075  -6.955   0.631
    6    HB3  LYS   9           HB1      LYS   9  -9.697  -6.243  -0.211
    7    HG2  LYS   9           HG2      LYS   9  -8.208  -7.009   1.628
    8    HG3  LYS   9           HG1      LYS   9  -9.593  -7.783   2.399
    9    HD2  LYS   9           HD2      LYS   9  -9.932  -9.113   0.287
   10    HD3  LYS   9           HD1      LYS   9  -8.415  -8.444  -0.313
   11    HE2  LYS   9           HE2      LYS   9  -8.699  -9.997   2.275
   12    HE3  LYS   9           HE1      LYS   9  -8.125 -10.684   0.755
   13    HZ1  LYS   9           HZ1      LYS   9  -6.147 -10.075   1.628
   14    HZ2  LYS   9           HZ2      LYS   9  -6.805  -8.829   2.575
   15    HZ3  LYS   9           HZ3      LYS   9  -6.540  -8.587   0.915
   16    H    ILE  10           HN       ILE  10 -11.147  -3.038   2.494
   17    HA   ILE  10           HA       ILE  10 -13.048  -2.534   0.388
   18    HB   ILE  10           HB       ILE  10 -12.136  -0.535   2.457
   19   HG12  ILE  10          HG12      ILE  10 -12.561  -2.555   3.711
   20   HG13  ILE  10          HG11      ILE  10 -13.971  -1.514   3.894
   21   HG21  ILE  10          HG21      ILE  10 -13.671   0.282   0.738
   22   HG22  ILE  10          HG22      ILE  10 -14.521   0.161   2.278
   23   HG23  ILE  10          HG23      ILE  10 -14.764  -1.069   1.038
   24   HD11  ILE  10          HD11      ILE  10 -13.678  -3.959   2.142
   25   HD12  ILE  10          HD12      ILE  10 -14.978  -2.791   1.906
   26   HD13  ILE  10          HD13      ILE  10 -14.852  -3.675   3.426
   27    H    VAL  11           HN       VAL  11 -10.755  -2.820  -0.937
   28    HA   VAL  11           HA       VAL  11  -9.375  -0.302  -1.312
   29    HB   VAL  11           HB       VAL  11  -8.149  -2.382  -1.603
   30   HG11  VAL  11          HG11      VAL  11 -10.201  -3.655  -2.435
   31   HG12  VAL  11          HG12      VAL  11  -8.698  -3.990  -3.292
   32   HG13  VAL  11          HG13      VAL  11  -9.903  -2.921  -4.010
   33   HG21  VAL  11          HG21      VAL  11  -7.054  -1.828  -3.653
   34   HG22  VAL  11          HG22      VAL  11  -7.679  -0.305  -3.020
   35   HG23  VAL  11          HG23      VAL  11  -8.525  -1.130  -4.330
   36    H    SER  12           HN       SER  12  -9.821   1.236  -2.658
   37    HA   SER  12           HA       SER  12 -11.250   0.799  -5.119
   38    HB2  SER  12           HB2      SER  12 -12.560   2.587  -3.074
   39    HB3  SER  12           HB1      SER  12 -13.157   2.154  -4.673
   40    HG   SER  12           HG       SER  12 -13.039  -0.090  -3.825
   41    H    CYS  13           HN       CYS  13 -10.308   2.028  -6.503
   42    HA   CYS  13           HA       CYS  13  -8.628   4.244  -5.731
   43    HB2  CYS  13           HB2      CYS  13  -7.893   2.802  -7.526
   44    HB3  CYS  13           HB1      CYS  13  -9.373   3.094  -8.428
   45    H    ARG  14           HN       ARG  14  -8.852   6.421  -6.613
   46    HA   ARG  14           HA       ARG  14 -11.703   7.192  -6.992
   47    HB2  ARG  14           HB2      ARG  14 -11.212   9.283  -5.940
   48    HB3  ARG  14           HB1      ARG  14 -10.544   8.021  -4.908
   49    HG2  ARG  14           HG2      ARG  14  -8.320   8.383  -6.072
   50    HG3  ARG  14           HG1      ARG  14  -9.034   9.795  -6.847
   51    HD2  ARG  14           HD2      ARG  14  -9.016   9.420  -3.846
   52    HD3  ARG  14           HD1      ARG  14  -7.736  10.264  -4.711
   53    HE   ARG  14           HE       ARG  14  -9.980  11.520  -5.585
   54   HH11  ARG  14          HH21      ARG  14  -8.749  10.662  -2.468
   55   HH12  ARG  14          HH22      ARG  14  -9.475  12.009  -1.656
   56   HH21  ARG  14          HH11      ARG  14 -10.938  13.288  -4.529
   57   HH22  ARG  14          HH12      ARG  14 -10.714  13.496  -2.823
   58    H    ILE  15           HN       ILE  15  -8.713   6.961  -8.503
   59    HA   ILE  15           HA       ILE  15  -9.105   9.220 -10.316
   60    HB   ILE  15           HB       ILE  15  -6.986   7.056 -10.317
   61   HG12  ILE  15          HG12      ILE  15  -6.706   9.905  -9.334
   62   HG13  ILE  15          HG11      ILE  15  -7.151   8.588  -8.249
   63   HG21  ILE  15          HG21      ILE  15  -7.343   9.666 -11.801
   64   HG22  ILE  15          HG22      ILE  15  -7.063   8.059 -12.473
   65   HG23  ILE  15          HG23      ILE  15  -5.766   8.897 -11.623
   66   HD11  ILE  15          HD11      ILE  15  -4.727   8.917  -8.195
   67   HD12  ILE  15          HD12      ILE  15  -4.643   8.728  -9.946
   68   HD13  ILE  15          HD13      ILE  15  -5.103   7.359  -8.934
   69    H    CYS  16           HN       CYS  16  -9.316   5.703 -10.294
   70    HA   CYS  16           HA       CYS  16 -10.766   5.798 -12.859
   71    HB2  CYS  16           HB2      CYS  16  -9.490   4.046 -13.816
   72    HB3  CYS  16           HB1      CYS  16  -8.312   5.183 -13.162
   73    H    LYS  17           HN       LYS  17 -10.407   4.544  -9.683
   74    HA   LYS  17           HA       LYS  17 -11.689   3.112  -8.436
   75    HB2  LYS  17           HB2      LYS  17 -13.697   3.205 -10.685
   76    HB3  LYS  17           HB1      LYS  17 -13.990   2.932  -8.970
   77    HG2  LYS  17           HG2      LYS  17 -13.239   5.225  -8.465
   78    HG3  LYS  17           HG1      LYS  17 -12.948   5.508 -10.181
   79    HD2  LYS  17           HD2      LYS  17 -15.262   5.338 -10.710
   80    HD3  LYS  17           HD1      LYS  17 -15.647   4.647  -9.133
   81    HE2  LYS  17           HE2      LYS  17 -16.287   7.042  -9.269
   82    HE3  LYS  17           HE1      LYS  17 -15.055   6.763  -8.039
   83    HZ1  LYS  17           HZ1      LYS  17 -14.895   8.570 -10.058
   84    HZ2  LYS  17           HZ2      LYS  17 -13.953   7.279 -10.634
   85    HZ3  LYS  17           HZ3      LYS  17 -13.589   8.000  -9.138
   86    H    GLY  18           HN       GLY  18  -9.707   1.881  -9.799
   87    HA2  GLY  18           HA2      GLY  18 -10.828  -0.455 -11.187
   88    HA3  GLY  18           HA1      GLY  18  -9.122  -0.036 -11.054
   89    H    ASP  19           HN       ASP  19  -8.084  -1.564  -9.953
   90    HA   ASP  19           HA       ASP  19  -9.270  -2.582  -7.430
   91    HB2  ASP  19           HB2      ASP  19  -8.368  -4.776  -7.922
   92    HB3  ASP  19           HB1      ASP  19  -9.389  -4.261  -9.263
   93    H    HIS  20           HN       HIS  20  -7.849  -0.586  -6.836
   94    HA   HIS  20           HA       HIS  20  -5.582  -1.502  -5.462
   95    HB2  HIS  20           HB2      HIS  20  -3.880  -0.119  -6.793
   96    HB3  HIS  20           HB1      HIS  20  -4.373  -1.654  -7.503
   97    HD2  HIS  20           HD2      HIS  20  -5.679   2.106  -7.865
   98    HE1  HIS  20           HE1      HIS  20  -5.923   0.168 -11.606
   99    H    TRP  21           HN       TRP  21  -4.655   0.130  -4.173
  100    HA   TRP  21           HA       TRP  21  -6.410   2.251  -3.473
  101    HB2  TRP  21           HB2      TRP  21  -3.555   1.636  -2.694
