*HEADER    TRANSCRIPTION                           28-APR-11   2LCC              
*TITLE     SOLUTION STRUCTURE OF RBBP1 CHROMOBARREL DOMAIN                       
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: AT-RICH INTERACTIVE DOMAIN-CONTAINING PROTEIN 4A;          
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: UNP RESIDUES 568-635;                                      
*COMPND   5 SYNONYM: ARID DOMAIN-CONTAINING PROTEIN 4A, RETINOBLASTOMA-BINDING   
*COMPND   6 PROTEIN 1, RBBP-1;                                                   
*COMPND   7 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: ARID4A, RBBP1, RBP1;                                           
*SOURCE   6 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   7 EXPRESSION_SYSTEM_TAXID: 562;                                        
*SOURCE   8 EXPRESSION_SYSTEM_STRAIN: ROSETTA (DE3);                             
*SOURCE   9 EXPRESSION_SYSTEM_VECTOR_TYPE: VECTOR;                               
*SOURCE  10 EXPRESSION_SYSTEM_VECTOR: PET30A                                     
*KEYWDS    CHROMOBARREL DOMAIN, RBBP1, TRANSCRIPTION                             
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    20                                                                    
*AUTHOR    W.GONG, Y.FENG                                                        
*REVDAT   1   08-FEB-12 2LCC    0                                                


assign (resid  32 and name   HB) ((resid  33 and name   HA) or (resid  31 and name   HA)) 7.0 5.2 0.0 !      8:20  Single
assign (resid  32 and name   HB) ((resid  33 and name  HB#) or (resid   7 and name   HG) or (resid  40 and name  HB#) or (resid   7 and name  HB#)) 7.0 5.2 0.0 !      9:20  Single
assign (resid  32 and name   HB) ((resid  39 and name HG##) or (resid   7 and name HD##)) 5.0 3.2 0.0 !     10:20  Single
assign (resid  28 and name  HB#) ((resid  11 and name  HG#) or (resid  11 and name  HD#)) 7.0 5.2 0.0 !     36:20  Single
assign (resid  28 and name  HB#) ((resid  11 and name  HG#) or (resid  30 and name  HD#)) 7.0 5.2 0.0 !     39:20  Single
assign (resid  28 and name  HB#) ((resid  11 and name  HE#) or (resid  46 and name  HB#)) 7.0 5.2 0.0 !     42:20  Single
assign (resid  31 and name  HB#) ((resid  30 and name  HB#) or (resid  33 and name  HB#)) 7.0 5.2 0.0 !     58:20  Single
assign (resid  31 and name  HB#) ((resid  30 and name  HB#) or (resid  30 and name  HG#)) 7.0 5.2 0.0 !     60:20  Single
assign (resid   8 and name   HA) ((resid  29 and name HG2#) or (resid   7 and name HD##)) 3.5 1.7 0.0 !     71:20  Single
assign (resid  10 and name   HA) ((resid  11 and name  HB#) or (resid  29 and name   HB)) 5.0 3.2 0.0 !     76:20  Single
assign (resid  10 and name   HA) ((resid  11 and name  HG#) or (resid  11 and name  HD#)) 5.0 3.2 0.0 !     77:20  Single
assign (resid  64 and name   HA) ((resid  67 and name  HD#) or (resid  65 and name  HB#) or (resid  65 and name   HG)) 5.0 3.2 0.0 !     91:20  Single
assign (resid  64 and name   HA) ((resid  65 and name   HA) or (resid  67 and name   HA)) 5.0 3.2 0.0 !     97:20  Single
assign (resid  39 and name   HA) ((resid  40 and name   HG) or (resid  40 and name  HB#) or (resid  34 and name   HB)) 5.0 3.2 0.0 !    105:20  Single
assign (resid  39 and name   HA) ((resid  40 and name   HN) or (resid  35 and name   HN)) 3.0 1.2 0.0 !    110:20  Single
assign (resid  29 and name   HA) ((resid  43 and name HG##) or (resid  29 and name HD1#)) 3.5 1.7 0.0 !    112:20  Single
assign (resid  29 and name   HA) ((resid  43 and name   HB) or (resid  30 and name  HB#) or (resid  30 and name  HG#)) 3.5 1.7 0.0 !    113:20  Single
assign (resid  29 and name   HA) ((resid  29 and name HG1#) or (resid  30 and name  HD#)) 7.0 5.2 0.0 !    116:20  Single
assign (resid  21 and name   HA) ((resid  20 and name  HB#) or (resid  22 and name  HB#)) 5.0 3.2 2.0 !    125:20  Single  10-8-13, T21
!10-8-13 T21  assign (resid  21 and name   HA) ((resid  23 and name  HD#) or (resid  20 and name  HD#)) 7.0 5.2 0.0 !    126:20  Single
assign (resid  21 and name   HA) ((resid  20 and name   HA) or (resid  17 and name  HA#)) 5.0 3.2 2.0 !    127:20  Single  10-8-13, T21
assign (resid  62 and name   HB) ((resid  62 and name   HA) or (resid  61 and name   HA)) 3.5 1.7 0.0 !    130:20  Single
assign (resid  62 and name   HA) ((resid  63 and name   HA) or (resid  59 and name   HA) or (resid  64 and name   HA)) 5.0 3.2 0.0 !    132:20  Single
assign (resid  62 and name   HA) ((resid  63 and name  HB#) or (resid  67 and name  HE#)) 7.0 5.2 0.0 !    133:20  Single
assign (resid  12 and name   HA) ((resid  12 and name   HN) or (resid  62 and name   HN)) 5.0 3.2 0.0 !    145:20  Single
assign (resid   6 and name   HA) ((resid   7 and name   HG) or (resid   7 and name  HB#)) 5.0 3.2 0.0 !    147:20  Single
assign (resid  20 and name   HA) ((resid  20 and name  HD#) or (resid  22 and name  HB#)) 3.5 1.7 1.0 !    153:20  Single 10-8-17
assign (resid  34 and name   HA) ((resid  34 and name   HN) or (resid  39 and name   HN)) 3.5 1.7 0.0 !    174:20  Single
assign (resid  34 and name   HA) ((resid  35 and name   HN) or (resid  40 and name   HN)) 3.0 1.2 0.0 !    175:20  Single
assign (resid  67 and name   HA) ((resid  67 and name  HD#) or (resid  65 and name  HB#)) 3.5 1.7 0.0 !    192:20  Single
assign (resid   7 and name   HA) ((resid   7 and name HD##) or (resid  29 and name HG1#)) 3.0 1.2 0.5 !    203:20  Single 10-8-20
assign (resid  69 and name   HA) ((resid  69 and name   HG) or (resid  69 and name  HB#)) 3.0 1.2 0.0 !    205:20  Single
assign (resid  58 and name   HA) ((resid  40 and name   HA) or (resid  41 and name   HA)) 7.0 5.2 0.0 !    217:20  Single
assign (resid   7 and name   HA) ((resid   7 and name  HB#) or (resid   7 and name   HG)) 3.0 1.2 0.0 !    223:20  Single
assign (resid  65 and name   HA) ((resid  65 and name  HB#) or (resid  65 and name   HG)) 3.0 1.2 0.0 !    232:20  Single
assign (resid  30 and name   HA) ((resid   8 and name HG2#) or (resid  30 and name  HG#) or (resid  30 and name  HB#)) 3.0 1.2 0.0 !    243:20  Single
assign (resid  22 and name   HA) ((resid  22 and name  HB#) or (resid  22 and name  HG#)) 3.0 1.2 0.0 !    244:20  Single
assign (resid  22 and name   HA) ((resid  22 and name HE2#) or (resid  22 and name   HN)) 3.5 1.7 0.0 !    252:20  Single
assign (resid  26 and name   HA) ((resid  13 and name  HB#) or (resid  13 and name  HD#)) 5.0 3.2 0.0 !    269:20  Single
assign (resid  26 and name   HA) ((resid  27 and name  HB#) or (resid  24 and name HG2#) or (resid  62 and name HD1#)) 5.0 3.2 0.0 !    270:20  Single
assign (resid  59 and name   HA) ((resid  58 and name  HB#) or (resid  60 and name  HB#)) 5.0 3.2 0.0 !    272:20  Single
assign (resid  38 and name   HA) ((resid  38 and name  HG#) or (resid  35 and name  HB#)) 3.5 1.7 0.0 !    278:20  Single
assign (resid  23 and name   HA) ((resid  23 and name  HB#) or (resid  24 and name HG1#) or (resid  23 and name  HG#)) 3.0 1.2 0.0 !    296:20  Single
assign (resid  18 and name   HA) ((resid  22 and name HE2#) or (resid  22 and name   HN)) 7.0 5.2 0.0 !    316:20  Single
assign (resid  35 and name   HA) ((resid  34 and name HG2#) or (resid  40 and name HD##)) 5.0 3.2 0.0 !    320:20  Single
assign (resid  35 and name   HA) ((resid  36 and name   HA) or (resid  39 and name   HA)) 5.0 3.2 0.0 !    323:20  Single
assign (resid  17 and name  HA#) ((resid  18 and name   HA) or (resid  16 and name   HA)) 5.0 3.2 0.0 !    411:20  Single
assign (resid  35 and name  HB#) ((resid  40 and name   HG) or (resid  40 and name  HB#) or (resid  33 and name  HB#)) 7.0 5.2 0.0 !    423:20  Single
assign (resid  35 and name  HB#) ((resid  35 and name   HA) or (resid  34 and name   HA)) 3.0 1.2 0.0 !    428:20  Single
assign (resid  35 and name  HB#) ((resid  35 and name   HN) or (resid  40 and name   HN)) 3.0 1.2 0.0 !    430:20  Single
assign (resid  51 and name  HD#) ((resid  51 and name  HG#) or (resid  50 and name HG##)) 5.0 3.2 0.0 !    433:20  Single
assign (resid  16 and name  HB#) ((resid  16 and name  HE#) or (resid  25 and name  HD#)) 5.0 3.2 0.0 !    437:20  Single
assign (resid  25 and name  HB#) ((resid  26 and name   HN) or (resid  25 and name   HN)) 3.5 1.7 0.0 !    450:20  Single
assign (resid  41 and name  HB#) ((resid  29 and name HG2#) or (resid  56 and name HG##)) 3.5 1.7 0.0 !    481:20  Single
assign (resid  46 and name  HB#) ((resid  45 and name  HB#) or (resid  26 and name  HB#)) 5.0 3.2 0.0 !    519:20  Single
assign (resid  34 and name   HB) ((resid  34 and name HG2#) or (resid  34 and name HD1#)) 3.0 1.2 0.0 !    530:20  Single
assign (resid  24 and name   HB) ((resid  24 and name HD1#) or (resid  24 and name HG2#)) 3.0 1.2 0.0 !    531:20  Single
assign (resid  24 and name   HB) ((resid  15 and name   HA) or (resid  23 and name   HA)) 5.0 3.2 0.0 !    538:20  Single
assign (resid  34 and name   HB) ((resid  35 and name   HN) or (resid  40 and name   HN)) 3.5 1.7 0.5 !    543:20  Single 10-8-12
assign (resid  62 and name   HB) ((resid  62 and name   HA) or (resid  61 and name   HA)) 5.0 3.2 0.0 !    546:20  Single
assign (resid  34 and name   HB) ((resid  39 and name   HA) or (resid  37 and name  HA#)) 5.0 3.2 2.0 !    547:20  Single 10-8-12
assign (resid  61 and name   HB) ((resid  61 and name HG1#) or (resid  14 and name HG##)) 3.5 1.7 0.0 !    551:20  Single
assign (resid  61 and name   HB) ((resid  58 and name   HA) or (resid  61 and name   HA)) 5.0 3.2 0.0 !    553:20  Single
assign (resid  29 and name   HB) ((resid  29 and name HD1#) or (resid  43 and name HG##)) 3.5 1.7 0.0 !    556:20  Single
assign (resid  29 and name   HB) ((resid   7 and name HD##) or (resid  29 and name HG2#)) 3.0 1.2 0.0 !    557:20  Single
assign (resid  29 and name   HB) ((resid  10 and name HG2#) or (resid  30 and name  HB#) or (resid  43 and name   HB) or (resid  30 and name  HG#)) 5.0 3.2 0.0 !    558:20  Single
assign (resid  29 and name   HB) ((resid  29 and name   HA) or (resid  10 and name   HB) or (resid   8 and name   HB)) 3.5 1.7 0.0 !    561:20  Single
assign (resid  26 and name  HG#) ((resid  13 and name   HA) or (resid  25 and name   HA)) 5.0 3.2 0.0 !    571:20  Single
assign (resid  26 and name  HG#) ((resid  13 and name  HG#) or (resid  13 and name  HD#)) 5.0 3.2 0.0 !    582:20  Single
assign (resid  26 and name  HG#) ((resid  11 and name  HD#) or (resid  11 and name  HG#) or (resid  24 and name   HB)) 7.0 5.2 0.0 !    583:20  Single
assign (resid  26 and name  HG#) ((resid  62 and name HD1#) or (resid  27 and name  HB#)) 7.0 5.2 0.0 !    587:20  Single
assign (resid  12 and name   HB) ((resid  64 and name  HD#) or (resid  61 and name   HA)) 5.0 3.2 0.0 !    614:20  Single
assign (resid  12 and name   HB) ((resid  12 and name   HA) or (resid  63 and name   HA)) 3.5 1.7 0.0 !    615:20  Single
assign (resid  33 and name  HG#) ((resid  33 and name   HN) or (resid  40 and name   HN) or (resid  35 and name   HN)) 5.0 3.2 0.0 !    620:20  Single
assign (resid  33 and name  HG#) ((resid  33 and name  HB#) or (resid  40 and name  HB#)) 3.0 1.2 0.0 !    627:20  Single
assign (resid  54 and name  HG#) ((resid  14 and name HG##) or (resid  43 and name HG##)) 7.0 5.2 0.0 !    636:20  Single
assign (resid  22 and name  HG#) ((resid  23 and name   HA) or (resid  15 and name   HA)) 3.5 1.7 2.5 !    651:20  Single 10-8-17
assign (resid  29 and name   HA) ((resid  43 and name   HB) or (resid  30 and name  HB#)) 5.0 3.2 0.0 !    677:20  Single
assign (resid  43 and name   HA) ((resid  30 and name  HB#) or (resid  43 and name   HB)) 3.5 1.7 0.0 !    679:20  Single
assign (resid  44 and name   HN) ((resid  43 and name   HB) or (resid  30 and name  HB#)) 5.0 3.2 0.0 !    681:20  Single
assign (resid  39 and name   HB) ((resid  38 and name   HA) or (resid  33 and name   HA)) 5.0 3.2 0.0 !    691:20  Single
assign (resid  39 and name   HB) ((resid  40 and name   HN) or (resid  35 and name   HN) or (resid  33 and name   HN)) 5.0 3.2 0.0 !    728:20  Single
assign (resid  64 and name  HB#) ((resid  65 and name   HG) or (resid  65 and name  HB#)) 5.0 3.2 0.0 !    748:20  Single
assign (resid  11 and name  HB#) ((resid  11 and name   HN) or (resid  28 and name   HN)) 3.5 1.7 0.0 !    752:20  Single
assign (resid  38 and name  HB#) ((resid  35 and name   HN) or (resid  40 and name   HN)) 7.0 5.2 0.0 !    753:20  Single
assign (resid  13 and name  HD#) ((resid  24 and name HG2#) or (resid  62 and name HD1#)) 3.0 1.2 0.0 !    768:20  Single
assign (resid  29 and name HG1#) ((resid  12 and name HG##) or (resid  43 and name HG##)) 5.0 3.2 0.0 !    801:20  Single
assign (resid  24 and name HG1#) ((resid  15 and name   HA) or (resid  23 and name   HA)) 3.5 1.7 0.0 !    817:20  Single
assign (resid  29 and name HG1#) ((resid  10 and name   HB) or (resid  29 and name   HA)) 3.5 1.7 0.0 !    820:20  Single
assign (resid  61 and name HG1#) ((resid  60 and name  HB#) or (resid  14 and name   HB)) 7.0 5.2 0.0 !    837:20  Single
assign (resid  61 and name HG1#) ((resid  12 and name HG##) or (resid  43 and name HG##)) 7.0 5.2 0.0 !    838:20  Single
assign (resid  61 and name HG1#) ((resid  14 and name HG##) or (resid  43 and name HG##)) 5.0 3.2 0.0 !    839:20  Single
assign (resid  64 and name  HG#) ((resid  64 and name   HA) or (resid  63 and name   HA) or (resid  12 and name   HA)) 3.0 1.2 0.0 !    848:20  Single
assign (resid  42 and name   HG) ((resid  30 and name  HB#) or (resid  30 and name  HG#)) 5.0 3.2 0.0 !    897:20  Single
assign (resid  27 and name  HB#) ((resid  27 and name   HA) or (resid  43 and name   HA)) 3.0 1.2 0.0 !    917:20  Single
assign (resid  27 and name  HB#) ((resid  26 and name   HA) or (resid  12 and name   HA)) 5.0 3.2 0.0 !    918:20  Single
assign (resid  40 and name HD##) ((resid  38 and name  HG#) or (resid  35 and name  HB#) or (resid  57 and name  HB#)) 3.5 1.7 0.0 !    919:20  Single
assign (resid  27 and name  HB#) ((resid  14 and name   HB) or (resid  11 and name  HB#)) 5.0 3.2 0.0 !    922:20  Single
assign (resid  65 and name HD##) ((resid  65 and name  HB#) or (resid  65 and name   HG)) 3.0 1.5 0.0 !    927:20  Single
assign (resid  69 and name HD##) ((resid  69 and name   HG) or (resid  69 and name  HB#)) 3.0 1.5 0.0 !    929:20  Single
assign (resid  42 and name HD##) ((resid  30 and name  HB#) or (resid  30 and name  HG#)) 3.0 1.2 0.0 !    938:20  Single
assign (resid  42 and name HD##) ((resid  44 and name   HN) or (resid  42 and name   HN)) 5.0 3.2 0.0 !    944:20  Single
assign (resid  40 and name HD##) ((resid  40 and name   HN) or (resid  35 and name   HN)) 3.5 1.7 0.0 !    951:20  Single
assign (resid  40 and name HD##) ((resid  38 and name  HG#) or (resid  35 and name  HB#) or (resid  57 and name  HB#)) 3.5 1.7 0.0 !    959:20  Single
assign (resid  12 and name HG##) ((resid  29 and name HD1#) or (resid  43 and name HG##) or (resid  14 and name HG##)) 3.0 1.2 0.0 !    966:20  Single
assign (resid  14 and name HG##) ((resid  61 and name HG1#) or (resid  27 and name  HB#)) 3.0 1.2 0.0 !    967:20  Single
assign (resid  14 and name HG##) ((resid  61 and name   HB) or (resid  15 and name  HG#)) 5.0 3.2 0.0 !    969:20  Single
assign (resid  14 and name HG##) ((resid  14 and name   HB) or (resid  60 and name  HB#)) 3.0 1.2 0.0 !    971:20  Single
assign (resid  12 and name HG##) ((resid  10 and name HG2#) or (resid  43 and name   HB)) 3.0 1.2 0.0 !    974:20  Single
assign (resid  12 and name HG##) ((resid  64 and name  HD#) or (resid  61 and name   HA)) 3.0 1.2 0.0 !    979:20  Single
assign (resid  12 and name HG##) ((resid  63 and name   HA) or (resid  12 and name   HA)) 3.0 1.2 0.0 !    980:20  Single
assign (resid  14 and name HG##) ((resid  26 and name   HA) or (resid  16 and name   HA)) 5.0 3.2 0.0 !    981:20  Single
assign (resid  12 and name HG##) ((resid  11 and name   HN) or (resid  63 and name   HN) or (resid  28 and name   HN)) 5.0 3.2 0.0 !    989:20  Single
assign (resid  14 and name HG##) ((resid  27 and name   HN) or (resid  43 and name   HN)) 3.5 1.7 0.0 !    990:20  Single
assign (resid  10 and name HG2#) ((resid  11 and name  HG#) or (resid  11 and name  HD#)) 7.0 5.2 0.0 !    999:20  Single
assign (resid  10 and name HG2#) ((resid  11 and name  HB#) or (resid  12 and name   HB) or (resid   7 and name  HB#)) 7.0 5.2 0.0 !   1000:20  Single
assign (resid  10 and name HG2#) ((resid  10 and name   HB) or (resid  10 and name   HA)) 3.0 1.2 0.0 !   1003:20  Single
assign (resid  10 and name HG2#) ((resid  12 and name   HA) or (resid  63 and name   HA)) 5.0 3.2 0.0 !   1004:20  Single
assign (resid  32 and name HG2#) ((resid   7 and name HD##) or (resid  29 and name HG2#)) 3.0 1.2 0.0 !   1012:20  Single
assign (resid  32 and name HG2#) ((resid   7 and name   HG) or (resid  33 and name  HB#) or (resid  40 and name  HB#) or (resid   7 and name  HB#)) 5.0 3.2 0.0 !   1013:20  Single
assign (resid  32 and name HG2#) ((resid  58 and name   HA) or (resid  29 and name   HA)) 7.0 5.2 0.0 !   1017:20  Single
assign (resid  32 and name HG2#) ((resid  34 and name   HN) or (resid  39 and name   HN)) 7.0 5.2 0.0 !   1024:20  Single
assign (resid  14 and name HG##) ((resid  61 and name HG1#) or (resid  27 and name  HB#)) 3.5 1.7 0.0 !   1027:20  Single
assign (resid  14 and name HG##) ((resid  14 and name   HB) or (resid  60 and name  HB#)) 3.0 1.2 0.0 !   1029:20  Single
assign (resid  14 and name HG##) ((resid  60 and name  HB#) or (resid  54 and name  HG#)) 5.0 3.2 0.0 !   1030:20  Single
assign (resid  14 and name HG##) ((resid  26 and name   HA) or (resid  16 and name   HA)) 5.0 3.2 0.0 !   1032:20  Single
assign (resid  56 and name HG##) ((resid  60 and name  HB#) or (resid  54 and name  HG#)) 3.5 1.7 0.0 !   1041:20  Single
assign (resid  39 and name HG##) ((resid  57 and name  HG#) or (resid  34 and name   HB) or (resid  40 and name  HB#) or (resid  33 and name  HB#)) 3.5 1.7 0.0 !   1045:20  Single
assign (resid  39 and name HG##) ((resid  40 and name   HN) or (resid  33 and name   HN)) 3.0 1.2 0.0 !   1051:20  Single
assign (resid  21 and name HG2#) ((resid  21 and name   HA) or (resid  22 and name   HA)) 3.0 1.2 0.5 !   1053:20  Single
assign (resid  21 and name HG2#) ((resid  17 and name  HA#) or (resid  20 and name   HA)) 5.0 3.2 0.0 !   1057:20  Single
assign (resid  21 and name HG2#) ((resid  20 and name  HB#) or (resid  22 and name  HB#)) 5.0 3.2 2.0 !   1068:20  Single  10-8-13 T21
assign (resid   8 and name HG2#) ((resid   7 and name HD##) or (resid  29 and name HG2#)) 3.5 1.7 0.0 !   1070:20  Single
assign (resid  43 and name HG##) ((resid  27 and name  HB#) or (resid  61 and name HG1#)) 3.0 1.2 0.0 !   1074:20  Single
assign (resid  43 and name HG##) ((resid  56 and name HG##) or (resid  29 and name HG2#)) 3.0 1.2 0.0 !   1075:20  Single
assign (resid  39 and name HG##) ((resid  34 and name   HB) or (resid  40 and name  HB#) or (resid  40 and name   HG) or (resid  33 and name  HB#)) 3.5 1.7 0.0 !   1078:20  Single
assign (resid  39 and name HG##) ((resid  34 and name HD1#) or (resid  34 and name HG2#)) 3.0 1.2 0.0 !   1081:20  Single
assign (resid  39 and name HG##) ((resid  40 and name   HA) or (resid  41 and name   HA)) 5.0 3.2 0.0 !   1087:20  Single
assign (resid  43 and name HG##) ((resid  44 and name   HN) or (resid  42 and name   HN)) 3.5 1.7 0.0 !   1094:20  Single
assign (resid  39 and name HG##) ((resid  40 and name   HN) or (resid  33 and name   HN)) 3.0 1.2 0.0 !   1096:20  Single
assign (resid  50 and name HG##) ((resid  46 and name   HA) or (resid  50 and name   HA)) 3.0 1.2 0.0 !   1100:20  Single
assign (resid  42 and name HD##) ((resid  30 and name  HB#) or (resid  30 and name  HG#)) 7.0 5.2 0.0 !   1104:20  Single
assign (resid  42 and name HD##) ((resid  53 and name   HA) or (resid  43 and name   HA)) 5.0 3.2 0.0 !   1109:20  Single
assign (resid  42 and name HD##) ((resid  44 and name   HN) or (resid  42 and name   HN)) 7.0 5.2 0.0 !   1114:20  Single
assign (resid  56 and name HG##) ((resid  41 and name   HA) or (resid  40 and name   HA)) 5.0 3.2 0.0 !   1126:20  Single
assign (resid  56 and name HG##) ((resid  41 and name  HB#) or (resid  16 and name  HB#)) 7.0 5.2 0.0 !   1127:20  Single
assign (resid  56 and name HG##) ((resid  60 and name  HB#) or (resid  54 and name  HG#)) 5.0 3.2 0.0 !   1129:20  Single
assign (resid  50 and name HG##) ((resid  46 and name   HA) or (resid  50 and name   HA)) 5.0 3.2 0.0 !   1146:20  Single
assign (resid  56 and name HG##) ((resid  61 and name   HA) or (resid  58 and name   HA)) 5.0 3.2 0.0 !   1149:20  Single
assign (resid  58 and name  HB#) ((resid  40 and name   HA) or (resid  41 and name   HA)) 7.0 5.2 0.0 !   1156:20  Single
assign (resid  43 and name HG##) ((resid  44 and name   HN) or (resid  42 and name   HN)) 7.0 5.2 0.0 !   1167:20  Single
assign (resid  43 and name HG##) ((resid  54 and name   HN) or (resid  45 and name   HN)) 3.5 1.7 0.0 !   1168:20  Single
assign (resid  29 and name HG2#) ((resid   7 and name   HA) or (resid  30 and name   HA)) 5.0 3.2 0.0 !   1178:20  Single
assign (resid  29 and name HG2#) ((resid   8 and name   HA) or (resid  32 and name   HB)) 5.0 3.2 0.0 !   1180:20  Single
assign (resid  29 and name HG2#) ((resid   7 and name   HG) or (resid   7 and name  HB#)) 5.0 3.2 0.0 !   1186:20  Single
assign (resid  29 and name HG2#) ((resid  30 and name  HB#) or (resid  43 and name   HB) or (resid  30 and name  HG#)) 5.0 3.2 0.0 !   1188:20  Single
assign (resid  43 and name HG##) ((resid  27 and name  HB#) or (resid  61 and name HG1#)) 3.0 1.2 0.0 !   1190:20  Single
assign (resid  12 and name HG##) ((resid  11 and name   HN) or (resid  63 and name   HN) or (resid  28 and name   HN)) 5.0 3.2 0.0 !   1204:20  Single
assign (resid  12 and name HG##) ((resid  63 and name   HA) or (resid  12 and name   HA)) 3.5 1.7 0.0 !   1209:20  Single
assign (resid  12 and name HG##) ((resid  10 and name   HB) or (resid  61 and name   HA) or (resid  29 and name   HA) or (resid  62 and name   HA)) 3.5 1.7 0.0 !   1210:20  Single
assign (resid  12 and name HG##) ((resid  11 and name  HB#) or (resid  29 and name   HB)) 5.0 3.2 0.0 !   1213:20  Single