  102    HB3  TRP  21           HB1      TRP  21  -4.462   2.992  -2.027
  103    HD1  TRP  21           HD1      TRP  21  -5.085  -0.803  -2.540
  104    HE1  TRP  21           HE1      TRP  21  -6.268  -1.705  -0.434
  105    HE3  TRP  21           HE3      TRP  21  -5.474   3.509   0.168
  106    HZ2  TRP  21           HZ2      TRP  21  -7.250  -0.726   2.069
  107    HZ3  TRP  21           HZ3      TRP  21  -6.536   3.496   2.407
  108    HH2  TRP  21           HH2      TRP  21  -7.423   1.386   3.359
  109    H    THR  22           HN       THR  22  -6.146   4.491  -3.711
  110    HA   THR  22           HA       THR  22  -5.457   5.474  -6.182
  111    HB   THR  22           HB       THR  22  -5.536   7.677  -5.217
  112    HG1  THR  22           HG1      THR  22  -4.195   6.639  -3.308
  113   HG21  THR  22          HG21      THR  22  -7.636   6.306  -5.243
  114   HG22  THR  22          HG22      THR  22  -7.621   7.549  -3.992
  115   HG23  THR  22          HG23      THR  22  -7.315   5.866  -3.566
  116    H    THR  23           HN       THR  23  -3.348   4.754  -3.505
  117    HA   THR  23           HA       THR  23  -1.116   6.307  -4.349
  118    HB   THR  23           HB       THR  23  -1.243   3.828  -2.624
  119    HG1  THR  23           HG1      THR  23  -0.845   6.480  -1.787
  120   HG21  THR  23          HG21      THR  23   1.006   4.048  -3.400
  121   HG22  THR  23          HG22      THR  23   0.974   4.760  -1.786
  122   HG23  THR  23          HG23      THR  23   0.969   5.801  -3.209
  123    H    ARG  24           HN       ARG  24  -1.916   2.855  -4.725
  124    HA   ARG  24           HA       ARG  24   0.325   2.488  -6.573
  125    HB2  ARG  24           HB2      ARG  24  -0.881   0.068  -6.567
  126    HB3  ARG  24           HB1      ARG  24   0.224   0.576  -5.290
  127    HG2  ARG  24           HG2      ARG  24  -1.565   1.191  -3.842
  128    HG3  ARG  24           HG1      ARG  24  -2.753   1.080  -5.140
  129    HD2  ARG  24           HD2      ARG  24  -1.183  -1.219  -3.941
  130    HD3  ARG  24           HD1      ARG  24  -2.902  -0.904  -3.719
  131    HE   ARG  24           HE       ARG  24  -2.389  -1.109  -6.480
  132   HH11  ARG  24          HH21      ARG  24  -2.362  -3.010  -3.590
  133   HH12  ARG  24          HH22      ARG  24  -2.733  -4.496  -4.397
  134   HH21  ARG  24          HH11      ARG  24  -2.877  -3.053  -7.547
  135   HH22  ARG  24          HH12      ARG  24  -3.025  -4.520  -6.639
  136    H    CYS  25           HN       CYS  25  -2.145   4.145  -7.215
  137    HA   CYS  25           HA       CYS  25  -3.471   2.637  -9.293
  138    HB2  CYS  25           HB2      CYS  25  -4.806   4.263  -8.156
  139    HB3  CYS  25           HB1      CYS  25  -3.627   5.537  -8.465
  140    HA   PRO  26           HA       PRO  26  -0.376   3.797 -12.336
  141    HB2  PRO  26           HB2      PRO  26  -1.571   2.891 -14.595
  142    HB3  PRO  26           HB1      PRO  26  -0.933   1.781 -13.363
  143    HG2  PRO  26           HG2      PRO  26  -3.751   2.683 -13.808
  144    HG3  PRO  26           HG1      PRO  26  -3.133   1.052 -13.488
  145    HD2  PRO  26           HD2      PRO  26  -4.227   2.628 -11.529
  146    HD3  PRO  26           HD1      PRO  26  -2.966   1.418 -11.201
  147    H    TYR  27           HN       TYR  27  -2.415   5.787 -11.461
  148    HA   TYR  27           HA       TYR  27  -2.234   7.556 -13.785
  149    HB2  TYR  27           HB2      TYR  27  -4.859   6.809 -12.478
  150    HB3  TYR  27           HB1      TYR  27  -4.642   8.188 -13.552
  151    HD1  TYR  27           HD2      TYR  27  -3.372   7.615 -15.834
  152    HD2  TYR  27           HD1      TYR  27  -5.546   4.785 -13.442
  153    HE1  TYR  27           HE2      TYR  27  -3.624   6.138 -17.809
  154    HE2  TYR  27           HE1      TYR  27  -5.798   3.309 -15.419
  155    HH   TYR  27           HH       TYR  27  -4.072   3.884 -18.373
  156    H    LYS  28           HN       LYS  28  -1.120   7.347 -11.039
  157    HA   LYS  28           HA       LYS  28  -2.314   9.322  -9.394
  158    HB2  LYS  28           HB2      LYS  28  -0.204   9.250  -8.119
  159    HB3  LYS  28           HB1      LYS  28  -0.841   7.641  -8.432
  160    HG2  LYS  28           HG2      LYS  28   1.106   8.745 -10.441
  161    HG3  LYS  28           HG1      LYS  28   1.754   8.285  -8.876
  162    HD2  LYS  28           HD2      LYS  28   0.583   6.031  -9.197
  163    HD3  LYS  28           HD1      LYS  28   0.309   6.524 -10.867
  164    HE2  LYS  28           HE2      LYS  28   2.372   5.193 -10.669
  165    HE3  LYS  28           HE1      LYS  28   2.730   6.842 -11.178
  166    HZ1  LYS  28           HZ1      LYS  28   3.848   7.247  -9.311
  167    HZ2  LYS  28           HZ2      LYS  28   3.861   5.565  -9.075
  168    HZ3  LYS  28           HZ3      LYS  28   2.673   6.522  -8.326
  169    H    ASP  29           HN       ASP  29  -1.401   9.920 -12.310
  170    HA   ASP  29           HA       ASP  29   0.569  11.882 -12.249
  171    HB2  ASP  29           HB2      ASP  29  -0.068  12.297 -14.452
  172    HB3  ASP  29           HB1      ASP  29  -0.570  10.640 -14.212
  173    H    THR  30           HN       THR  30  -2.271  11.871 -10.680
  174    HA   THR  30           HA       THR  30  -2.661  14.812 -10.805
  175    HB   THR  30           HB       THR  30  -4.773  13.982 -11.252
  176    HG1  THR  30           HG1      THR  30  -5.926  13.927  -9.257
  177   HG21  THR  30          HG21      THR  30  -4.395  11.655 -11.311
  178   HG22  THR  30          HG22      THR  30  -5.597  11.850 -10.037
  179   HG23  THR  30          HG23      THR  30  -3.904  11.599  -9.619
  180    H    LEU  31           HN       LEU  31  -3.824  12.746  -8.238
  181    HA   LEU  31           HA       LEU  31  -1.693  13.393  -6.406
  182    HB2  LEU  31           HB2      LEU  31  -3.086  15.511  -6.544
  183    HB3  LEU  31           HB1      LEU  31  -4.414  14.584  -5.852
  184    HG   LEU  31           HG       LEU  31  -2.661  13.946  -3.992
  185   HD11  LEU  31          HD11      LEU  31  -1.085  15.875  -3.580
  186   HD12  LEU  31          HD12      LEU  31  -1.459  16.458  -5.199
  187   HD13  LEU  31          HD13      LEU  31  -0.668  14.898  -4.984
  188   HD21  LEU  31          HD21      LEU  31  -3.922  16.693  -4.249
  189   HD22  LEU  31          HD22      LEU  31  -3.261  16.047  -2.747
  190   HD23  LEU  31          HD23      LEU  31  -4.643  15.262  -3.512
  191    H    GLY  32           HN       GLY  32  -1.536  11.294  -5.781
  192    HA2  GLY  32           HA2      GLY  32  -3.689   9.517  -5.381
  193    HA3  GLY  32           HA1      GLY  32  -2.064   9.316  -4.732
  Start of MODEL   13
    1    H1   LYS   9           HT1      LYS   9 -10.132  -3.914   4.253
    2    H2   LYS   9           HT2      LYS   9 -11.730  -3.833   3.680
    3    H3   LYS   9           HT3      LYS   9 -10.572  -2.713   3.140