assign (resid  12 and name HG##) ((resid  10 and name HG2#) or (resid  43 and name   HB)) 3.5 1.7 0.0 !   1216:20  Single
assign (resid  12 and name HG##) ((resid  61 and name HG1#) or (resid  27 and name  HB#)) 3.0 1.2 0.0 !   1218:20  Single
assign (resid  12 and name HG##) ((resid  29 and name HD1#) or (resid  43 and name HG##) or (resid  14 and name HG##)) 3.0 1.2 0.0 !   1219:20  Single
assign (resid  62 and name HG2#) ((resid  62 and name   HB) or (resid  13 and name  HD#)) 3.0 1.2 0.0 !   1223:20  Single
assign (resid  62 and name HG2#) ((resid  13 and name  HE#) or (resid  67 and name  HE#)) 3.0 1.2 0.0 !   1227:20  Single
assign (resid  34 and name HG2#) ((resid  37 and name  HA#) or (resid  39 and name   HA)) 3.0 1.2 0.0 !   1231:20  Single
assign (resid  34 and name HG2#) ((resid  34 and name   HA) or (resid  35 and name   HA)) 3.0 1.2 0.0 !   1232:20  Single
assign (resid  62 and name HG2#) ((resid  63 and name   HA) or (resid  12 and name   HA) or (resid  64 and name   HA)) 3.5 1.7 0.0 !   1233:20  Single
assign (resid  34 and name HG2#) ((resid  39 and name   HN) or (resid  34 and name   HN)) 5.0 3.2 0.0 !   1239:20  Single
assign (resid  61 and name HG2#) ((resid  29 and name HD1#) or (resid  14 and name HG##) or (resid  43 and name HG##)) 3.0 1.2 0.0 !   1247:20  Single
assign (resid  61 and name HG2#) ((resid  61 and name HG1#) or (resid  14 and name HG##)) 3.0 1.2 0.0 !   1248:20  Single
assign (resid  61 and name HG2#) ((resid  56 and name HG##) or (resid  62 and name HG1#) or (resid  29 and name HG2#)) 3.5 1.7 0.0 !   1253:20  Single
assign (resid  61 and name HG2#) ((resid  61 and name   HA) or (resid  62 and name   HA) or (resid  58 and name   HA)) 3.0 1.2 0.0 !   1255:20  Single
assign (resid  61 and name HG2#) ((resid  63 and name   HA) or (resid  12 and name   HA)) 3.5 1.7 0.0 !   1256:20  Single
assign (resid  61 and name HG2#) ((resid  61 and name   HN) or (resid  63 and name  HE3)) 3.5 1.7 0.0 !   1260:20  Single
assign (resid  29 and name HD1#) ((resid  43 and name   HB) or (resid  10 and name HG2#)) 3.0 1.2 0.0 !   1270:20  Single
assign (resid  29 and name HD1#) ((resid   7 and name  HB#) or (resid   7 and name   HG) or (resid  30 and name  HB#)) 5.0 3.2 0.0 !   1272:20  Single
assign (resid  29 and name HD1#) ((resid  29 and name   HB) or (resid  11 and name  HB#)) 3.5 1.7 0.0 !   1273:20  Single
assign (resid  29 and name HD1#) ((resid  29 and name   HA) or (resid  10 and name   HB)) 3.0 1.2 0.0 !   1276:20  Single
assign (resid  61 and name HD1#) ((resid  43 and name HG##) or (resid  12 and name HG##)) 3.0 1.2 0.0 !   1287:20  Single
assign (resid  61 and name HD1#) ((resid  14 and name HG##) or (resid  32 and name HG2#)) 3.0 1.2 0.0 !   1288:20  Single
assign (resid  61 and name HD1#) ((resid  43 and name HG##) or (resid  14 and name HG##) or (resid  29 and name HD1#)) 3.0 1.2 0.0 !   1290:20  Single
assign (resid  61 and name HD1#) ((resid  60 and name  HB#) or (resid  58 and name  HB#)) 3.5 1.7 0.0 !   1293:20  Single
assign (resid  61 and name HD1#) ((resid  57 and name   HA) or (resid  14 and name   HA)) 3.5 1.7 1.0 !   1297:20  Single 10-8-16
assign (resid  61 and name HD1#) ((resid  40 and name   HA) or (resid  41 and name   HA)) 5.0 3.2 0.0 !   1298:20  Single
assign (resid  61 and name HD1#) ((resid  63 and name  HZ2) or (resid  41 and name  HE#)) 3.5 1.7 0.0 !   1300:20  Single
assign (resid  61 and name HD1#) ((resid  63 and name  HE1) or (resid  56 and name   HN)) 3.5 1.7 0.0 !   1304:20  Single
assign (resid  32 and name   HA) ((resid  39 and name HG##) or (resid   7 and name HD##) or (resid  29 and name HG2#)) 5.0 3.2 0.0 !   1322:20  Single
assign (resid  32 and name   HA) ((resid  33 and name  HB#) or (resid  40 and name  HB#) or (resid   7 and name   HG)) 5.0 3.2 0.0 !   1323:20  Single
assign (resid  40 and name HD##) ((resid  40 and name   HN) or (resid  35 and name   HN)) 3.5 1.7 0.0 !   1347:20  Single
assign (resid  34 and name HD1#) ((resid  39 and name   HB) or (resid  33 and name  HG#)) 3.5 1.7 0.5 !   1363:20  Single 10-8-19
assign (resid  39 and name   HA) ((resid  34 and name HD1#) or (resid  40 and name HD##)) 3.0 1.2 0.2 !   1370:20  Single 10-8-20
assign (resid  50 and name   HB) ((resid  50 and name   HA) or (resid  46 and name   HA)) 5.0 3.2 0.0 !   1388:20  Single
assign (resid  38 and name  HB#) ((resid  35 and name   HN) or (resid  40 and name   HN)) 7.0 5.2 0.0 !   1389:20  Single
assign (resid  26 and name   HA) ((resid  27 and name  HB#) or (resid  24 and name HG2#) or (resid  62 and name HD1#)) 5.0 3.2 0.0 !   1396:20  Single
assign (resid  56 and name HG##) ((resid  60 and name  HB#) or (resid  14 and name   HB)) 5.0 3.2 0.0 !   1407:20  Single
assign (resid  57 and name  HG#) ((resid  57 and name  HB#) or (resid  38 and name  HG#)) 3.5 1.7 0.0 !   1409:20  Single
assign (resid  60 and name   HA) ((resid  61 and name HG1#) or (resid  62 and name HD1#)) 7.0 5.2 0.0 !   1414:20  Single
assign (resid  62 and name HD1#) ((resid  62 and name HG1#) or (resid  15 and name  HG#)) 3.0 1.2 0.0 !   1433:20  Single
assign (resid  62 and name HD1#) ((resid  62 and name   HB) or (resid  13 and name  HD#)) 3.0 1.2 0.0 !   1434:20  Single
assign (resid  62 and name HD1#) ((resid  15 and name   HA) or (resid  12 and name   HA)) 5.0 3.2 0.0 !   1437:20  Single
assign (resid  62 and name HG2#) ((resid  64 and name  HB#) or (resid  26 and name  HG#)) 7.0 5.2 0.0 !   1442:20  Single
assign (resid  69 and name HD##) ((resid  69 and name   HG) or (resid  69 and name  HB#)) 3.0 1.5 0.0 !   1462:20  Single
assign (resid  72 and name   HN) ((resid  72 and name  HB#) or (resid  71 and name  HB#)) 5.0 3.2 0.0 !   1506:20  Single
assign (resid  27 and name  HB#) ((resid  43 and name HG##) or (resid  14 and name HG##)) 3.0 1.2 0.0 !   1510:20  Single
assign (resid  53 and name  HB#) ((resid  54 and name   HN) or (resid  53 and name   HN)) 3.5 1.7 0.0 !   1512:20  Single
assign (resid  43 and name HG##) ((resid  14 and name HG##) or (resid  61 and name HG1#)) 3.5 1.7 0.0 !   1513:20  Single
assign (resid  12 and name HG##) ((resid  61 and name HG1#) or (resid  14 and name HG##)) 3.5 1.7 0.0 !   1525:20  Single
assign ((resid  11 and name  HG#) or (resid  11 and name  HD#))    (resid  28 and name  HB#) 5.0 3.2 0.0 !     37:20  Double
assign ((resid  11 and name  HG#) or (resid  29 and name HG1#) or (resid  30 and name  HD#))    (resid  28 and name  HB#) 5.0 3.2 0.0 !     38:20  Double
assign ((resid  45 and name   HA) or (resid  10 and name   HA) or (resid  29 and name   HA) or (resid   8 and name   HB) or (resid  10 and name   HB))    (resid  28 and name HB#) 7.0 5.2 0.0 !     44:20  Double
assign ((resid  30 and name  HB#) or (resid  33 and name  HB#))    (resid  31 and name  HB#) 7.0 5.2 0.0 !     59:20  Double
assign ((resid  30 and name  HB#) or (resid  30 and name  HG#))    (resid  31 and name  HB#) 5.0 3.2 0.0 !     61:20  Double
assign ((resid  62 and name HG1#) or (resid  61 and name   HB))    ((resid  62 and name   HA) or (resid  61 and name   HA)) 3.0 1.2 0.0 !    114:20  Double
assign ((resid  62 and name HG1#) or (resid  56 and name HG##))    ((resid  62 and name   HA) or (resid  61 and name   HA)) 3.0 1.2 0.0 !    115:20  Double
assign ((resid  24 and name HG1#) or (resid  34 and name HG1#) or (resid  23 and name  HG#))    ((resid  24 and name   HA) or (resid  34 and name   HA)) 3.5 1.7 0.0 !    166:20  Double
assign ((resid  34 and name   HB) or (resid  23 and name  HD#) or (resid  40 and name   HG) or (resid  33 and name  HB#) or (resid  15 and name  HB#))    ((resid  34 and name   HA) or (resid  24 and name   HA)) 3.0 1.2 0.0 !    167:20  Double
assign ((resid  24 and name HG2#) or (resid  34 and name HG2#) or (resid  34 and name HD1#))    ((resid  24 and name   HA) or (resid  34 and name   HA)) 3.0 1.2 0.0 !    169:20  Double
assign ((resid  76 and name   HN) or (resid   8 and name   HN))    ((resid  75 and name   HA) or (resid   7 and name   HA)) 3.5 1.7 0.0 !    236:20  Double
assign ((resid  30 and name  HB#) or (resid  23 and name  HD#))    ((resid  30 and name   HA) or (resid  22 and name   HA)) 3.0 1.2 0.0 !    245:20  Double
assign ((resid  16 and name  HB#) or (resid  30 and name  HE#))    ((resid  22 and name   HA) or (resid  30 and name   HA)) 5.0 3.2 0.0 !    248:20  Double
assign ((resid   3 and name   HN) or (resid  67 and name   HN) or (resid  66 and name   HN))    ((resid   2 and name   HA) or (resid  66 and name   HA)) 3.0 1.2 0.0 !    290:20  Double
assign ((resid   2 and name  HB#) or (resid  66 and name  HB#))    ((resid   2 and name   HA) or (resid  66 and name   HA)) 3.0 1.2 0.0 !    300:20  Double
assign ((resid  33 and name  HB#) or (resid  18 and name  HB#))    ((resid  33 and name   HA) or (resid  18 and name   HA)) 3.0 1.2 0.0 !    307:20  Double
assign ((resid  64 and name  HG#) or (resid  57 and name  HB#))    ((resid  63 and name   HA) or (resid  59 and name   HA)) 5.0 3.2 0.0 !    308:20  Double
assign ((resid  63 and name  HE3) or (resid  61 and name   HN))    ((resid  63 and name   HA) or (resid  59 and name   HA)) 5.0 3.2 0.0 !    311:20  Double
assign ((resid  63 and name   HA) or (resid  12 and name   HA))    (resid  64 and name  HD#) 3.0 1.2 0.0 !    338:20  Double
assign ((resid  63 and name   HN) or (resid  65 and name   HN))    (resid  64 and name  HD#) 5.0 3.2 0.0 !    345:20  Double
assign ((resid  69 and name  HB#) or (resid  69 and name   HG))    (resid  68 and name  HA#) 5.0 3.2 0.0 !    373:20  Double
assign ((resid  18 and name   HA) or (resid  16 and name   HA) or (resid  15 and name   HA))    (resid  17 and name  HA#) 7.0 5.2 0.0 !    408:20  Double
assign ((resid  18 and name   HN) or (resid  17 and name   HN))    (resid  17 and name  HA#) 3.5 1.7 0.0 !    416:20  Double
assign ((resid  40 and name   HG) or (resid  40 and name  HB#))    (resid  35 and name  HB#) 5.0 3.2 0.0 !    424:20  Double
assign ((resid  35 and name   HA) or (resid  34 and name   HA))    (resid  35 and name  HB#) 3.0 1.2 0.0 !    427:20  Double
assign ((resid  35 and name   HN) or (resid  40 and name   HN))    (resid  35 and name  HB#) 3.5 1.7 0.0 !    429:20  Double
assign ((resid  51 and name  HG#) or (resid  50 and name HG##))    (resid  51 and name  HD#) 3.5 1.7 0.0 !    432:20  Double
assign ((resid  15 and name  HB#) or (resid  57 and name  HG#))    (resid  60 and name  HD#) 3.5 1.7 0.0 !    439:20  Double
assign ((resid  56 and name HG##) or (resid  56 and name HG##))    (resid  60 and name  HD#) 5.0 3.2 0.0 !    445:20  Double
assign ((resid  18 and name   HA) or (resid  16 and name   HA))    (resid  18 and name  HD#) 5.0 3.2 0.0 !    446:20  Double
assign ((resid  65 and name HD##) or (resid  69 and name HD##))    (resid  65 and name  HB#) 3.0 1.5 0.0 !    454:20  Double
assign ((resid   7 and name HD##) or (resid  29 and name HG2#))    ((resid   7 and name  HB#) or (resid   7 and name  HB#)) 3.0 1.2 0.0 !    456:20  Double
assign ((resid  65 and name   HA) or (resid  69 and name   HA))    ((resid  65 and name  HB#) or (resid  69 and name  HB#)) 3.0 1.2 0.0 !    459:20  Double
assign ((resid  70 and name   HN) or (resid  65 and name   HN))    ((resid  69 and name  HB#) or (resid  65 and name  HB#)) 3.5 1.7 0.0 !    467:20  Double
assign ((resid   2 and name   HA) or (resid  66 and name   HA))    ((resid   2 and name  HB#) or (resid  66 and name  HB#)) 3.0 1.2 0.0 !    471:20  Double
assign ((resid  67 and name   HN) or (resid  66 and name   HN) or (resid   3 and name   HN) or (resid  42 and name   HN))    ((resid  66 and name  HB#) or (resid   2 and name  HB#) or (resid  41 and name  HB#)) 3.0 1.2 0.0 !    475:20  Double
assign ((resid   3 and name   HN) or (resid  42 and name   HN))    ((resid   2 and name  HB#) or (resid  41 and name  HB#)) 5.0 3.2 0.0 !    476:20  Double
assign ((resid  30 and name  HB#) or (resid  65 and name  HB#))    ((resid  30 and name  HE#) or (resid  66 and name  HB#)) 3.0 1.2 0.5 !    484:20  Double  10-8-16
assign ((resid  11 and name  HG#) or (resid  11 and name  HD#) or (resid  62 and name   HB))    ((resid  11 and name  HE#) or (resid  13 and name  HE#)) 3.0 1.2 0.0 !    487:20  Double
assign ((resid  54 and name   HN) or (resid  53 and name   HN))    (resid  53 and name  HB#) 3.5 1.7 0.0 !    508:20  Double
assign ((resid  57 and name  HD#) or (resid  58 and name  HB#) or (resid  60 and name  HB#))    (resid  59 and name  HB#) 7.0 5.2 0.0 !    510:20  Double
assign ((resid  45 and name  HB#) or (resid  26 and name  HB#))    (resid  46 and name  HB#) 5.0 3.2 0.0 !    520:20  Double
assign ((resid  13 and name   HA) or (resid  25 and name   HA))    (resid  26 and name  HG#) 5.0 3.2 0.0 !    572:20  Double
assign ((resid  11 and name  HE#) or (resid  13 and name  HE#))    (resid  26 and name  HG#) 3.5 1.7 0.0 !    575:20  Double
assign ((resid  62 and name HD1#) or (resid  24 and name HG2#))    (resid  13 and name  HB#) 3.0 1.2 0.0 !    589:20  Double
assign ((resid  33 and name   HN) or (resid  40 and name   HN) or (resid  35 and name   HN))    (resid  33 and name  HG#) 5.0 3.2 0.0 !    617:20  Double
assign ((resid  33 and name  HB#) or (resid  40 and name  HB#))    (resid  33 and name  HG#) 3.0 1.2 0.0 !    626:20  Double
assign ((resid  23 and name   HA) or (resid  15 and name   HA) or (resid  18 and name   HA))    (resid  22 and name  HG#) 3.5 1.7 2.5 !    642:20  Double 10-8-17
assign ((resid  33 and name   HN) or (resid  40 and name   HN))    (resid  33 and name  HB#) 3.0 1.2 0.0 !    656:20  Double
assign ((resid  29 and name   HA) or (resid   8 and name   HB) or (resid  62 and name   HA))    ((resid  30 and name  HB#) or (resid  15 and name  HB#)) 5.0 3.2 0.0 !    664:20  Double
assign ((resid  34 and name HD1#) or (resid  40 and name HD##) or (resid  34 and name HG2#))    (resid  33 and name  HB#) 3.5 1.7 0.0 !    669:20  Double
assign ((resid  42 and name   HG) or (resid  29 and name HD1#))    ((resid  30 and name  HB#) or (resid  43 and name   HB)) 3.0 1.2 0.0 !    671:20  Double
assign ((resid  29 and name HG2#) or (resid  56 and name HG##))    ((resid  30 and name  HB#) or (resid  43 and name   HB)) 5.0 3.2 0.0 !    673:20  Double
assign ((resid  42 and name HD##) or (resid  43 and name HG##))    ((resid  30 and name  HB#) or (resid  43 and name   HB)) 3.0 1.2 0.0 !    676:20  Double
assign ((resid  43 and name   HN) or (resid  27 and name   HN))    ((resid  43 and name   HB) or (resid  30 and name  HB#)) 7.0 5.2 0.0 !    682:20  Double
assign ((resid  39 and name   HN) or (resid  65 and name   HN))    ((resid  38 and name  HB#) or (resid  64 and name  HB#)) 3.5 1.7 0.0 !    719:20  Double
assign ((resid  20 and name   HA) or (resid  39 and name   HA))    ((resid  20 and name  HB#) or (resid  39 and name   HB)) 3.0 1.2 0.0 !    725:20  Double
assign ((resid  22 and name   HN) or (resid  22 and name HE2#))    (resid  22 and name  HB#) 5.0 3.2 0.0 !    761:20  Double
assign ((resid  18 and name   HA) or (resid  16 and name   HA))    (resid  22 and name  HB#) 5.0 3.2 0.0 !    763:20  Double
assign ((resid  24 and name HG2#) or (resid  62 and name HD1#))    (resid  13 and name  HD#) 3.0 1.2 0.0 !    772:20  Double
assign ((resid  39 and name   HB) or (resid  29 and name   HB))    ((resid  34 and name HG1#) or (resid  29 and name HG1#)) 5.0 3.2 0.0 !    802:20  Double
assign ((resid  34 and name   HB) or (resid   7 and name  HB#) or (resid   7 and name   HG))    ((resid  34 and name HG1#) or (resid  29 and name HG1#)) 3.0 1.2 0.0 !    803:20  Double
assign ((resid  35 and name   HN) or (resid  40 and name   HN) or (resid  33 and name   HN))    (resid  34 and name HG1#) 5.0 3.2 0.0 !    805:20  Double
assign ((resid  35 and name   HN) or (resid  23 and name   HN) or (resid  40 and name   HN) or (resid  33 and name   HN))    ((resid  34 and name HG1#) or (resid  24 and name HG1#)) 5.0 3.2 0.0 !    806:20  Double
assign ((resid  34 and name   HN) or (resid  39 and name   HN) or (resid  11 and name   HN))    ((resid  34 and name HG1#) or (resid  29 and name HG1#)) 3.5 1.7 0.0 !    807:20  Double
assign ((resid  34 and name   HN) or (resid  39 and name   HN))    (resid  34 and name HG1#) 5.0 3.2 0.0 !    808:20  Double
assign ((resid  23 and name   HN) or (resid  25 and name   HN))    (resid  24 and name HG1#) 5.0 3.2 0.0 !    812:20  Double
assign ((resid  24 and name   HA) or (resid  34 and name   HA))    ((resid  24 and name HG1#) or (resid  34 and name HG1#)) 3.0 1.2 0.0 !    818:20  Double
assign ((resid  24 and name   HB) or (resid  13 and name  HD#))    (resid  24 and name HG1#) 3.0 1.2 0.0 !    825:20  Double
assign ((resid  60 and name  HB#) or (resid  14 and name   HB))    (resid  61 and name HG1#) 5.0 3.2 0.0 !    826:20  Double
assign ((resid  12 and name HG##) or (resid  43 and name HG##))    (resid  29 and name HG1#) 5.0 3.2 0.0 !    829:20  Double
assign ((resid  14 and name HG##) or (resid  39 and name HG##) or (resid  43 and name HG##))    ((resid  34 and name HG1#) or (resid  61 and name HG1#)) 5.0 3.2 0.0 !    831:20  Double
assign ((resid  24 and name HG2#) or (resid  24 and name HD1#))    (resid  24 and name HG1#) 3.0 1.2 0.0 !    832:20  Double
assign ((resid  15 and name   HA) or (resid  23 and name   HA))    (resid  24 and name HG1#) 5.0 3.2 0.0 !    841:20  Double
assign ((resid  10 and name   HB) or (resid  29 and name   HA))    (resid  29 and name HG1#) 5.0 3.2 0.0 !    842:20  Double
assign ((resid  30 and name   HA) or (resid   7 and name   HA))    ((resid  30 and name  HD#) or (resid  29 and name HG1#)) 5.0 3.2 0.0 !    847:20  Double
assign ((resid  64 and name   HA) or (resid  63 and name   HA) or (resid  12 and name   HA))    (resid  64 and name  HG#) 3.5 1.7 0.0 !    849:20  Double
assign ((resid  18 and name  HB#) or (resid  67 and name  HB#))    ((resid  18 and name  HG#) or (resid  69 and name   HG)) 3.0 1.2 0.0 !    864:20  Double
assign ((resid  13 and name  HB#) or (resid  13 and name  HD#))    (resid  62 and name HG1#) 3.0 1.2 0.0 !    872:20  Double
assign ((resid  51 and name  HD#) or (resid  51 and name  HD#))    (resid  51 and name  HG#) 3.5 1.7 0.0 !    875:20  Double
assign ((resid  24 and name HG2#) or (resid  62 and name HD1#))    (resid  13 and name  HG#) 3.0 1.2 0.0 !    878:20  Double
assign ((resid  42 and name   HG) or (resid  14 and name HG##))    ((resid  30 and name  HG#) or (resid  15 and name  HG#)) 5.0 3.2 0.0 !    902:20  Double
assign ((resid  23 and name   HA) or (resid  64 and name   HA))    ((resid  23 and name  HG#) or (resid  67 and name  HG#)) 3.5 1.7 0.0 !    906:20  Double
assign ((resid  23 and name  HE#) or (resid  67 and name  HE#))    ((resid  23 and name  HG#) or (resid  67 and name  HG#)) 3.0 1.2 0.0 !    908:20  Double
assign ((resid  69 and name   HN) or (resid  24 and name   HN))    ((resid  67 and name  HG#) or (resid  23 and name  HG#)) 5.0 3.2 0.0 !    931:20  Double
assign ((resid  13 and name   HA) or (resid  25 and name   HA))    (resid  24 and name HG2#) 5.0 3.2 0.0 !   1138:20  Double
assign ((resid  13 and name  HG#) or (resid  15 and name  HG#))    (resid  24 and name HG2#) 3.5 1.7 0.0 !   1140:20  Double
assign ((resid  13 and name  HD#) or (resid  24 and name   HB))    (resid  24 and name HG2#) 3.0 1.2 0.0 !   1144:20  Double
assign ((resid  67 and name   HA) or (resid  69 and name   HA))    (resid  68 and name  HA#) 7.0 5.2 0.0 !   1328:20  Double
assign ((resid  38 and name  HG#) or (resid  64 and name  HG#))    ((resid  38 and name  HB#) or (resid  64 and name  HB#)) 3.0 1.2 0.0 !   1331:20  Double
assign ((resid  44 and name   HN) or (resid  42 and name   HN))    (resid  30 and name  HG#) 7.0 5.2 0.0 !   1336:20  Double
assign ((resid  23 and name  HE#) or (resid  67 and name  HE#))    ((resid  23 and name  HG#) or (resid  67 and name  HG#)) 3.5 1.7 0.0 !   1338:20  Double
assign ((resid  51 and name  HG#) or (resid  50 and name HG##))    (resid  51 and name  HB#)  3.5 1.7 0.0 !   1351:20  Double
assign ((resid  51 and name  HD#) or (resid  51 and name  HD#))    (resid  51 and name  HB#) 5.0 3.2 0.0 !   1353:20  Double
assign ((resid  11 and name  HE#) or (resid  46 and name  HB#))    (resid  11 and name  HD#) 3.0 1.2 0.0 !   1374:20  Double
assign ((resid  67 and name   HA) or (resid  69 and name   HA) or (resid  17 and name  HA#))    ((resid  67 and name  HD#) or (resid  23 and name  HD#)) 3.5 1.7 0.0 !   1375:20  Double
assign ((resid  29 and name HG2#) or (resid  65 and name HD##) or (resid  56 and name HG##))    ((resid  66 and name  HB#) or (resid  41 and name  HB#)) 3.5 1.7 0.0 !   1378:20  Double
assign ((resid  16 and name  HB#) or (resid  51 and name  HD#))    ((resid  16 and name   HA) or (resid  52 and name   HA)) 5.0 3.2 0.0 !   1393:20  Double
assign ((resid  57 and name  HB#) or (resid  38 and name  HG#))    (resid  57 and name  HG#) 7.0 5.2 0.0 !   1410:20  Double
assign ((resid  23 and name   HA) or (resid  64 and name   HA))    ((resid  23 and name  HD#) or (resid  67 and name  HD#)) 5.0 3.2 0.0 !   1495:20  Double
assign ((resid  40 and name   HG) or (resid  40 and name  HB#))    ((resid  38 and name  HG#) or (resid  56 and name   HB)) 5.0 3.2 0.0 !   1521:20  Double
assign (resid  63 and name   HN) ((resid  62 and name HG1#) or (resid  65 and name HD##)) 5.0 3.2 0.0 !      1:10  Single
assign (resid  63 and name   HN) ((resid  62 and name HG1#) or (resid  61 and name   HB)) 5.0 3.2 0.0 !      2:10  Single
assign (resid  63 and name   HN) ((resid  62 and name   HB) or (resid  65 and name  HB#) or (resid  67 and name  HD#)) 7.0 5.2 0.0 !      3:10  Single
assign (resid  63 and name   HN) ((resid  63 and name   HA) or (resid  64 and name   HA)) 5.0 3.2 0.0 !      8:10  Single
assign (resid  63 and name   HN) ((resid  63 and name  HE3) or (resid  61 and name   HN)) 5.0 3.2 0.0 !      9:10  Single
assign (resid  63 and name  HE1) ((resid  63 and name  HB#) or (resid  59 and name  HB#)) 5.0 3.2 0.0 !     21:10  Single
assign (resid  63 and name  HE1) ((resid  59 and name   HA) or (resid  63 and name   HA)) 7.0 5.2 0.0 !     23:10  Single
assign (resid  30 and name   HN) ((resid  43 and name HG##) or (resid  42 and name HD##)) 5.0 3.2 0.0 !     32:10  Single