    4    HA   LYS   9           HA       LYS   9  -9.299  -4.625   2.183
    5    HB2  LYS   9           HB2      LYS   9 -11.939  -6.066   2.483
    6    HB3  LYS   9           HB1      LYS   9 -10.390  -6.728   1.957
    7    HG2  LYS   9           HG2      LYS   9  -9.474  -6.187   4.244
    8    HG3  LYS   9           HG1      LYS   9 -11.114  -5.765   4.738
    9    HD2  LYS   9           HD2      LYS   9 -11.820  -8.080   3.958
   10    HD3  LYS   9           HD1      LYS   9 -10.105  -8.462   3.809
   11    HE2  LYS   9           HE2      LYS   9  -9.872  -7.680   6.237
   12    HE3  LYS   9           HE1      LYS   9 -11.633  -7.727   6.311
   13    HZ1  LYS   9           HZ1      LYS   9 -11.128  -9.834   6.974
   14    HZ2  LYS   9           HZ2      LYS   9  -9.720  -9.929   6.028
   15    HZ3  LYS   9           HZ3      LYS   9 -11.248 -10.091   5.302
   16    H    ILE  10           HN       ILE  10 -12.200  -2.870   2.059
   17    HA   ILE  10           HA       ILE  10 -12.905  -3.435  -0.661
   18    HB   ILE  10           HB       ILE  10 -14.623  -2.668   0.861
   19   HG12  ILE  10          HG12      ILE  10 -15.584  -0.838  -0.446
   20   HG13  ILE  10          HG11      ILE  10 -14.009  -0.459  -1.136
   21   HG21  ILE  10          HG21      ILE  10 -14.544  -0.717   2.135
   22   HG22  ILE  10          HG22      ILE  10 -13.391   0.073   1.063
   23   HG23  ILE  10          HG23      ILE  10 -12.850  -1.197   2.159
   24   HD11  ILE  10          HD11      ILE  10 -15.154  -3.231  -1.439
   25   HD12  ILE  10          HD12      ILE  10 -13.980  -2.397  -2.458
   26   HD13  ILE  10          HD13      ILE  10 -15.679  -1.934  -2.512
   27    H    VAL  11           HN       VAL  11 -10.969  -3.156  -1.799
   28    HA   VAL  11           HA       VAL  11  -9.592  -0.610  -1.787
   29    HB   VAL  11           HB       VAL  11  -8.318  -2.645  -2.165
   30   HG11  VAL  11          HG11      VAL  11  -8.681  -4.078  -4.052
   31   HG12  VAL  11          HG12      VAL  11  -9.833  -2.951  -4.767
   32   HG13  VAL  11          HG13      VAL  11 -10.261  -3.841  -3.307
   33   HG21  VAL  11          HG21      VAL  11  -7.737  -0.441  -3.318
   34   HG22  VAL  11          HG22      VAL  11  -8.452  -1.126  -4.777
   35   HG23  VAL  11          HG23      VAL  11  -7.043  -1.891  -4.042
   36    H    SER  12           HN       SER  12  -9.927   1.057  -3.005
   37    HA   SER  12           HA       SER  12 -11.107   0.871  -5.626
   38    HB2  SER  12           HB2      SER  12 -12.625   2.442  -3.548
   39    HB3  SER  12           HB1      SER  12 -13.063   2.167  -5.232
   40    HG   SER  12           HG       SER  12 -13.176  -0.083  -4.706
   41    H    CYS  13           HN       CYS  13 -10.042   2.232  -6.777
   42    HA   CYS  13           HA       CYS  13  -8.268   4.183  -5.795
   43    HB2  CYS  13           HB2      CYS  13  -8.312   3.030  -8.098
   44    HB3  CYS  13           HB1      CYS  13  -9.478   4.268  -8.551
   45    H    ARG  14           HN       ARG  14  -8.551   6.517  -7.010
   46    HA   ARG  14           HA       ARG  14 -11.230   7.586  -6.358
   47    HB2  ARG  14           HB2      ARG  14  -8.566   8.599  -5.345
   48    HB3  ARG  14           HB1      ARG  14 -10.038   9.573  -5.332
   49    HG2  ARG  14           HG2      ARG  14 -11.169   7.820  -3.990
   50    HG3  ARG  14           HG1      ARG  14  -9.670   6.890  -3.966
   51    HD2  ARG  14           HD2      ARG  14  -9.925   8.215  -1.899
   52    HD3  ARG  14           HD1      ARG  14  -8.522   8.740  -2.826
   53    HE   ARG  14           HE       ARG  14 -10.511  10.388  -3.703
   54   HH11  ARG  14          HH21      ARG  14  -9.292   9.457  -0.602
   55   HH12  ARG  14          HH22      ARG  14  -9.671  10.967   0.155
   56   HH21  ARG  14          HH11      ARG  14 -11.012  12.373  -2.717
   57   HH22  ARG  14          HH12      ARG  14 -10.646  12.618  -1.043
   58    H    ILE  15           HN       ILE  15  -9.654   6.951  -8.838
   59    HA   ILE  15           HA       ILE  15 -10.032   9.558 -10.152
   60    HB   ILE  15           HB       ILE  15  -7.540   7.857 -10.446
   61   HG12  ILE  15          HG12      ILE  15  -6.611  10.294  -9.757
   62   HG13  ILE  15          HG11      ILE  15  -8.180  10.401  -8.964
   63   HG21  ILE  15          HG21      ILE  15  -6.863   9.835 -11.916
   64   HG22  ILE  15          HG22      ILE  15  -8.563  10.305 -11.898
   65   HG23  ILE  15          HG23      ILE  15  -8.084   8.753 -12.586
   66   HD11  ILE  15          HD11      ILE  15  -6.930   9.448  -7.264
   67   HD12  ILE  15          HD12      ILE  15  -5.867   8.593  -8.380
   68   HD13  ILE  15          HD13      ILE  15  -7.488   7.979  -8.063
   69    H    CYS  16           HN       CYS  16  -9.580   6.068 -10.393
   70    HA   CYS  16           HA       CYS  16 -11.226   6.055 -12.847
   71    HB2  CYS  16           HB2      CYS  16  -9.761   4.452 -13.888
   72    HB3  CYS  16           HB1      CYS  16  -8.789   5.836 -13.388
   73    H    LYS  17           HN       LYS  17 -10.673   4.902  -9.731
   74    HA   LYS  17           HA       LYS  17 -11.517   3.157  -8.494
   75    HB2  LYS  17           HB2      LYS  17 -13.796   3.128 -10.463
   76    HB3  LYS  17           HB1      LYS  17 -13.833   2.859  -8.721
   77    HG2  LYS  17           HG2      LYS  17 -13.168   5.229  -8.362
   78    HG3  LYS  17           HG1      LYS  17 -13.233   5.489 -10.106
   79    HD2  LYS  17           HD2      LYS  17 -15.575   5.104 -10.186
   80    HD3  LYS  17           HD1      LYS  17 -15.596   4.416  -8.562
   81    HE2  LYS  17           HE2      LYS  17 -16.452   6.797  -8.711
   82    HE3  LYS  17           HE1      LYS  17 -15.135   6.557  -7.564
   83    HZ1  LYS  17           HZ1      LYS  17 -13.626   7.582  -8.942
   84    HZ2  LYS  17           HZ2      LYS  17 -15.024   8.500  -9.240
   85    HZ3  LYS  17           HZ3      LYS  17 -14.538   7.306 -10.346
   86    H    GLY  18           HN       GLY  18  -9.605   2.197 -10.112
   87    HA2  GLY  18           HA2      GLY  18 -10.619  -0.052 -11.673
   88    HA3  GLY  18           HA1      GLY  18  -8.930   0.407 -11.464
   89    H    ASP  19           HN       ASP  19  -7.719  -0.631  -9.973
   90    HA   ASP  19           HA       ASP  19  -8.945  -2.054  -7.757
   91    HB2  ASP  19           HB2      ASP  19  -8.881  -3.499  -9.972
   92    HB3  ASP  19           HB1      ASP  19  -7.186  -3.703  -9.551
   93    H    HIS  20           HN       HIS  20  -7.659  -0.444  -6.637
   94    HA   HIS  20           HA       HIS  20  -5.161  -1.433  -5.777
   95    HB2  HIS  20           HB2      HIS  20  -3.998   0.852  -6.651
   96    HB3  HIS  20           HB1      HIS  20  -3.940  -0.649  -7.571
   97    HD2  HIS  20           HD2      HIS  20  -5.961   2.751  -7.617
   98    HE1  HIS  20           HE1      HIS  20  -6.539   0.780 -11.304
   99    H    TRP  21           HN       TRP  21  -4.158  -0.019  -4.215