assign (resid  30 and name   HN) ((resid  29 and name HD1#) or (resid  42 and name   HG)) 5.0 3.2 0.0 !     33:10  Single
assign (resid  30 and name   HN) ((resid  30 and name  HB#) or (resid  30 and name  HG#)) 3.5 1.7 0.0 !     34:10  Single
assign (resid  30 and name   HN) ((resid  42 and name   HN) or (resid  44 and name   HN)) 5.0 3.2 0.0 !     42:10  Single
assign (resid  42 and name   HN) ((resid  43 and name HG##) or (resid  42 and name HD##)) 5.0 3.2 0.0 !     45:10  Single
assign (resid  42 and name   HN) ((resid  42 and name   HG) or (resid  29 and name HD1#)) 5.0 3.2 0.0 !     46:10  Single
assign (resid  42 and name   HN) ((resid  30 and name  HB#) or (resid  40 and name  HB#) or (resid  33 and name  HB#)) 7.0 5.2 0.0 !     50:10  Single
assign (resid  42 and name   HN) ((resid  42 and name   HA) or (resid  32 and name   HB)) 5.0 3.2 0.0 !     51:10  Single
assign (resid  42 and name   HN) ((resid  55 and name  HH2) or (resid  41 and name  HE#)) 7.0 5.2 0.0 !     55:10  Single
assign (resid  62 and name   HN) ((resid  62 and name HD1#) or (resid  61 and name HG1#)) 5.0 3.2 0.0 !     63:10  Single
assign (resid  62 and name   HN) ((resid  14 and name HG##) or (resid  61 and name HG1#)) 5.0 3.2 0.0 !     65:10  Single
assign (resid  62 and name   HN) ((resid  61 and name   HB) or (resid  15 and name  HG#)) 5.0 3.2 0.0 !     66:10  Single
assign (resid  35 and name   HN) ((resid  34 and name   HB) or (resid  40 and name  HB#) or (resid  33 and name  HB#)) 3.5 1.7 0.2 !     68:10  Single 10-8-16
assign (resid  35 and name   HN) ((resid  38 and name  HB#) or (resid  33 and name  HG#)) 5.0 3.2 0.0 !     73:10  Single
assign (resid  35 and name   HN) ((resid  38 and name  HG#) or (resid  35 and name  HB#)) 3.5 1.7 0.0 !     74:10  Single
assign (resid  35 and name   HN) ((resid  36 and name  HB#) or (resid  57 and name  HE#)) 7.0 5.2 0.0 !     76:10  Single
assign (resid  62 and name   HN) ((resid  61 and name   HA) or (resid  62 and name   HA)) 5.0 3.2 0.0 !     77:10  Single
assign (resid  62 and name   HN) ((resid  12 and name   HA) or (resid  26 and name   HA) or (resid  15 and name   HA)) 7.0 5.2 0.0 !     78:10  Single
assign (resid  35 and name   HN) ((resid  34 and name   HA) or (resid  35 and name   HA)) 3.0 1.2 0.0 !     80:10  Single
assign (resid  62 and name   HN) ((resid  61 and name   HN) or (resid  63 and name  HE3)) 7.0 5.2 0.0 !     84:10  Single
assign (resid  16 and name   HN) ((resid  24 and name HG2#) or (resid  24 and name HD1#)) 5.0 3.2 0.0 !     88:10  Single
assign (resid  16 and name   HN) ((resid  24 and name HG1#) or (resid  56 and name HG##)) 7.0 5.2 0.0 !     89:10  Single
assign (resid  16 and name   HN) ((resid  15 and name  HB#) or (resid  23 and name  HD#)) 5.0 3.2 0.0 !     91:10  Single
assign (resid  16 and name   HN) ((resid  15 and name  HG#) or (resid  24 and name HG1#) or (resid  23 and name  HG#)) 5.0 3.2 0.0 !     92:10  Single
assign (resid  16 and name   HN) ((resid  22 and name  HG#) or (resid  60 and name  HG#)) 5.0 3.2 1.0 !     93:10  Single 10-8-17
assign (resid  16 and name   HN) ((resid  22 and name HE2#) or (resid  16 and name  HD#)) 5.0 3.2 0.0 !    100:10  Single
assign (resid  11 and name   HN) ((resid  11 and name  HG#) or (resid  11 and name  HD#)) 5.0 3.2 0.0 !    107:10  Single
assign (resid  11 and name   HN) ((resid  10 and name   HA) or (resid  10 and name   HB)) 3.5 1.7 0.0 !    111:10  Single
assign (resid  36 and name   HN) ((resid  35 and name  HB#) or (resid  38 and name  HG#)) 5.0 3.2 0.0 !    118:10  Single
assign (resid  40 and name   HN) ((resid  40 and name HD##) or (resid  34 and name HD1#)) 3.5 1.7 0.0 !    131:10  Single
assign (resid  23 and name   HN) ((resid  23 and name  HG#) or (resid  24 and name HG1#)) 3.0 1.2 0.5 !    134:10  Single 10-8-16
assign (resid  23 and name   HN) ((resid  16 and name  HB#) or (resid  23 and name  HE#)) 7.0 5.2 0.0 !    145:10  Single
assign (resid  23 and name   HN) ((resid  22 and name HE2#) or (resid  22 and name   HN)) 7.0 5.2 0.0 !    146:10  Single
assign (resid  25 and name   HN) ((resid  24 and name HG1#) or (resid  62 and name HG1#)) 7.0 5.2 0.0 !    149:10  Single
assign (resid  25 and name   HN) ((resid  13 and name  HG#) or (resid  13 and name  HD#) or (resid  24 and name HG1#)) 5.0 3.2 0.0 !    150:10  Single
assign (resid  25 and name   HN) ((resid  24 and name   HB) or (resid  13 and name  HD#)) 5.0 3.2 0.0 !    151:10  Single
assign (resid  25 and name   HN) ((resid  13 and name  HE#) or (resid  23 and name  HE#) or (resid  16 and name  HB#)) 7.0 5.2 0.0 !    154:10  Single
assign (resid  25 and name   HN) ((resid  15 and name   HA) or (resid  23 and name   HA)) 7.0 5.2 0.0 !    155:10  Single
assign (resid  15 and name   HN) ((resid  14 and name   HB) or (resid  60 and name  HB#)) 7.0 5.2 0.0 !    172:10  Single
assign (resid  15 and name   HN) ((resid  62 and name   HB) or (resid  13 and name  HD#) or (resid  24 and name   HB)) 5.0 3.2 0.5 !    175:10  Single 10-8-16
assign (resid  15 and name   HN) ((resid  56 and name HG##) or (resid  24 and name HG1#) or (resid  62 and name HG1#)) 7.0 5.2 0.0 !    178:10  Single
assign (resid  15 and name   HN) ((resid  62 and name HD1#) or (resid  24 and name HG2#) or (resid  61 and name HG1#)) 5.0 3.2 0.0 !    180:10  Single
assign (resid  72 and name   HN) ((resid  72 and name  HB#) or (resid  71 and name  HB#)) 5.0 3.2 0.0 !    181:10  Single
assign (resid  27 and name   HN) ((resid  12 and name HG##) or (resid  43 and name HG##)) 7.0 5.2 0.0 !    188:10  Single
assign (resid  27 and name   HN) ((resid  13 and name  HG#) or (resid  43 and name   HB)) 7.0 5.2 0.0 !    192:10  Single
assign (resid  27 and name   HN) ((resid  13 and name  HG#) or (resid  13 and name  HB#) or (resid  13 and name  HD#)) 5.0 3.2 0.0 !    193:10  Single
assign (resid  27 and name   HN) ((resid  11 and name  HG#) or (resid  11 and name  HD#) or (resid  62 and name   HB)) 7.0 5.2 0.0 !    194:10  Single
assign (resid  27 and name   HN) ((resid  11 and name  HB#) or (resid  12 and name   HB)) 7.0 5.2 0.0 !    195:10  Single
assign (resid  27 and name   HN) ((resid  26 and name  HB#) or (resid  45 and name  HB#)) 5.0 3.2 0.0 !    196:10  Single
assign (resid  27 and name   HN) ((resid  11 and name  HE#) or (resid  13 and name  HE#)) 7.0 5.2 0.0 !    199:10  Single
assign (resid  27 and name   HN) ((resid  45 and name   HA) or (resid  61 and name   HA)) 7.0 5.2 0.0 !    200:10  Single
assign (resid  27 and name   HN) ((resid  28 and name   HN) or (resid  11 and name   HN)) 7.0 5.2 0.0 !    206:10  Single
assign (resid   7 and name   HN) ((resid   7 and name   HG) or (resid   7 and name  HB#)) 5.0 3.2 0.0 !    211:10  Single
assign (resid  39 and name   HN) ((resid  40 and name HD##) or (resid  34 and name HG2#)) 5.0 3.2 0.0 !    225:10  Single
assign (resid  39 and name   HN) ((resid  38 and name  HG#) or (resid  57 and name  HB#)) 5.0 3.2 0.0 !    227:10  Single
assign (resid  39 and name   HN) ((resid  40 and name   HG) or (resid  40 and name  HB#) or (resid  34 and name   HB)) 5.0 3.2 0.0 !    231:10  Single
assign (resid  39 and name   HN) ((resid  40 and name   HN) or (resid  35 and name   HN)) 5.0 3.2 0.0 !    235:10  Single
assign (resid  33 and name   HN) ((resid  33 and name  HB#) or (resid  40 and name  HB#)) 5.0 3.2 0.0 !    240:10  Single
assign (resid  33 and name   HN) ((resid  41 and name   HA) or (resid  40 and name   HA)) 5.0 3.2 0.0 !    246:10  Single
assign (resid  33 and name   HN) ((resid  55 and name  HH2) or (resid  41 and name  HE#)) 5.0 3.2 0.0 !    249:10  Single
assign (resid   4 and name   HN) ((resid   4 and name  HB#) or (resid   3 and name  HB#)) 3.5 1.7 0.0 !    255:10  Single
assign (resid   4 and name   HN) ((resid   4 and name  HB#) or (resid   3 and name  HB#)) 3.5 1.7 0.0 !    256:10  Single
!10-8-17 assign (resid  22 and name   HN) ((resid  23 and name  HG#) or (resid  23 and name  HB#)) 7.0 5.2 0.0 !    268:10  Single
assign (resid  22 and name   HN) ((resid  22 and name   HA) or (resid  21 and name   HA)) 3.5 1.7 0.0 !    273:10  Single
assign (resid  34 and name   HN) ((resid  33 and name  HB#) or (resid  34 and name   HB)) 3.0 1.2 0.0 !    282:10  Single
assign (resid  34 and name   HN) ((resid  33 and name   HN) or (resid  35 and name   HN) or (resid  40 and name   HN)) 5.0 3.2 0.0 !    286:10  Single
assign (resid  29 and name   HN) ((resid  43 and name HG##) or (resid  12 and name HG##)) 7.0 5.2 0.0 !    288:10  Single
assign (resid  65 and name   HN) ((resid  65 and name  HB#) or (resid  67 and name  HD#) or (resid  65 and name   HG)) 3.0 1.2 0.0 !    292:10  Single
assign (resid  29 and name   HN) ((resid  29 and name   HA) or (resid  10 and name   HB)) 3.5 1.7 0.0 !    297:10  Single
assign (resid  67 and name   HN) ((resid  65 and name  HB#) or (resid  67 and name  HD#)) 5.0 3.2 0.0 !    307:10  Single
assign (resid  38 and name   HN) ((resid  36 and name  HB#) or (resid  57 and name  HE#)) 7.0 5.2 0.0 !    331:10  Single
assign (resid  38 and name   HN) ((resid  37 and name  HA#) or (resid  39 and name   HA)) 3.5 1.7 0.0 !    333:10  Single
assign (resid  69 and name   HN) ((resid  69 and name   HA) or (resid  67 and name   HA)) 5.0 3.2 0.0 !    349:10  Single
assign (resid   2 and name   HN) ((resid   1 and name  HG#) or (resid   4 and name  HG#)) 7.0 5.2 0.0 !    355:10  Single
assign (resid   2 and name   HN) ((resid   1 and name  HB#) or (resid   3 and name  HB#)) 5.0 3.2 0.0 !    356:10  Single
assign (resid   2 and name   HN) ((resid   1 and name  HB#) or (resid   3 and name  HB#)) 5.0 3.2 0.0 !    357:10  Single
assign (resid  43 and name   HN) ((resid  43 and name HG##) or (resid  42 and name HD##)) 3.5 1.7 0.0 !    365:10  Single
assign (resid  43 and name   HN) ((resid  42 and name  HB#) or (resid  27 and name  HB#)) 5.0 3.2 0.0 !    367:10  Single
assign (resid  43 and name   HN) ((resid  56 and name HG##) or (resid  29 and name HG2#)) 5.0 3.2 0.0 !    368:10  Single
assign (resid  43 and name   HN) ((resid  43 and name   HB) or (resid  30 and name  HB#)) 7.0 5.2 0.0 !    369:10  Single
assign (resid  43 and name   HN) ((resid  43 and name   HA) or (resid  53 and name   HA)) 5.0 3.2 0.0 !    371:10  Single
assign (resid  43 and name   HN) ((resid  42 and name   HN) or (resid  44 and name   HN)) 7.0 5.2 0.0 !    373:10  Single
assign (resid  26 and name   HN) ((resid  27 and name  HB#) or (resid  24 and name HG2#)) 7.0 5.2 0.0 !    376:10  Single
assign (resid  26 and name   HN) ((resid  13 and name  HG#) or (resid  13 and name  HD#) or (resid  13 and name  HB#)) 7.0 5.2 0.0 !    377:10  Single
assign (resid  26 and name   HN) ((resid  26 and name  HB#) or (resid  45 and name  HB#)) 5.0 3.2 0.0 !    378:10  Single
assign (resid  14 and name   HN) ((resid  24 and name HG2#) or (resid  62 and name HD1#)) 5.0 3.2 0.0 !    392:10  Single
assign (resid  14 and name   HN) ((resid  61 and name   HA) or (resid  62 and name   HA) or (resid  45 and name   HA)) 7.0 5.2 0.0 !    399:10  Single
assign (resid  14 and name   HN) ((resid  25 and name   HN) or (resid  27 and name   HN)) 5.0 3.2 0.0 !    404:10  Single
assign (resid  53 and name   HN) ((resid  50 and name   HA) or (resid  51 and name   HA)) 5.0 3.2 0.0 !    408:10  Single
assign (resid  57 and name   HN) ((resid  58 and name   HN) or (resid  15 and name   HN)) 7.0 5.2 0.0 !    441:10  Single
assign (resid  24 and name   HN) ((resid  25 and name   HN) or (resid  23 and name   HN)) 5.0 3.2 0.0 !    442:10  Single
!10-8-17 assign (resid  24 and name   HN) ((resid  22 and name  HG#) or (resid  22 and name  HB#)) 7.0 5.2 0.0 !    446:10  Single
assign (resid  24 and name   HN) ((resid  23 and name  HD#) or (resid  24 and name   HB)) 3.5 1.7 0.0 !    447:10  Single
assign (resid  69 and name   HN) ((resid  67 and name  HB#) or (resid  70 and name  HB#)) 7.0 5.2 0.0 !    449:10  Single
assign (resid  69 and name   HN) ((resid  69 and name  HB#) or (resid  69 and name   HG)) 3.0 1.2 0.0 !    450:10  Single
assign (resid  24 and name   HN) ((resid  24 and name HG1#) or (resid  23 and name  HB#)) 3.0 1.2 0.0 !    451:10  Single
assign (resid  24 and name   HN) ((resid  23 and name  HE#) or (resid  16 and name  HB#)) 7.0 5.2 0.0 !    452:10  Single
assign (resid  75 and name   HN) ((resid  75 and name   HA) or (resid  72 and name   HA)) 7.0 5.2 0.0 !    456:10  Single
assign (resid  56 and name   HN) ((resid  43 and name HG##) or (resid  42 and name HD##)) 7.0 5.2 0.0 !    477:10  Single
assign (resid  56 and name   HN) ((resid  40 and name   HA) or (resid  41 and name   HA)) 5.0 3.2 0.0 !    484:10  Single
assign (resid  54 and name   HN) ((resid  42 and name HD##) or (resid  43 and name HG##)) 5.0 3.2 0.0 !    492:10  Single
assign (resid  54 and name   HN) ((resid  43 and name HG##) or (resid  14 and name HG##)) 5.0 3.2 0.0 !    496:10  Single
assign (resid  41 and name   HN) ((resid  43 and name HG##) or (resid  29 and name HD1#) or (resid  14 and name HG##)) 5.0 3.2 0.0 !    503:10  Single
assign (resid  41 and name   HN) ((resid  58 and name   HA) or (resid  39 and name   HA)) 7.0 5.2 0.0 !    509:10  Single
assign (resid  41 and name   HN) ((resid  42 and name   HA) or (resid  32 and name   HB)) 7.0 5.2 0.0 !    510:10  Single
assign (resid  41 and name   HN) ((resid  40 and name   HA) or (resid  41 and name   HA)) 3.5 1.7 0.0 !    512:10  Single
assign (resid  41 and name   HN) ((resid  40 and name   HN) or (resid  33 and name   HN)) 5.0 3.2 0.0 !    520:10  Single
assign (resid  61 and name   HN) ((resid  61 and name HG1#) or (resid  62 and name HD1#)) 5.0 3.2 0.0 !    533:10  Single
assign (resid  61 and name   HN) ((resid  61 and name HG1#) or (resid  14 and name HG##)) 3.5 1.7 0.0 !    534:10  Single
assign (resid  61 and name   HN) ((resid  15 and name  HB#) or (resid  57 and name  HG#)) 5.0 3.2 0.0 !    536:10  Single
assign (resid  61 and name   HN) ((resid  60 and name  HB#) or (resid  58 and name  HB#)) 5.0 3.2 0.0 !    537:10  Single
assign (resid  61 and name   HN) ((resid  61 and name   HA) or (resid  58 and name   HA)) 3.5 1.7 0.0 !    541:10  Single
assign (resid  61 and name   HN) ((resid  41 and name  HE#) or (resid  60 and name   HE)) 7.0 5.2 0.0 !    542:10  Single
assign (resid  13 and name   HN) ((resid  14 and name HG##) or (resid  29 and name HD1#) or (resid  43 and name HG##)) 7.0 5.2 0.0 !    551:10  Single
assign (resid  13 and name   HN) ((resid  62 and name HD1#) or (resid  61 and name HG1#)) 3.5 1.7 0.5 !    552:10  Single
assign (resid  13 and name   HN) (resid  62 and name HG1#) 5.5 3.7 0.0  ! 10-8-16
assign (resid  13 and name   HN) ((resid  13 and name  HG#) or (resid  62 and name HG1#)) 5.0 3.2 0.0 !    553:10  Single
assign (resid  13 and name   HN) ((resid  64 and name  HD#) or (resid  61 and name   HA)) 5.0 3.2 0.0 !    556:10  Single
assign (resid  13 and name   HN) ((resid  14 and name   HA) or (resid  11 and name   HA)) 7.0 5.2 0.0 !    558:10  Single
assign (resid  13 and name   HN) ((resid  62 and name   HN) or (resid  12 and name   HN)) 5.0 3.2 0.0 !    560:10  Single
assign (resid  13 and name   HN) ((resid  63 and name   HN) or (resid  11 and name   HN)) 7.0 5.2 0.0 !    562:10  Single
assign (resid  60 and name   HN) ((resid  61 and name HG1#) or (resid  62 and name HD1#)) 7.0 5.2 0.0 !    565:10  Single
assign (resid  60 and name   HN) ((resid  61 and name HG1#) or (resid  14 and name HG##)) 5.0 3.2 0.0 !    566:10  Single
assign (resid  60 and name   HN) ((resid  58 and name   HA) or (resid  61 and name   HA)) 7.0 5.2 0.0 !    577:10  Single
assign (resid  60 and name   HN) ((resid  57 and name   HA) or (resid  14 and name   HA)) 5.0 3.2 0.0 !    580:10  Single
assign (resid  60 and name   HN) ((resid  41 and name  HE#) or (resid  60 and name   HE)) 7.0 5.2 0.0 !    581:10  Single
assign (resid  60 and name   HN) ((resid  58 and name   HN) or (resid  15 and name   HN)) 7.0 5.2 0.0 !    586:10  Single
assign (resid  44 and name   HN) ((resid  43 and name HG##) or (resid  42 and name HD##)) 5.0 3.2 0.0 !    587:10  Single
assign (resid  44 and name   HN) ((resid  43 and name HG##) or (resid  29 and name HD1#)) 5.0 3.2 0.0 !    588:10  Single
assign (resid  44 and name   HN) ((resid  43 and name   HB) or (resid  30 and name  HB#)) 5.0 3.2 0.0 !    591:10  Single
assign (resid  44 and name   HN) ((resid  29 and name   HA) or (resid  50 and name   HA)) 7.0 5.2 0.0 !    594:10  Single
assign (resid  18 and name   HN) ((resid  22 and name   HA) or (resid  21 and name   HA)) 7.0 5.2 0.0 !    602:10  Single
assign (resid  12 and name   HN) ((resid  29 and name HD1#) or (resid  43 and name HG##)) 7.0 5.2 0.0 !    608:10  Single
assign (resid  12 and name   HN) ((resid  27 and name  HB#) or (resid  61 and name HG1#)) 7.0 5.2 0.0 !    609:10  Single
assign (resid  12 and name   HN) ((resid  11 and name  HG#) or (resid  29 and name HG1#)) 5.0 3.2 0.0 !    610:10  Single
assign (resid  12 and name   HN) ((resid  11 and name  HD#) or (resid  11 and name  HG#)) 5.0 3.2 0.0 !    611:10  Single
assign (resid  12 and name   HN) ((resid  10 and name   HB) or (resid  29 and name   HA) or (resid  45 and name   HA)) 7.0 5.2 0.0 !    615:10  Single
assign (resid  12 and name   HN) ((resid  12 and name   HA) or (resid  26 and name   HA)) 5.0 3.2 0.0 !    616:10  Single
assign (resid  12 and name   HN) ((resid  11 and name   HN) or (resid  28 and name   HN)) 5.0 3.2 0.0 !    622:10  Single
assign (resid   8 and name   HN) ((resid   7 and name HD##) or (resid  29 and name HG1#)) 5.0 3.2 0.0 !    626:10  Single
assign (resid  10 and name   HN) ((resid  29 and name   HB) or (resid  11 and name  HB#)) 7.0 5.2 0.0 !    631:10  Single
assign (resid  10 and name   HN) ((resid  10 and name   HB) or (resid  10 and name   HA)) 3.5 1.7 0.0 !    635:10  Single
assign (resid   8 and name   HN) ((resid   8 and name   HB) or (resid  10 and name   HB)) 5.0 3.2 0.0 !    637:10  Single
assign (resid  17 and name   HN) ((resid  16 and name  HD#) or (resid  22 and name HE2#)) 7.0 5.2 0.0 !    650:10  Single
assign (resid   9 and name   HN) ((resid   8 and name   HB) or (resid  10 and name   HB)) 5.0 3.2 0.0 !    658:10  Single
assign (resid   9 and name   HN) ((resid   8 and name HG2#) or (resid  30 and name  HG#) or (resid  30 and name  HG#)) 5.0 3.2 0.0 !    661:10  Single
assign (resid  32 and name   HN) ((resid   7 and name HD##) or (resid  29 and name HG2#)) 5.0 3.2 0.0 !    663:10  Single
assign (resid  41 and name  HD#) ((resid  59 and name   HN) or (resid  32 and name   HN)) 7.0 5.2 0.0 !    684:10  Single
assign (resid  28 and name   HN) ((resid  46 and name  HB#) or (resid  11 and name  HE#)) 5.0 3.2 0.0 !    689:10  Single
assign (resid  28 and name   HN) ((resid  27 and name   HA) or (resid  43 and name   HA)) 3.5 1.7 0.0 !    693:10  Single
assign (resid  28 and name   HN) ((resid  27 and name   HN) or (resid  43 and name   HN)) 5.0 3.2 0.0 !    701:10  Single
assign (resid  22 and name HE2#) ((resid  24 and name HD1#) or (resid  24 and name HG2#)) 7.0 5.2 0.0 !    703:10  Single
assign (resid  22 and name HE2#) ((resid  22 and name  HB#) or (resid  15 and name  HB#)) 5.0 3.2 0.0 !    705:10  Single
assign (resid  22 and name HE2#) ((resid  15 and name   HA) or (resid  16 and name   HA)) 5.0 3.2 0.0 !    710:10  Single
assign (resid  31 and name   HN) ((resid  29 and name   HA) or (resid   8 and name   HB)) 7.0 5.2 0.0 !    726:10  Single
assign (resid  31 and name   HN) ((resid  42 and name   HA) or (resid  32 and name   HB) or (resid   8 and name   HA)) 7.0 5.2 0.0 !    727:10  Single
assign (resid  31 and name   HN) ((resid  42 and name HD##) or (resid  43 and name HG##)) 5.0 3.2 0.0 !    734:10  Single
assign (resid  31 and name   HN) ((resid  42 and name   HG) or (resid  29 and name HD1#)) 5.0 3.2 0.0 !    735:10  Single
assign (resid  31 and name   HN) ((resid  29 and name HG2#) or (resid   7 and name HD##)) 3.5 1.7 0.0 !    736:10  Single
assign (resid  31 and name   HN) ((resid  30 and name  HG#) or (resid   8 and name HG2#)) 5.0 3.2 0.0 !    738:10  Single
assign (resid  68 and name   HN) ((resid  69 and name  HB#) or (resid  65 and name  HB#)) 7.0 5.2 0.0 !    750:10  Single
assign (resid  21 and name   HN) ((resid  20 and name  HB#) or (resid  22 and name  HB#)) 7.0 5.2 0.0 !    756:10  Single
assign (resid  37 and name   HN) ((resid  38 and name  HG#) or (resid  35 and name  HB#)) 7.0 5.2 0.0 !    766:10  Single
assign (resid  30 and name   HN) ((resid  41 and name  HB#) or (resid  44 and name  HB#)) 7.0 5.2 0.0 !    787:10  Single
!10-8-13, K30 assign (resid  30 and name   HN) ((resid  31 and name  HB#) or (resid  28 and name  HB#)) 7.0 5.2 0.0 !    788:10  Single
assign (resid  61 and name   HN) ((resid  57 and name  HG#) or (resid  62 and name   HB)) 7.0 5.2 0.0 !    796:10  Single
assign (resid  57 and name   HN) ((resid  56 and name   HA) or (resid  57 and name   HA)) 5.0 3.2 0.0 !    800:10  Single
assign ((resid  23 and name  HD#) or (resid  40 and name  HB#) or (resid  40 and name   HG))    ((resid  23 and name   HN) or (resid  40 and name   HN)) 3.0 1.2 0.0 !    132:10  Double
assign ((resid  15 and name   HA) or (resid  16 and name   HA) or (resid  33 and name   HA))    ((resid  23 and name   HN) or (resid  40 and name   HN)) 5.0 3.2 0.0 !    137:10  Double
assign ((resid  34 and name   HA) or (resid  24 and name   HA))    ((resid  40 and name   HN) or (resid  23 and name   HN)) 3.5 1.7 0.0 !    139:10  Double
assign ((resid  16 and name   HN) or (resid  41 and name   HN))    ((resid  23 and name   HN) or (resid  40 and name   HN)) 5.0 3.2 0.0 !    144:10  Double
assign ((resid  29 and name HG1#) or (resid  65 and name HD##))    ((resid  29 and name   HN) or (resid  65 and name   HN)) 3.5 1.7 0.0 !    287:10  Double
assign ((resid  67 and name  HG#) or (resid  10 and name HG2#))    ((resid  65 and name   HN) or (resid  29 and name   HN)) 7.0 5.2 0.0 !    291:10  Double
assign ((resid  65 and name HD##) or (resid  56 and name HG##))    ((resid  66 and name   HN) or (resid  57 and name   HN)) 3.5 1.7 0.0 !    426:10  Double