  100    HA   TRP  21           HA       TRP  21  -6.080   1.228  -2.507
  101    HB2  TRP  21           HB2      TRP  21  -3.081   0.908  -2.434
  102    HB3  TRP  21           HB1      TRP  21  -3.926   1.863  -1.218
  103    HD1  TRP  21           HD1      TRP  21  -3.865  -1.708  -2.666
  104    HE1  TRP  21           HE1      TRP  21  -4.688  -3.336  -0.843
  105    HE3  TRP  21           HE3      TRP  21  -5.168   1.628   0.976
  106    HZ2  TRP  21           HZ2      TRP  21  -5.757  -3.236   1.808
  107    HZ3  TRP  21           HZ3      TRP  21  -6.085   0.835   3.137
  108    HH2  TRP  21           HH2      TRP  21  -6.380  -1.590   3.558
  109    H    THR  22           HN       THR  22  -5.781   2.471  -5.157
  110    HA   THR  22           HA       THR  22  -5.792   4.578  -6.055
  111    HB   THR  22           HB       THR  22  -5.523   5.697  -3.267
  112    HG1  THR  22           HG1      THR  22  -7.175   4.415  -2.901
  113   HG21  THR  22          HG21      THR  22  -6.848   7.502  -4.167
  114   HG22  THR  22          HG22      THR  22  -7.157   6.601  -5.651
  115   HG23  THR  22          HG23      THR  22  -5.534   7.191  -5.299
  116    H    THR  23           HN       THR  23  -3.713   4.995  -3.182
  117    HA   THR  23           HA       THR  23  -1.813   6.660  -4.194
  118    HB   THR  23           HB       THR  23  -0.239   5.698  -2.585
  119    HG1  THR  23           HG1      THR  23  -2.126   3.593  -2.597
  120   HG21  THR  23          HG21      THR  23  -3.112   5.737  -1.623
  121   HG22  THR  23          HG22      THR  23  -2.015   7.116  -1.700
  122   HG23  THR  23          HG23      THR  23  -1.699   5.800  -0.569
  123    H    ARG  24           HN       ARG  24  -1.822   3.106  -4.504
  124    HA   ARG  24           HA       ARG  24   0.479   3.211  -6.316
  125    HB2  ARG  24           HB2      ARG  24   0.482   0.814  -6.185
  126    HB3  ARG  24           HB1      ARG  24   0.231   1.435  -4.550
  127    HG2  ARG  24           HG2      ARG  24  -2.301   1.204  -5.073
  128    HG3  ARG  24           HG1      ARG  24  -1.783   0.178  -6.411
  129    HD2  ARG  24           HD2      ARG  24  -1.073  -0.246  -3.496
  130    HD3  ARG  24           HD1      ARG  24  -2.274  -1.165  -4.400
  131    HE   ARG  24           HE       ARG  24   0.209  -1.278  -5.757
  132   HH11  ARG  24          HH21      ARG  24  -1.394  -2.369  -2.892
  133   HH12  ARG  24          HH22      ARG  24  -0.456  -3.819  -2.753
  134   HH21  ARG  24          HH11      ARG  24   1.441  -3.177  -5.583
  135   HH22  ARG  24          HH12      ARG  24   1.148  -4.277  -4.277
  136    H    CYS  25           HN       CYS  25  -2.123   4.404  -7.081
  137    HA   CYS  25           HA       CYS  25  -3.431   2.727  -8.956
  138    HB2  CYS  25           HB2      CYS  25  -4.643   4.609  -8.163
  139    HB3  CYS  25           HB1      CYS  25  -3.336   5.717  -8.574
  140    HA   PRO  26           HA       PRO  26  -0.348   3.050 -12.201
  141    HB2  PRO  26           HB2      PRO  26  -1.758   2.050 -14.305
  142    HB3  PRO  26           HB1      PRO  26  -1.192   1.025 -12.970
  143    HG2  PRO  26           HG2      PRO  26  -3.903   2.201 -13.425
  144    HG3  PRO  26           HG1      PRO  26  -3.463   0.562 -12.910
  145    HD2  PRO  26           HD2      PRO  26  -4.273   2.491 -11.144
  146    HD3  PRO  26           HD1      PRO  26  -3.135   1.200 -10.699
  147    H    TYR  27           HN       TYR  27  -2.829   5.097 -11.762
  148    HA   TYR  27           HA       TYR  27  -2.043   6.806 -14.025
  149    HB2  TYR  27           HB2      TYR  27  -4.941   6.311 -13.305
  150    HB3  TYR  27           HB1      TYR  27  -4.329   7.326 -14.610
  151    HD1  TYR  27           HD2      TYR  27  -2.511   5.998 -16.163
  152    HD2  TYR  27           HD1      TYR  27  -5.737   4.208 -13.955
  153    HE1  TYR  27           HE2      TYR  27  -2.467   4.042 -17.683
  154    HE2  TYR  27           HE1      TYR  27  -5.691   2.254 -15.480
  155    HH   TYR  27           HH       TYR  27  -3.298   2.032 -18.115
  156    H    LYS  28           HN       LYS  28  -1.096   7.198 -11.547
  157    HA   LYS  28           HA       LYS  28  -2.820   9.003 -10.056
  158    HB2  LYS  28           HB2      LYS  28  -0.564   9.301  -8.735
  159    HB3  LYS  28           HB1      LYS  28  -1.469   7.797  -8.590
  160    HG2  LYS  28           HG2      LYS  28   0.977   7.443  -8.977
  161    HG3  LYS  28           HG1      LYS  28  -0.035   6.705 -10.215
  162    HD2  LYS  28           HD2      LYS  28   0.453   8.428 -11.788
  163    HD3  LYS  28           HD1      LYS  28   1.133   9.475 -10.541
  164    HE2  LYS  28           HE2      LYS  28   2.325   6.777 -11.203
  165    HE3  LYS  28           HE1      LYS  28   2.817   8.253 -12.033
  166    HZ1  LYS  28           HZ1      LYS  28   2.747   8.291  -9.111
  167    HZ2  LYS  28           HZ2      LYS  28   3.799   9.086 -10.182
  168    HZ3  LYS  28           HZ3      LYS  28   4.009   7.433  -9.853
  169    H    ASP  29           HN       ASP  29  -1.741   9.511 -12.876
  170    HA   ASP  29           HA       ASP  29   0.093  11.586 -12.870
  171    HB2  ASP  29           HB2      ASP  29  -0.501  11.847 -15.106
  172    HB3  ASP  29           HB1      ASP  29  -0.948  10.187 -14.788
  173    H    THR  30           HN       THR  30  -2.814  11.533 -11.392
  174    HA   THR  30           HA       THR  30  -3.689  14.240 -11.918
  175    HB   THR  30           HB       THR  30  -5.357  13.789 -10.162
  176    HG1  THR  30           HG1      THR  30  -4.406  11.176  -9.940
  177   HG21  THR  30          HG21      THR  30  -5.074  11.357 -11.935
  178   HG22  THR  30          HG22      THR  30  -5.582  12.931 -12.550
  179   HG23  THR  30          HG23      THR  30  -6.561  12.097 -11.342
  180    H    LEU  31           HN       LEU  31  -1.828  12.549  -9.458
  181    HA   LEU  31           HA       LEU  31  -1.731  14.782  -7.645
  182    HB2  LEU  31           HB2      LEU  31  -0.278  12.144  -7.821
  183    HB3  LEU  31           HB1      LEU  31   0.173  13.361  -6.628
  184    HG   LEU  31           HG       LEU  31  -2.056  13.341  -5.676
  185   HD11  LEU  31          HD11      LEU  31  -3.692  11.575  -6.615
  186   HD12  LEU  31          HD12      LEU  31  -2.674  11.584  -8.056
  187   HD13  LEU  31          HD13      LEU  31  -3.491  13.061  -7.542
  188   HD21  LEU  31          HD21      LEU  31  -0.555  11.608  -4.850
  189   HD22  LEU  31          HD22      LEU  31  -0.988  10.547  -6.191
  190   HD23  LEU  31          HD23      LEU  31  -2.185  10.943  -4.957
  191    H    GLY  32           HN       GLY  32   0.199  15.968  -7.099
  192    HA2  GLY  32           HA2      GLY  32   2.653  16.000  -8.266
  193    HA3  GLY  32           HA1      GLY  32   1.645  16.833  -9.447
  Start of MODEL   14
    1    H1   LYS   9           HT1      LYS   9 -10.635  -6.982  -0.871
    2    H2   LYS   9           HT2      LYS   9  -9.123  -7.730  -0.673
    3    H3   LYS   9           HT3      LYS   9 -10.517  -8.440  -0.011
    4    HA   LYS   9           HA       LYS   9  -9.543  -9.363  -2.205
    5    HB2  LYS   9           HB2      LYS   9 -11.705 -10.003  -1.090
    6    HB3  LYS   9           HB1      LYS   9 -12.495  -8.706  -1.987
    7    HG2  LYS   9           HG2      LYS   9 -12.028  -9.740  -4.089
    8    HG3  LYS   9           HG1      LYS   9 -10.904 -10.884  -3.354
    9    HD2  LYS   9           HD2      LYS   9 -12.684 -12.027  -2.212
   10    HD3  LYS   9           HD1      LYS   9 -13.847 -10.775  -2.652
   11    HE2  LYS   9           HE2      LYS   9 -12.374 -12.486  -4.673
   12    HE3  LYS   9           HE1      LYS   9 -13.994 -12.847  -4.078
   13    HZ1  LYS   9           HZ1      LYS   9 -13.184 -10.961  -6.041
   14    HZ2  LYS   9           HZ2      LYS   9 -14.052 -10.196  -4.797
   15    HZ3  LYS   9           HZ3      LYS   9 -14.744 -11.495  -5.646
   16    H    ILE  10           HN       ILE  10 -11.820  -6.613  -2.389
   17    HA   ILE  10           HA       ILE  10 -10.443  -5.657  -4.803
   18    HB   ILE  10           HB       ILE  10 -12.427  -7.132  -5.404
   19   HG12  ILE  10          HG12      ILE  10 -12.454  -4.214  -6.242
   20   HG13  ILE  10          HG11      ILE  10 -11.470  -5.490  -6.961
   21   HG21  ILE  10          HG21      ILE  10 -14.142  -4.779  -4.623
   22   HG22  ILE  10          HG22      ILE  10 -13.810  -6.059  -3.454
   23   HG23  ILE  10          HG23      ILE  10 -14.623  -6.439  -4.972
   24   HD11  ILE  10          HD11      ILE  10 -13.373  -5.249  -8.389
   25   HD12  ILE  10          HD12      ILE  10 -14.482  -5.220  -7.019
   26   HD13  ILE  10          HD13      ILE  10 -13.654  -6.716  -7.451
   27    H    VAL  11           HN       VAL  11  -9.871  -3.647  -4.366
   28    HA   VAL  11           HA       VAL  11 -11.615  -1.956  -2.664
   29    HB   VAL  11           HB       VAL  11  -9.402  -2.321  -1.708
   30   HG11  VAL  11          HG11      VAL  11  -8.344  -2.743  -4.002
   31   HG12  VAL  11          HG12      VAL  11  -7.386  -1.787  -2.871
   32   HG13  VAL  11          HG13      VAL  11  -8.267  -0.990  -4.175
   33   HG21  VAL  11          HG21      VAL  11 -10.585  -0.047  -1.637
   34   HG22  VAL  11          HG22      VAL  11  -9.465   0.458  -2.903
   35   HG23  VAL  11          HG23      VAL  11  -8.849  -0.030  -1.324
   36    H    SER  12           HN       SER  12 -12.344  -0.064  -3.367
   37    HA   SER  12           HA       SER  12 -12.088   0.496  -6.210
   38    HB2  SER  12           HB2      SER  12 -13.710   2.331  -5.687
   39    HB3  SER  12           HB1      SER  12 -14.291   0.711  -5.314
   40    HG   SER  12           HG       SER  12 -14.540   1.415  -3.356
   41    H    CYS  13           HN       CYS  13 -10.603   1.717  -6.984
   42    HA   CYS  13           HA       CYS  13  -8.706   3.184  -5.527
   43    HB2  CYS  13           HB2      CYS  13  -8.648   2.349  -7.981
   44    HB3  CYS  13           HB1      CYS  13  -9.456   3.864  -8.362
   45    H    ARG  14           HN       ARG  14  -8.650   5.695  -6.923
   46    HA   ARG  14           HA       ARG  14 -11.128   7.059  -6.126
   47    HB2  ARG  14           HB2      ARG  14  -9.236   6.952  -4.250
   48    HB3  ARG  14           HB1      ARG  14  -8.550   8.277  -5.184
   49    HG2  ARG  14           HG2      ARG  14  -9.925   9.452  -3.708
   50    HG3  ARG  14           HG1      ARG  14 -11.017   9.242  -5.074
   51    HD2  ARG  14           HD2      ARG  14 -12.103   8.675  -2.914
   52    HD3  ARG  14           HD1      ARG  14 -12.035   7.291  -3.998
   53    HE   ARG  14           HE       ARG  14  -9.753   7.096  -2.470
   54   HH11  ARG  14          HH21      ARG  14 -13.155   7.352  -1.895
   55   HH12  ARG  14          HH22      ARG  14 -13.116   6.436  -0.426
   56   HH21  ARG  14          HH11      ARG  14  -9.693   5.896  -0.544
   57   HH22  ARG  14          HH12      ARG  14 -11.155   5.611   0.340
   58    H    ILE  15           HN       ILE  15  -9.057   6.482  -8.471
   59    HA   ILE  15           HA       ILE  15  -9.301   9.194  -9.653
   60    HB   ILE  15           HB       ILE  15  -6.970   7.291  -9.999
   61   HG12  ILE  15          HG12      ILE  15  -6.934   9.999  -8.647
   62   HG13  ILE  15          HG11      ILE  15  -7.218   8.516  -7.737
   63   HG21  ILE  15          HG21      ILE  15  -5.993   9.400 -11.078
   64   HG22  ILE  15          HG22      ILE  15  -7.641  10.027 -11.095
   65   HG23  ILE  15          HG23      ILE  15  -7.246   8.563 -11.995
   66   HD11  ILE  15          HD11      ILE  15  -5.092   7.590  -8.623
   67   HD12  ILE  15          HD12      ILE  15  -4.837   9.061  -7.685
   68   HD13  ILE  15          HD13      ILE  15  -4.791   9.120  -9.447
   69    H    CYS  16           HN       CYS  16  -9.139   5.715 -10.088
   70    HA   CYS  16           HA       CYS  16 -10.534   5.980 -12.690
   71    HB2  CYS  16           HB2      CYS  16  -9.242   4.170 -13.583
   72    HB3  CYS  16           HB1      CYS  16  -8.096   5.325 -12.902
   73    H    LYS  17           HN       LYS  17 -10.488   4.801  -9.547
   74    HA   LYS  17           HA       LYS  17 -11.799   3.341  -8.374
   75    HB2  LYS  17           HB2      LYS  17 -13.614   3.601 -10.781
   76    HB3  LYS  17           HB1      LYS  17 -14.071   3.024  -9.185
   77    HG2  LYS  17           HG2      LYS  17 -12.802   5.741  -9.445
   78    HG3  LYS  17           HG1      LYS  17 -14.503   5.551  -9.852
   79    HD2  LYS  17           HD2      LYS  17 -13.559   4.380  -7.249
   80    HD3  LYS  17           HD1      LYS  17 -13.720   6.131  -7.351
   81    HE2  LYS  17           HE2      LYS  17 -15.781   4.709  -6.584
   82    HE3  LYS  17           HE1      LYS  17 -16.030   6.032  -7.724
   83    HZ1  LYS  17           HZ1      LYS  17 -15.884   4.422  -9.537
   84    HZ2  LYS  17           HZ2      LYS  17 -17.156   4.053  -8.474
   85    HZ3  LYS  17           HZ3      LYS  17 -15.711   3.162  -8.415
   86    H    GLY  18           HN       GLY  18  -9.737   2.190  -9.901
   87    HA2  GLY  18           HA2      GLY  18 -10.809  -0.164 -11.242
   88    HA3  GLY  18           HA1      GLY  18  -9.108   0.247 -11.041
   89    H    ASP  19           HN       ASP  19  -8.220  -1.470 -10.053
   90    HA   ASP  19           HA       ASP  19  -9.481  -2.472  -7.554
   91    HB2  ASP  19           HB2      ASP  19  -8.527  -4.651  -8.047
   92    HB3  ASP  19           HB1      ASP  19  -9.509  -4.123  -9.413
   93    H    HIS  20           HN       HIS  20  -8.063  -0.450  -6.921
   94    HA   HIS  20           HA       HIS  20  -5.942  -1.365  -5.361
   95    HB2  HIS  20           HB2      HIS  20  -4.089  -0.080  -6.640
   96    HB3  HIS  20           HB1      HIS  20  -4.538  -1.680  -7.220
   97    HD2  HIS  20           HD2      HIS  20  -5.832   2.002  -8.124
   98    HE1  HIS  20           HE1      HIS  20  -5.556  -0.308 -11.643