assign ((resid  57 and name  HB#) or (resid   3 and name  HB#))    ((resid  57 and name   HN) or (resid   3 and name   HN)) 3.0 1.2 0.0 !    429:10  Double
assign ((resid  66 and name  HB#) or (resid   2 and name  HB#))    ((resid  66 and name   HN) or (resid   3 and name   HN)) 3.5 1.7 0.0 !    430:10  Double
assign ((resid  65 and name   HA) or (resid   1 and name   HA))    ((resid  66 and name   HN) or (resid   3 and name   HN)) 3.5 1.7 0.0 !    436:10  Double
assign ((resid   2 and name   HA) or (resid  66 and name   HA))    ((resid   3 and name   HN) or (resid  66 and name   HN)) 3.0 1.2 0.0 !    437:10  Double
assign ((resid  57 and name  HG#) or (resid  33 and name  HB#))    ((resid  59 and name   HN) or (resid  32 and name   HN)) 5.0 3.2 0.0 !    665:10  Double
assign ((resid  41 and name   HA) or (resid  40 and name   HA))    ((resid  32 and name   HN) or (resid  59 and name   HN)) 7.0 5.2 0.0 !    677:10  Double
assign ((resid  55 and name  HH2) or (resid  41 and name  HE#))    ((resid  32 and name   HN) or (resid  59 and name   HN)) 5.0 3.2 0.0 !    683:10  Double
assign ((resid  24 and name HD1#) or (resid  24 and name HG2#))    (resid  22 and name HE2#) 7.0 5.2 0.0 !    702:10  Double
assign ((resid  22 and name  HB#) or (resid  15 and name  HB#))    (resid  22 and name HE2#) 5.0 3.2 0.0 !    704:10  Double
assign ((resid  22 and name  HG#) or (resid  22 and name  HG#))    (resid  22 and name HE2#) 3.5 1.7 0.0 !    707:10  Double
assign ((resid  16 and name   HA) or (resid  18 and name   HA))    (resid  22 and name HE2#) 5.0 3.2 0.0 !    713:10  Double
assign ((resid  65 and name  HB#) or (resid  57 and name  HG#))    ((resid  66 and name   HN) or (resid  57 and name   HN)) 3.5 1.7 0.0 !    793:10  Double
assign (resid  41 and name  HD#) ((resid  40 and name   HA) or (resid  41 and name   HA)) 5.0 3.2 0.0 !     14:25  Single
assign (resid  41 and name  HD#) ((resid  29 and name HG2#) or (resid   7 and name HD##)) 3.5 1.7 0.0 !     18:25  Single
assign (resid  41 and name  HD#) ((resid  29 and name HD1#) or (resid  43 and name HG##)) 5.0 3.2 0.0 !     19:25  Single
assign (resid  46 and name  HD#) ((resid  46 and name  HB#) or (resid  11 and name  HE#)) 3.0 1.2 0.0 !     23:25  Single
assign (resid  46 and name  HD#) ((resid  26 and name  HB#) or (resid  45 and name  HB#)) 5.0 3.2 0.0 !     24:25  Single
assign (resid  63 and name  HD1) ((resid  62 and name   HA) or (resid  58 and name   HA) or (resid  61 and name   HA)) 5.0 3.2 0.0 !     45:25  Single
assign (resid  45 and name  HE#) ((resid  25 and name  HB#) or (resid  54 and name  HG#)) 3.5 1.7 0.0 !     89:25  Single
assign (resid  63 and name  HZ2) ((resid  58 and name   HA) or (resid  29 and name   HA)) 7.0 5.2 0.0 !    114:25  Single
assign ((resid  11 and name  HG#) or (resid  23 and name  HG#))    ((resid  46 and name  HD#) or (resid  16 and name  HD#)) 7.0 5.2 0.0 !     21:25  Double
assign ((resid  16 and name  HD#) or (resid  46 and name  HD#))    ((resid  16 and name  HE#) or (resid  46 and name  HE#)) 3.0 1.2 0.0 !     81:25  Double
assign ((resid  65 and name HD##) or (resid 7 and name HD##)) ((resid 65 and name HG) or (resid 65 and name HB#) or (resid 7 and name HG) or (resid 7 and name HB#)) 3.0 1.5 0.0 ! 1467:20
assign ((resid  34 and name HD1#) or (resid  40 and name HD##) or (resid  34 and name HG2#))    (resid  33 and name  HB#) 3.0 1.5 0.5 ! 867:20
assign (resid  40 and name HD##) ((resid  40 and name   HG) or (resid  40 and name  HB#)) 3.0 1.5 0.0  !    961,925:20  Single
assign (resid  40 and name HD##) ((resid  60 and name  HB#) or (resid  58 and name  HB#)) 3.5 1.7 1.0 !    923:20  Single 10-8-12
assign (resid  29 and name HD1#) ((resid  43 and name HG##) or (resid  12 and name HG##)) 3.0 1.5 0.0 !   1267:20  Single
assign (resid   7 and name HD##) ((resid   7 and name  HB#) or (resid   7 and name   HG)) 3.0 1.5 0.0 !    928:20  Single
assign ((resid  65 and name HD##) or (resid   7 and name HD##) or (resid  29 and name HG2#))    ((resid  65 and name  HB#)or (resid   7 and name  HB#)) 3.0 1.5 0.0 !    455:20  Double
! 10-8-5 assign ((resid   8 and name   HA) or (resid  42 and name   HA))    ((resid   3 and name   HN) or (resid  57 and name   HN)) 7.0 5.2 0.0 !    434:10  Double
assign (resid  26 and name  HG#) ((resid  13 and name  HE#) or (resid  11 and name  HE#)) 5.0 3.2 0.0 !    576:20  Single for K67
assign (resid  10 and name   HB) ((resid  29 and name   HB) or (resid  11 and name  HB#)) 5.0 3.2 0.0 !     16:20  Single
assign ((resid   4 and name   HN) or (resid  39 and name   HN))    ((resid   4 and name  HG#) or (resid  38 and name  HG#)) 3.0 1.2 0.0 !    601:20  Double
assign (resid  32 and name HG2#) ((resid  39 and name   HB) or (resid  33 and name  HG#) or (resid  29 and name   HB) or (resid  57 and name  HB#)) 5.0 3.2 0.0 !   1014:20  Single
assign ((resid   4 and name   HA) or (resid   3 and name   HA)) (resid   4 and name  HG#) 3.0 1.2 0.0 !   1369:20  
assign (resid  33 and name   HN) (resid  32 and name   HB) 3.5 1.7 0.0 !      0:20  Unique
assign (resid  32 and name   HN) (resid  32 and name   HB) 3.5 1.7 0.0 !      1:20  Unique
assign (resid  41 and name  HD#) (resid  32 and name   HB) 7.0 5.2 0.0 !      2:20  Unique
assign (resid  55 and name  HZ3) (resid  32 and name   HB) 7.0 5.2 0.0 !      3:20  Unique
assign (resid  41 and name  HE#) (resid  32 and name   HB) 7.0 5.2 0.0 !      4:20  Unique
assign (resid  32 and name   HA) (resid  32 and name   HB) 3.5 1.7 0.0 !      5:20  Unique
assign (resid  41 and name   HA) (resid  32 and name   HB) 7.0 5.2 0.0 !      6:20  Unique
assign (resid  32 and name HG2#) (resid  32 and name   HB) 3.0 1.2 0.0 !     11:20  Unique
assign (resid  39 and name HG##) (resid  32 and name   HB) 3.5 1.7 0.0 !     12:20  Unique
assign (resid  11 and name   HN) (resid  10 and name   HB) 3.5 1.7 0.5 !     13:20  Unique 10-8-12
assign (resid  10 and name   HN) (resid  10 and name   HB) 7.0 5.2 0.0 !     14:20  Unique
assign (resid  29 and name HG1#) (resid  10 and name   HB) 3.5 1.7 0.0 !     17:20  Unique
assign (resid  29 and name HD1#) (resid  10 and name   HB) 5.0 3.2 0.0 !     18:20  Unique
assign (resid   8 and name HG2#) (resid   8 and name   HB) 3.0 1.2 0.0 !     19:20  Unique
assign (resid   8 and name   HA) (resid   8 and name   HB) 3.0 1.2 0.0 !     20:20  Unique
assign (resid  21 and name HG2#) (resid  21 and name   HB) 3.0 1.2 0.0 !     22:20  Unique
assign (resid   8 and name   HN) (resid   8 and name   HB) 7.0 5.2 0.0 !     24:20  Unique
assign (resid  12 and name   HN) (resid  28 and name  HB#) 7.0 5.2 0.0 !     26:20  Unique
assign (resid  12 and name   HN) (resid  28 and name  HB#) 5.0 3.2 0.0 !     27:20  Unique
assign (resid  29 and name   HN) (resid  28 and name  HB#) 3.0 1.2 0.0 !     28:20  Unique
assign (resid  29 and name   HN) (resid  28 and name  HB#) 3.5 1.7 0.0 !     29:20  Unique
assign (resid  28 and name   HA) (resid  28 and name  HB#) 3.5 1.7 0.0 !     32:20  Unique
assign (resid  28 and name   HA) (resid  28 and name  HB#) 3.5 1.7 0.0 !     35:20  Unique
assign (resid  27 and name  HB#) (resid  28 and name  HB#) 7.0 5.2 0.0 !     41:20  Unique
assign (resid  11 and name  HB#) (resid  28 and name  HB#) 7.0 5.2 0.0 !     43:20  Unique
assign (resid  32 and name   HN) (resid  31 and name  HB#) 3.5 1.7 0.0 !     48:20  Unique
assign (resid  32 and name   HN) (resid  31 and name  HB#) 3.5 1.7 0.0 !     49:20  Unique
assign (resid  31 and name   HN) (resid  31 and name  HB#) 5.0 3.2 0.0 !     50:20  Unique
assign (resid  31 and name   HN) (resid  31 and name  HB#) 7.0 5.2 0.0 !     51:20  Unique
assign (resid  55 and name  HH2) (resid  31 and name  HB#) 5.0 3.2 0.0 !     52:20  Unique
assign (resid  55 and name  HH2) (resid  31 and name  HB#) 5.0 3.2 0.0 !     53:20  Unique
assign (resid  31 and name   HA) (resid  31 and name  HB#) 3.5 1.7 0.0 !     55:20  Unique
assign (resid  31 and name   HA) (resid  31 and name  HB#) 3.5 1.7 0.0 !     56:20  Unique
assign (resid  42 and name  HB#) (resid  31 and name  HB#) 5.0 3.2 0.0 !     62:20  Unique
assign (resid  42 and name  HB#) (resid  31 and name  HB#) 5.0 3.2 0.0 !     63:20  Unique
assign (resid  42 and name HD##) (resid  31 and name  HB#) 3.5 1.7 0.0 !     64:20  Unique
assign (resid  29 and name HG2#) (resid  31 and name  HB#) 5.0 3.2 0.0 !     65:20  Unique
assign (resid  42 and name   HG) (resid  31 and name  HB#) 7.0 5.2 0.0 !     66:20  Unique
assign (resid  42 and name   HG) (resid  31 and name  HB#) 7.0 5.2 0.0 !     67:20  Unique
assign (resid  42 and name HD##) (resid  31 and name  HB#) 3.5 1.7 0.0 !     68:20  Unique
assign (resid  42 and name HD##) (resid  31 and name  HB#) 5.0 3.2 0.0 !     69:20  Unique
assign (resid  42 and name HD##) (resid  31 and name  HB#) 5.0 3.2 0.0 !     70:20  Unique
assign (resid   8 and name HG2#) (resid   8 and name   HA) 3.0 1.2 0.0 !     72:20  Unique
assign (resid  29 and name   HB) (resid   8 and name   HA) 7.0 5.2 0.0 !     74:20  Unique
assign (resid  11 and name  HB#) (resid  10 and name   HA) 5.0 3.2 0.0 !     75:20  Unique
assign (resid  10 and name HG2#) (resid  10 and name   HA) 3.0 1.2 0.0 !     78:20  Unique
assign (resid  39 and name HG##) (resid  39 and name   HA) 3.0 1.2 0.0 !     79:20  Unique
assign (resid   8 and name   HB) (resid   8 and name   HA) 3.0 1.2 0.0 !     81:20  Unique
assign (resid   9 and name  HA#) (resid   8 and name   HA) 5.0 3.2 0.0 !     82:20  Unique
assign (resid  10 and name   HN) (resid   8 and name   HA) 7.0 5.2 0.0 !     85:20  Unique
assign (resid   9 and name   HN) (resid   8 and name   HA) 3.5 1.7 0.0 !     86:20  Unique
assign (resid  10 and name   HN) (resid  10 and name   HA) 5.0 3.2 0.0 !     87:20  Unique
assign (resid  11 and name   HN) (resid  10 and name   HA) 3.5 1.7 0.0 !     88:20  Unique
assign (resid   5 and name  HD#) (resid   5 and name   HA) 5.0 3.2 0.0 !     90:20  Unique
assign (resid  64 and name  HB#) (resid  64 and name   HA) 3.0 1.2 0.0 !     92:20  Unique
assign (resid  64 and name  HG#) (resid  64 and name   HA) 3.0 1.2 0.0 !     93:20  Unique
assign (resid  64 and name  HB#) (resid  64 and name   HA) 3.0 1.2 0.0 !     94:20  Unique
assign (resid  64 and name  HD#) (resid  64 and name   HA) 5.0 3.2 0.0 !     96:20  Unique
assign (resid   5 and name  HB#) (resid   5 and name   HA) 3.0 1.2 0.0 !     98:20  Unique
assign (resid   5 and name  HB#) (resid   5 and name   HA) 3.0 1.2 0.0 !     99:20  Unique
assign (resid  65 and name   HN) (resid  64 and name   HA) 3.0 1.2 0.0 !    102:20  Unique
assign (resid   6 and name   HN) (resid   5 and name   HA) 3.5 1.7 0.0 !    103:20  Unique
assign (resid  39 and name HG##) (resid  39 and name   HA) 3.0 1.2 0.0 !    104:20  Unique
assign (resid  34 and name HG1#) (resid  39 and name   HA) 5.0 3.2 0.0 !    106:20  Unique
assign (resid  39 and name   HB) (resid  39 and name   HA) 3.0 1.2 0.0 !    107:20  Unique
assign (resid  34 and name   HA) (resid  39 and name   HA) 3.0 1.2 0.0 !    108:20  Unique
assign (resid  39 and name   HN) (resid  39 and name   HA) 3.5 1.7 0.0 !    109:20  Unique
assign (resid  43 and name HG##) (resid  29 and name   HA) 3.5 1.7 0.0 !    111:20  Unique