   99    H    TRP  21           HN       TRP  21  -5.166   0.232  -3.999
  100    HA   TRP  21           HA       TRP  21  -6.831   2.448  -3.526
  101    HB2  TRP  21           HB2      TRP  21  -4.029   1.812  -2.584
  102    HB3  TRP  21           HB1      TRP  21  -4.947   3.204  -2.010
  103    HD1  TRP  21           HD1      TRP  21  -5.423  -0.628  -2.316
  104    HE1  TRP  21           HE1      TRP  21  -6.788  -1.427  -0.280
  105    HE3  TRP  21           HE3      TRP  21  -6.304   3.853  -0.029
  106    HZ2  TRP  21           HZ2      TRP  21  -8.082  -0.313   2.015
  107    HZ3  TRP  21           HZ3      TRP  21  -7.604   3.955   2.078
  108    HH2  TRP  21           HH2      TRP  21  -8.493   1.880   3.102
  109    H    THR  22           HN       THR  22  -5.224   4.631  -3.091
  110    HA   THR  22           HA       THR  22  -4.882   5.628  -5.797
  111    HB   THR  22           HB       THR  22  -4.548   7.790  -4.737
  112    HG1  THR  22           HG1      THR  22  -4.894   6.766  -2.190
  113   HG21  THR  22          HG21      THR  22  -6.691   6.380  -3.146
  114   HG22  THR  22          HG22      THR  22  -6.864   6.681  -4.875
  115   HG23  THR  22          HG23      THR  22  -6.694   8.035  -3.757
  116    H    THR  23           HN       THR  23  -2.825   5.390  -2.884
  117    HA   THR  23           HA       THR  23  -0.431   6.288  -3.882
  118    HB   THR  23           HB       THR  23   0.659   4.745  -2.261
  119    HG1  THR  23           HG1      THR  23  -1.647   3.427  -2.652
  120   HG21  THR  23          HG21      THR  23  -0.440   5.661  -0.273
  121   HG22  THR  23          HG22      THR  23  -1.868   6.061  -1.229
  122   HG23  THR  23          HG23      THR  23  -0.343   6.893  -1.531
  123    H    ARG  24           HN       ARG  24  -2.179   3.511  -4.853
  124    HA   ARG  24           HA       ARG  24   0.110   2.596  -6.510
  125    HB2  ARG  24           HB2      ARG  24  -1.185   0.311  -6.343
  126    HB3  ARG  24           HB1      ARG  24  -0.126   0.813  -5.023
  127    HG2  ARG  24           HG2      ARG  24  -2.001   1.660  -3.749
  128    HG3  ARG  24           HG1      ARG  24  -3.103   1.372  -5.096
  129    HD2  ARG  24           HD2      ARG  24  -1.604  -0.719  -3.497
  130    HD3  ARG  24           HD1      ARG  24  -3.343  -0.446  -3.507
  131    HE   ARG  24           HE       ARG  24  -2.543  -0.962  -6.147
  132   HH11  ARG  24          HH21      ARG  24  -2.687  -2.509  -3.056
  133   HH12  ARG  24          HH22      ARG  24  -2.902  -4.100  -3.707
  134   HH21  ARG  24          HH11      ARG  24  -2.824  -3.044  -7.010
  135   HH22  ARG  24          HH12      ARG  24  -2.980  -4.402  -5.946
  136    H    CYS  25           HN       CYS  25  -1.366   4.512  -7.568
  137    HA   CYS  25           HA       CYS  25  -3.221   3.143  -9.445
  138    HB2  CYS  25           HB2      CYS  25  -4.381   4.715  -7.902
  139    HB3  CYS  25           HB1      CYS  25  -3.358   6.017  -8.511
  140    HA   PRO  26           HA       PRO  26   0.596   4.612 -11.727
  141    HB2  PRO  26           HB2      PRO  26  -0.788   2.698 -13.592
  142    HB3  PRO  26           HB1      PRO  26   0.949   2.914 -13.290
  143    HG2  PRO  26           HG2      PRO  26  -0.353   0.883 -12.203
  144    HG3  PRO  26           HG1      PRO  26   0.875   1.767 -11.276
  145    HD2  PRO  26           HD2      PRO  26  -2.106   1.856 -11.015
  146    HD3  PRO  26           HD1      PRO  26  -0.860   2.069  -9.764
  147    H    TYR  27           HN       TYR  27  -2.782   4.841 -12.130
  148    HA   TYR  27           HA       TYR  27  -2.660   6.404 -14.602
  149    HB2  TYR  27           HB2      TYR  27  -5.038   5.798 -12.832
  150    HB3  TYR  27           HB1      TYR  27  -5.077   6.434 -14.476
  151    HD1  TYR  27           HD2      TYR  27  -3.607   4.972 -16.209
  152    HD2  TYR  27           HD1      TYR  27  -5.403   3.495 -12.596
  153    HE1  TYR  27           HE2      TYR  27  -3.551   2.668 -17.122
  154    HE2  TYR  27           HE1      TYR  27  -5.345   1.191 -13.510
  155    HH   TYR  27           HH       TYR  27  -5.296   0.129 -15.810
  156    H    LYS  28           HN       LYS  28  -1.507   7.232 -11.896
  157    HA   LYS  28           HA       LYS  28  -3.089   9.505 -11.105
  158    HB2  LYS  28           HB2      LYS  28  -1.463   9.858  -9.429
  159    HB3  LYS  28           HB1      LYS  28  -1.570   8.108  -9.595
  160    HG2  LYS  28           HG2      LYS  28   0.574   9.920 -10.744
  161    HG3  LYS  28           HG1      LYS  28   0.768   8.706  -9.490
  162    HD2  LYS  28           HD2      LYS  28   0.056   6.968 -11.180
  163    HD3  LYS  28           HD1      LYS  28   0.154   8.228 -12.413
  164    HE2  LYS  28           HE2      LYS  28   2.526   8.628 -11.752
  165    HE3  LYS  28           HE1      LYS  28   2.409   7.276 -10.628
  166    HZ1  LYS  28           HZ1      LYS  28   1.460   6.527 -13.188
  167    HZ2  LYS  28           HZ2      LYS  28   2.726   5.854 -12.275
  168    HZ3  LYS  28           HZ3      LYS  28   3.027   7.163 -13.316
  169    H    ASP  29           HN       ASP  29  -1.764   9.138 -13.885
  170    HA   ASP  29           HA       ASP  29   0.098  11.250 -14.148
  171    HB2  ASP  29           HB2      ASP  29   0.049  10.710 -16.427
  172    HB3  ASP  29           HB1      ASP  29  -0.287   9.193 -15.628
  173    H    THR  30           HN       THR  30  -3.050  11.331 -13.406
  174    HA   THR  30           HA       THR  30  -3.805  13.658 -15.019
  175    HB   THR  30           HB       THR  30  -5.429  11.806 -14.526
  176    HG1  THR  30           HG1      THR  30  -5.862  14.216 -14.809
  177   HG21  THR  30          HG21      THR  30  -6.276  11.453 -12.363
  178   HG22  THR  30          HG22      THR  30  -5.641  12.986 -11.765
  179   HG23  THR  30          HG23      THR  30  -4.544  11.640 -12.084
  180    H    LEU  31           HN       LEU  31  -2.717  12.863 -11.795
  181    HA   LEU  31           HA       LEU  31  -3.527  15.008 -10.278
  182    HB2  LEU  31           HB2      LEU  31  -0.984  13.403 -10.342
  183    HB3  LEU  31           HB1      LEU  31  -1.089  14.799  -9.269
  184    HG   LEU  31           HG       LEU  31  -3.041  13.872  -8.163
  185   HD11  LEU  31          HD11      LEU  31  -4.230  12.798  -9.915
  186   HD12  LEU  31          HD12      LEU  31  -3.732  11.489  -8.844
  187   HD13  LEU  31          HD13      LEU  31  -2.850  11.787 -10.341
  188   HD21  LEU  31          HD21      LEU  31  -2.030  11.681  -7.343
  189   HD22  LEU  31          HD22      LEU  31  -0.967  13.085  -7.242
  190   HD23  LEU  31          HD23      LEU  31  -0.759  11.915  -8.544
  191    H    GLY  32           HN       GLY  32  -0.296  14.987 -11.785
  192    HA2  GLY  32           HA2      GLY  32   0.162  17.730 -11.605
  193    HA3  GLY  32           HA1      GLY  32   0.934  16.663 -12.774
  Start of MODEL   15
    1    H1   LYS   9           HT1      LYS   9 -13.366  -6.147   3.867
    2    H2   LYS   9           HT2      LYS   9 -12.009  -6.602   4.782
    3    H3   LYS   9           HT3      LYS   9 -12.245  -7.248   3.228
    4    HA   LYS   9           HA       LYS   9 -11.645  -4.421   3.898
    5    HB2  LYS   9           HB2      LYS   9  -9.822  -6.293   3.923
    6    HB3  LYS   9           HB1      LYS   9 -10.014  -6.286   2.173
    7    HG2  LYS   9           HG2      LYS   9  -8.314  -4.708   2.426
    8    HG3  LYS   9           HG1      LYS   9  -9.732  -3.663   2.446
    9    HD2  LYS   9           HD2      LYS   9  -9.707  -3.616   4.892
   10    HD3  LYS   9           HD1      LYS   9  -8.371  -4.766   4.927
   11    HE2  LYS   9           HE2      LYS   9  -6.982  -3.123   3.655
   12    HE3  LYS   9           HE1      LYS   9  -8.305  -1.964   3.776
   13    HZ1  LYS   9           HZ1      LYS   9  -6.366  -2.094   5.554
   14    HZ2  LYS   9           HZ2      LYS   9  -7.423  -3.230   6.249
   15    HZ3  LYS   9           HZ3      LYS   9  -7.946  -1.637   5.969
   16    H    ILE  10           HN       ILE  10 -11.519  -3.023   2.058
   17    HA   ILE  10           HA       ILE  10 -12.699  -4.002  -0.450
   18    HB   ILE  10           HB       ILE  10 -14.484  -3.065   1.092
   19   HG12  ILE  10          HG12      ILE  10 -15.465  -1.613  -0.737
   20   HG13  ILE  10          HG11      ILE  10 -13.929  -1.747  -1.587
   21   HG21  ILE  10          HG21      ILE  10 -14.544  -0.796   1.650
   22   HG22  ILE  10          HG22      ILE  10 -13.401  -0.345   0.386
   23   HG23  ILE  10          HG23      ILE  10 -12.832  -1.173   1.837
   24   HD11  ILE  10          HD11      ILE  10 -14.280  -3.958  -2.156
   25   HD12  ILE  10          HD12      ILE  10 -15.958  -3.434  -2.061
   26   HD13  ILE  10          HD13      ILE  10 -15.233  -4.300  -0.711
   27    H    VAL  11           HN       VAL  11 -11.323  -3.473  -1.986
   28    HA   VAL  11           HA       VAL  11  -9.675  -1.025  -1.723
   29    HB   VAL  11           HB       VAL  11  -8.387  -3.063  -2.011
   30   HG11  VAL  11          HG11      VAL  11 -10.281  -4.288  -3.205
   31   HG12  VAL  11          HG12      VAL  11  -8.670  -4.538  -3.877
   32   HG13  VAL  11          HG13      VAL  11  -9.791  -3.429  -4.666
   33   HG21  VAL  11          HG21      VAL  11  -8.410  -1.615  -4.665
   34   HG22  VAL  11          HG22      VAL  11  -7.032  -2.340  -3.836
   35   HG23  VAL  11          HG23      VAL  11  -7.776  -0.875  -3.194
   36    H    SER  12           HN       SER  12  -9.989   0.625  -2.951
   37    HA   SER  12           HA       SER  12 -11.024   0.413  -5.630
   38    HB2  SER  12           HB2      SER  12 -12.936   1.975  -5.172
   39    HB3  SER  12           HB1      SER  12 -13.152   0.343  -4.548
   40    HG   SER  12           HG       SER  12 -12.601   2.742  -3.191
   41    H    CYS  13           HN       CYS  13  -9.967   1.821  -6.745
   42    HA   CYS  13           HA       CYS  13  -8.337   3.856  -5.601
   43    HB2  CYS  13           HB2      CYS  13  -7.976   2.596  -7.798
   44    HB3  CYS  13           HB1      CYS  13  -9.167   3.684  -8.493
   45    H    ARG  14           HN       ARG  14  -8.518   6.180  -6.692
   46    HA   ARG  14           HA       ARG  14 -11.355   7.070  -6.509
   47    HB2  ARG  14           HB2      ARG  14 -10.706   8.987  -5.247
   48    HB3  ARG  14           HB1      ARG  14  -9.968   7.595  -4.457
   49    HG2  ARG  14           HG2      ARG  14  -7.871   8.080  -5.816
   50    HG3  ARG  14           HG1      ARG  14  -8.625   9.603  -6.284
   51    HD2  ARG  14           HD2      ARG  14  -8.972   9.951  -3.722
   52    HD3  ARG  14           HD1      ARG  14  -7.739   8.706  -3.550
   53    HE   ARG  14           HE       ARG  14  -6.176  10.295  -4.162
   54   HH11  ARG  14          HH21      ARG  14  -9.324  11.195  -5.282
   55   HH12  ARG  14          HH22      ARG  14  -8.815  12.729  -5.902
   56   HH21  ARG  14          HH11      ARG  14  -5.501  12.307  -4.972
   57   HH22  ARG  14          HH12      ARG  14  -6.651  13.359  -5.727
   58    H    ILE  15           HN       ILE  15  -8.389   7.123  -8.205
   59    HA   ILE  15           HA       ILE  15  -9.033   9.526  -9.741
   60    HB   ILE  15           HB       ILE  15  -6.763   7.547 -10.056
   61   HG12  ILE  15          HG12      ILE  15  -6.600  10.305  -8.818
   62   HG13  ILE  15          HG11      ILE  15  -6.973   8.891  -7.835
   63   HG21  ILE  15          HG21      ILE  15  -5.744   9.591 -11.222
   64   HG22  ILE  15          HG22      ILE  15  -7.376  10.259 -11.244
   65   HG23  ILE  15          HG23      ILE  15  -7.028   8.753 -12.094
   66   HD11  ILE  15          HD11      ILE  15  -4.533   9.157  -9.611
   67   HD12  ILE  15          HD12      ILE  15  -4.903   7.807  -8.538
   68   HD13  ILE  15          HD13      ILE  15  -4.540   9.397  -7.863
   69    H    CYS  16           HN       CYS  16  -9.046   6.030 -10.063
   70    HA   CYS  16           HA       CYS  16 -10.483   6.289 -12.636
   71    HB2  CYS  16           HB2      CYS  16  -9.214   4.475 -13.579
   72    HB3  CYS  16           HB1      CYS  16  -8.074   5.679 -12.979
   73    H    LYS  17           HN       LYS  17 -10.160   4.828  -9.534
   74    HA   LYS  17           HA       LYS  17 -11.471   3.349  -8.382
   75    HB2  LYS  17           HB2      LYS  17 -13.474   3.627 -10.624
   76    HB3  LYS  17           HB1      LYS  17 -13.772   3.191  -8.946
   77    HG2  LYS  17           HG2      LYS  17 -13.149   5.412  -8.190
   78    HG3  LYS  17           HG1      LYS  17 -12.649   5.867  -9.817
   79    HD2  LYS  17           HD2      LYS  17 -14.902   6.748  -9.271
   80    HD3  LYS  17           HD1      LYS  17 -14.946   5.624 -10.628
   81    HE2  LYS  17           HE2      LYS  17 -16.719   5.374  -8.719
   82    HE3  LYS  17           HE1      LYS  17 -15.944   3.926  -9.357
   83    HZ1  LYS  17           HZ1      LYS  17 -14.284   4.175  -7.525
   84    HZ2  LYS  17           HZ2      LYS  17 -15.859   3.803  -7.008
   85    HZ3  LYS  17           HZ3      LYS  17 -15.268   5.390  -6.868
   86    H    GLY  18           HN       GLY  18  -9.496   2.224  -9.910
   87    HA2  GLY  18           HA2      GLY  18 -10.632   0.006 -11.444
   88    HA3  GLY  18           HA1      GLY  18  -8.923   0.378 -11.245
   89    H    ASP  19           HN       ASP  19  -7.964  -1.304 -10.297
   90    HA   ASP  19           HA       ASP  19  -9.242  -2.530  -7.911
   91    HB2  ASP  19           HB2      ASP  19  -8.262  -4.652  -8.550
   92    HB3  ASP  19           HB1      ASP  19  -9.217  -4.034  -9.896
   93    H    HIS  20           HN       HIS  20  -7.888  -0.554  -7.090
   94    HA   HIS  20           HA       HIS  20  -5.723  -1.549  -5.617
   95    HB2  HIS  20           HB2      HIS  20  -3.925  -0.089  -6.727
   96    HB3  HIS  20           HB1      HIS  20  -4.352  -1.588  -7.548
   97    HD2  HIS  20           HD2      HIS  20  -5.438   2.242  -7.883
   98    HE1  HIS  20           HE1      HIS  20  -5.704   0.372 -11.658
   99    H    TRP  21           HN       TRP  21  -5.213  -0.161  -3.990
  100    HA   TRP  21           HA       TRP  21  -6.920   1.951  -3.356
  101    HB2  TRP  21           HB2      TRP  21  -4.147   1.241  -2.395
  102    HB3  TRP  21           HB1      TRP  21  -5.036   2.614  -1.739
  103    HD1  TRP  21           HD1      TRP  21  -4.958  -1.173  -1.785
  104    HE1  TRP  21           HE1      TRP  21  -6.644  -2.079  -0.057
  105    HE3  TRP  21           HE3      TRP  21  -7.333   3.165  -0.515
  106    HZ2  TRP  21           HZ2      TRP  21  -8.725  -1.092   1.639
  107    HZ3  TRP  21           HZ3      TRP  21  -9.161   3.154   1.157
  108    HH2  TRP  21           HH2      TRP  21  -9.860   1.033   2.236
  109    H    THR  22           HN       THR  22  -5.779   4.209  -2.737
  110    HA   THR  22           HA       THR  22  -5.274   5.480  -5.259
  111    HB   THR  22           HB       THR  22  -4.974   6.651  -2.487
  112    HG1  THR  22           HG1      THR  22  -7.147   5.793  -3.868
  113   HG21  THR  22          HG21      THR  22  -5.625   7.931  -5.156
  114   HG22  THR  22          HG22      THR  22  -4.035   7.960  -4.395
  115   HG23  THR  22          HG23      THR  22  -5.397   8.766  -3.619
  116    H    THR  23           HN       THR  23  -3.331   4.749  -2.381
  117    HA   THR  23           HA       THR  23  -0.960   6.020  -3.176
  118    HB   THR  23           HB       THR  23   0.156   4.543  -1.566
  119    HG1  THR  23           HG1      THR  23  -1.874   3.166  -0.635
  120   HG21  THR  23          HG21      THR  23  -2.574   5.584  -0.785
  121   HG22  THR  23          HG22      THR  23  -1.016   6.389  -0.590
  122   HG23  THR  23          HG23      THR  23  -1.408   4.977   0.392
  123    H    ARG  24           HN       ARG  24  -2.555   3.619  -4.774
  124    HA   ARG  24           HA       ARG  24  -0.122   2.850  -6.245
  125    HB2  ARG  24           HB2      ARG  24  -1.200   0.444  -6.279
  126    HB3  ARG  24           HB1      ARG  24  -0.212   0.948  -4.904
  127    HG2  ARG  24           HG2      ARG  24  -2.144   1.465  -3.587
  128    HG3  ARG  24           HG1      ARG  24  -3.217   1.294  -4.976
  129    HD2  ARG  24           HD2      ARG  24  -3.377  -0.721  -3.633
  130    HD3  ARG  24           HD1      ARG  24  -2.543  -1.113  -5.133
  131    HE   ARG  24           HE       ARG  24  -0.557  -0.461  -3.308
  132   HH11  ARG  24          HH21      ARG  24  -3.139  -2.746  -3.603
  133   HH12  ARG  24          HH22      ARG  24  -2.336  -3.978  -2.689
  134   HH21  ARG  24          HH11      ARG  24   0.501  -2.073  -2.107
  135   HH22  ARG  24          HH12      ARG  24  -0.276  -3.597  -1.841
  136    H    CYS  25           HN       CYS  25  -1.613   4.654  -7.349
  137    HA   CYS  25           HA       CYS  25  -3.578   3.321  -9.118
  138    HB2  CYS  25           HB2      CYS  25  -4.502   5.234  -7.963
  139    HB3  CYS  25           HB1      CYS  25  -3.154   6.245  -8.481
  140    HA   PRO  26           HA       PRO  26  -0.055   4.055 -11.942
  141    HB2  PRO  26           HB2      PRO  26  -0.496   2.034 -13.684
  142    HB3  PRO  26           HB1      PRO  26   0.197   1.747 -12.075
  143    HG2  PRO  26           HG2      PRO  26  -2.599   1.327 -13.032
  144    HG3  PRO  26           HG1      PRO  26  -1.618   0.328 -11.943
  145    HD2  PRO  26           HD2      PRO  26  -3.555   2.148 -11.097
  146    HD3  PRO  26           HD1      PRO  26  -2.221   1.558 -10.080
  147    H    TYR  27           HN       TYR  27  -2.458   5.611 -12.041
  148    HA   TYR  27           HA       TYR  27  -2.533   6.179 -14.905
  149    HB2  TYR  27           HB2      TYR  27  -5.063   5.634 -13.335
  150    HB3  TYR  27           HB1      TYR  27  -4.981   6.211 -14.998
  151    HD1  TYR  27           HD2      TYR  27  -3.346   4.738 -16.560
  152    HD2  TYR  27           HD1      TYR  27  -5.358   3.330 -13.034
  153    HE1  TYR  27           HE2      TYR  27  -3.142   2.406 -17.374
  154    HE2  TYR  27           HE1      TYR  27  -5.152   0.998 -13.851
  155    HH   TYR  27           HH       TYR  27  -3.288  -0.160 -15.652
  156    H    LYS  28           HN       LYS  28  -1.765   7.366 -12.171
  157    HA   LYS  28           HA       LYS  28  -3.467   9.621 -11.787
  158    HB2  LYS  28           HB2      LYS  28  -1.329  10.510 -10.556
  159    HB3  LYS  28           HB1      LYS  28  -2.201   9.133  -9.888
  160    HG2  LYS  28           HG2      LYS  28   0.295   8.819  -9.976
  161    HG3  LYS  28           HG1      LYS  28  -0.612   7.577 -10.831
  162    HD2  LYS  28           HD2      LYS  28  -0.100   8.531 -12.962
  163    HD3  LYS  28           HD1      LYS  28   0.500  10.020 -12.225
  164    HE2  LYS  28           HE2      LYS  28   2.396   8.859 -11.275
  165    HE3  LYS  28           HE1      LYS  28   1.760   7.299 -11.795
  166    HZ1  LYS  28           HZ1      LYS  28   3.091   7.671 -13.549
  167    HZ2  LYS  28           HZ2      LYS  28   3.113   9.356 -13.330
  168    HZ3  LYS  28           HZ3      LYS  28   1.795   8.614 -14.103
  169    H    ASP  29           HN       ASP  29  -2.014   8.972 -14.484
  170    HA   ASP  29           HA       ASP  29  -0.328  11.090 -15.113
  171    HB2  ASP  29           HB2      ASP  29  -0.509  10.314 -17.302
  172    HB3  ASP  29           HB1      ASP  29  -0.872   8.889 -16.356
  173    H    THR  30           HN       THR  30  -3.436  11.244 -14.172
  174    HA   THR  30           HA       THR  30  -4.226  13.502 -15.887
  175    HB   THR  30           HB       THR  30  -5.897  11.750 -15.436
  176    HG1  THR  30           HG1      THR  30  -6.363  14.116 -15.535
  177   HG21  THR  30          HG21      THR  30  -6.678  11.267 -13.241
  178   HG22  THR  30          HG22      THR  30  -5.826  12.650 -12.553
  179   HG23  THR  30          HG23      THR  30  -4.918  11.250 -13.124
  180    H    LEU  31           HN       LEU  31  -3.400  12.728 -12.546
  181    HA   LEU  31           HA       LEU  31  -4.102  15.176 -11.358
  182    HB2  LEU  31           HB2      LEU  31  -3.358  12.963 -10.244
  183    HB3  LEU  31           HB1      LEU  31  -1.715  13.539 -10.512
  184    HG   LEU  31           HG       LEU  31  -2.653  15.766  -9.376
  185   HD11  LEU  31          HD11      LEU  31  -4.351  13.674  -7.997
  186   HD12  LEU  31          HD12      LEU  31  -4.992  14.703  -9.276
  187   HD13  LEU  31          HD13      LEU  31  -4.393  15.424  -7.784
  188   HD21  LEU  31          HD21      LEU  31  -1.971  13.236  -7.838
  189   HD22  LEU  31          HD22      LEU  31  -1.932  14.868  -7.167
  190   HD23  LEU  31          HD23      LEU  31  -0.820  14.419  -8.461
  191    H    GLY  32           HN       GLY  32  -3.466  17.081 -12.168
  192    HA2  GLY  32           HA2      GLY  32  -0.891  18.079 -11.896
  193    HA3  GLY  32           HA1      GLY  32  -1.016  17.506 -13.557