assign (resid  43 and name   HA) (resid  29 and name   HA) 5.0 3.2 0.0 !    118:20  Unique
assign (resid  63 and name   HN) (resid  62 and name   HA) 3.5 1.7 0.0 !    119:20  Unique
assign (resid  30 and name   HN) (resid  29 and name   HA) 3.5 1.7 0.0 !    120:20  Unique
assign (resid  61 and name HG2#) (resid  61 and name   HA) 3.0 1.2 0.0 !    121:20  Unique
assign (resid  61 and name HD1#) (resid  61 and name   HA) 3.5 1.7 0.5 !    122:20  Unique 10-8-16
assign (resid  21 and name HG2#) (resid  21 and name   HA) 3.0 1.2 0.5 !    123:20  Unique  10-8-17, T21
assign (resid  20 and name  HG#) (resid  21 and name   HA) 5.0 3.2 2.0 !    124:20  Unique  10-8-18, T21
assign (resid  22 and name   HN) (resid  21 and name   HA) 5.0 3.2 0.0 !    129:20  Unique
assign (resid  62 and name HG2#) (resid  62 and name   HA) 3.0 1.2 0.0 !    131:20  Unique
assign (resid  61 and name   HN) (resid  61 and name   HA) 5.0 3.2 0.0 !    135:20  Unique
assign (resid  62 and name   HN) (resid  61 and name   HA) 3.0 1.2 0.0 !    136:20  Unique
assign (resid  63 and name  HD1) (resid  62 and name   HA) 5.0 3.2 0.0 !    137:20  Unique
assign (resid  61 and name HG2#) (resid  12 and name   HA) 5.0 3.2 0.0 !    138:20  Unique
assign (resid  12 and name HG##) (resid  12 and name   HA) 5.0 3.2 0.0 !    140:20  Unique
assign (resid  12 and name   HB) (resid  12 and name   HA) 3.5 1.7 0.0 !    142:20  Unique
assign (resid  64 and name  HD#) (resid  12 and name   HA) 5.0 3.2 0.0 !    143:20  Unique
assign (resid  13 and name   HN) (resid  12 and name   HA) 3.5 1.7 0.0 !    144:20  Unique
assign (resid   7 and name HD##) (resid   6 and name   HA) 5.0 3.2 0.0 !    146:20  Unique
assign (resid   7 and name   HN) (resid   6 and name   HA) 3.5 1.7 0.0 !    150:20  Unique
assign (resid  20 and name  HG#) (resid  20 and name   HA) 3.0 1.2 0.0 !    152:20  Unique
assign (resid  20 and name  HB#) (resid  20 and name   HA) 3.0 1.2 0.0 !    154:20  Unique
assign (resid  27 and name  HB#) (resid  45 and name   HA) 5.0 3.2 0.0 !    155:20  Unique
assign (resid  11 and name  HB#) (resid  45 and name   HA) 7.0 5.2 0.0 !    156:20  Unique
assign (resid  54 and name  HB#) (resid  45 and name   HA) 7.0 5.2 0.0 !    157:20  Unique
assign (resid  21 and name HG2#) (resid  20 and name   HA) 7.0 5.2 0.0 !    158:20  Unique
assign (resid  27 and name   HA) (resid  45 and name   HA) 5.0 3.2 0.0 !    159:20  Unique
assign (resid  46 and name   HN) (resid  45 and name   HA) 3.5 1.7 0.0 !    162:20  Unique
assign (resid  34 and name HG1#) (resid  34 and name   HA) 3.5 1.7 0.0 !    165:20  Unique
assign (resid  34 and name HG1#) (resid  34 and name   HA) 3.5 1.7 0.0 !    168:20  Unique
assign (resid  39 and name   HA) (resid  34 and name   HA) 5.0 3.2 0.0 !    170:20  Unique
assign (resid  25 and name  HD#) (resid  24 and name   HA) 5.0 3.2 0.0 !    172:20  Unique
assign (resid  24 and name   HN) (resid  24 and name   HA) 5.0 3.2 0.0 !    173:20  Unique
assign (resid  38 and name   HN) (resid  34 and name   HA) 5.0 3.2 0.0 !    177:20  Unique
assign (resid  16 and name   HN) (resid  24 and name   HA) 5.0 3.2 0.0 !    178:20  Unique
assign (resid  46 and name  HB#) (resid  46 and name   HA) 3.5 1.7 0.0 !    179:20  Unique
assign (resid  46 and name  HD#) (resid  46 and name   HA) 5.0 3.2 0.0 !    180:20  Unique
assign (resid  46 and name   HN) (resid  46 and name   HA) 7.0 5.2 0.0 !    181:20  Unique
assign (resid  51 and name  HG#) (resid  51 and name   HA) 5.0 3.2 0.0 !    182:20  Unique
assign (resid  51 and name  HG#) (resid  51 and name   HA) 5.0 3.2 0.0 !    183:20  Unique
assign (resid  51 and name  HB#) (resid  51 and name   HA) 3.0 1.2 0.0 !    184:20  Unique
assign (resid  70 and name  HB#) (resid  70 and name   HA) 3.0 1.2 0.0 !    185:20  Unique
assign (resid  70 and name  HG#) (resid  70 and name   HA) 3.0 1.2 0.0 !    186:20  Unique
assign (resid  52 and name   HN) (resid  51 and name   HA) 3.5 1.7 0.0 !    189:20  Unique
assign (resid  70 and name   HN) (resid  70 and name   HA) 5.0 3.2 0.0 !    190:20  Unique
assign (resid  67 and name  HB#) (resid  67 and name   HA) 3.0 1.2 0.0 !    193:20  Unique
assign (resid  68 and name  HA#) (resid  67 and name   HA) 5.0 3.2 0.0 !    195:20  Unique
assign (resid  60 and name   HN) (resid  60 and name   HA) 3.5 1.7 0.0 !    196:20  Unique
assign (resid  67 and name   HN) (resid  67 and name   HA) 5.0 3.2 0.0 !    197:20  Unique
assign (resid  68 and name   HN) (resid  67 and name   HA) 5.0 3.2 0.0 !    198:20  Unique
assign (resid  60 and name  HD#) (resid  60 and name   HA) 5.0 3.2 0.0 !    199:20  Unique
assign (resid  60 and name  HB#) (resid  60 and name   HA) 5.0 3.2 0.0 !    200:20  Unique
assign (resid  64 and name  HB#) (resid  65 and name   HA) 5.0 3.2 0.0 !    201:20  Unique
assign (resid  69 and name HD##) (resid  69 and name   HA) 3.0 1.2 0.0 !    204:20  Unique
assign (resid  36 and name  HB#) (resid  36 and name   HA) 3.0 1.2 0.0 !    206:20  Unique
assign (resid  35 and name   HA) (resid  36 and name   HA) 5.0 3.2 0.0 !    208:20  Unique
assign (resid  37 and name   HN) (resid  36 and name   HA) 3.0 1.2 0.0 !    209:20  Unique ! 10-8-16, D36
assign (resid  36 and name   HN) (resid  36 and name   HA) 3.5 1.7 0.0 !    210:20  Unique
assign (resid  70 and name   HN) (resid  69 and name   HA) 3.5 1.7 0.0 !    211:20  Unique
assign (resid  58 and name   HN) (resid  58 and name   HA) 3.5 1.7 0.0 !    212:20  Unique
assign (resid  59 and name   HN) (resid  58 and name   HA) 7.0 5.2 0.0 !    213:20  Unique
assign (resid  41 and name  HD#) (resid  58 and name   HA) 5.0 3.2 0.0 !    214:20  Unique
assign (resid  41 and name  HE#) (resid  58 and name   HA) 3.0 1.2 0.0 !    215:20  Unique
assign (resid  58 and name  HB#) (resid  58 and name   HA) 3.0 1.2 0.0 !    218:20  Unique
assign (resid  61 and name HD1#) (resid  58 and name   HA) 5.0 3.2 0.0 !    219:20  Unique
assign (resid  61 and name HG2#) (resid  58 and name   HA) 7.0 5.2 0.0 !    220:20  Unique
assign (resid  66 and name   HN) (resid  65 and name   HA) 3.0 1.2 0.0 !    229:20  Unique
assign (resid   1 and name  HB#) (resid   1 and name   HA) 3.0 1.2 0.0 !    230:20  Unique
assign (resid  66 and name  HB#) (resid  65 and name   HA) 7.0 5.2 0.0 !    231:20  Unique
assign (resid   3 and name  HB#) (resid   3 and name   HA) 3.0 1.2 0.0 !    233:20  Unique
assign (resid  60 and name  HG#) (resid  60 and name   HA) 5.0 3.2 0.0 !    235:20  Unique
assign (resid   4 and name   HN) (resid   3 and name   HA) 3.0 1.2 0.0 !    237:20  Unique
assign (resid   2 and name   HN) (resid   1 and name   HA) 3.5 1.7 0.0 !    238:20  Unique
assign (resid   1 and name  HG#) (resid   1 and name   HA) 5.0 3.2 0.0 !    240:20  Unique
assign (resid   1 and name  HB#) (resid   1 and name   HA) 5.0 3.2 0.0 !    241:20  Unique
assign (resid  22 and name  HB#) (resid  22 and name   HA) 3.0 1.2 0.0 !    246:20  Unique
assign (resid  22 and name  HG#) (resid  22 and name   HA) 3.0 1.2 0.5 !    247:20  Unique 10-8-17
assign (resid  72 and name  HB#) (resid  72 and name   HA) 3.0 1.2 0.0 !    249:20  Unique
assign (resid  72 and name  HB#) (resid  72 and name   HA) 3.5 1.7 0.0 !    250:20  Unique
assign (resid  23 and name   HN) (resid  22 and name   HA) 3.0 1.2 0.0 !    251:20  Unique
assign (resid  30 and name   HN) (resid  30 and name   HA) 5.0 3.2 0.0 !    253:20  Unique
assign (resid   8 and name   HA) (resid  30 and name   HA) 5.0 3.2 0.0 !    257:20  Unique
assign (resid  16 and name  HD#) (resid  16 and name   HA) 3.0 1.2 0.0 !    258:20  Unique
assign (resid  52 and name  HD#) (resid  52 and name   HA) 3.0 1.2 0.0 !    259:20  Unique
assign (resid  53 and name   HN) (resid  52 and name   HA) 5.0 3.2 0.0 !    260:20  Unique
assign (resid  52 and name   HN) (resid  52 and name   HA) 7.0 5.2 0.0 !    261:20  Unique
assign (resid  32 and name   HN) (resid  31 and name   HA) 3.0 1.2 0.0 !    262:20  Unique
assign (resid  27 and name   HN) (resid  26 and name   HA) 3.0 1.2 0.0 !    263:20  Unique
assign (resid  16 and name   HN) (resid  15 and name   HA) 5.0 3.2 0.0 !    264:20  Unique
assign (resid  31 and name   HN) (resid  31 and name   HA) 5.0 3.2 0.0 !    265:20  Unique
assign (resid  31 and name  HB#) (resid  31 and name   HA) 3.5 1.7 0.0 !    266:20  Unique
assign (resid  31 and name  HB#) (resid  31 and name   HA) 5.0 3.2 0.0 !    267:20  Unique
assign (resid  26 and name  HB#) (resid  26 and name   HA) 3.5 1.7 0.0 !    268:20  Unique
assign (resid  71 and name  HB#) (resid  71 and name   HA) 3.0 1.2 0.0 !    271:20  Unique
assign (resid  73 and name  HB#) (resid  73 and name   HA) 3.0 1.2 0.0 !    273:20  Unique
assign (resid  34 and name HD1#) (resid  33 and name   HA) 5.0 3.2 0.0 !    275:20  Unique
assign (resid  39 and name HG##) (resid  38 and name   HA) 3.5 1.7 0.0 !    279:20  Unique
assign (resid  42 and name HD##) (resid  54 and name   HA) 3.5 1.7 0.0 !    281:20  Unique
assign (resid  61 and name HG2#) (resid  63 and name   HA) 7.0 5.2 0.0 !    282:20  Unique
assign (resid  63 and name  HB#) (resid  63 and name   HA) 5.0 3.2 0.0 !    283:20  Unique
assign (resid  34 and name   HN) (resid  33 and name   HA) 3.0 1.2 0.0 !    284:20  Unique
assign (resid  33 and name   HN) (resid  33 and name   HA) 3.0 1.2 0.0 !    285:20  Unique
assign (resid  38 and name   HN) (resid  38 and name   HA) 3.0 1.2 0.0 !    286:20  Unique
assign (resid  39 and name   HN) (resid  38 and name   HA) 3.0 1.2 0.0 !    287:20  Unique
assign (resid  55 and name   HN) (resid  54 and name   HA) 3.0 1.2 0.0 !    288:20  Unique
assign (resid  24 and name   HN) (resid  23 and name   HA) 3.0 1.2 0.0 !    289:20  Unique
assign (resid  23 and name   HN) (resid  23 and name   HA) 7.0 5.2 0.0 !    291:20  Unique
! 10-8-17 assign (resid  22 and name HE2#) (resid  23 and name   HA) 5.0 3.2 0.0 !    292:20  Unique
assign (resid   5 and name  HD#) (resid   4 and name   HA) 3.0 1.2 0.0 !    293:20  Unique
assign (resid  24 and name HD1#) (resid  23 and name   HA) 5.0 3.2 0.0 !    294:20  Unique
assign (resid  55 and name  HD1) (resid  54 and name   HA) 3.0 1.2 0.0 !    302:20  Unique
assign (resid  53 and name  HB#) (resid  54 and name   HA) 5.0 3.2 0.0 !    303:20  Unique
assign (resid  54 and name   HN) (resid  54 and name   HA) 5.0 3.2 0.0 !    304:20  Unique
assign (resid  16 and name   HN) (resid  23 and name   HA) 7.0 5.2 0.0 !    306:20  Unique
assign (resid  59 and name  HB#) (resid  59 and name   HA) 3.0 1.2 0.0 !    309:20  Unique
assign (resid  18 and name  HB#) (resid  18 and name   HA) 3.0 1.2 0.0 !    310:20  Unique
assign (resid  59 and name   HN) (resid  59 and name   HA) 3.0 1.2 0.0 !    312:20  Unique
assign (resid  18 and name  HG#) (resid  18 and name   HA) 3.5 1.7 0.0 !    314:20  Unique
assign (resid  43 and name   HN) (resid  42 and name   HA) 5.0 3.2 0.0 !    317:20  Unique
assign (resid  42 and name HD##) (resid  42 and name   HA) 5.0 3.2 0.0 !    318:20  Unique
assign (resid  42 and name HD##) (resid  42 and name   HA) 7.0 5.2 0.0 !    319:20  Unique
assign (resid  35 and name  HB#) (resid  35 and name   HA) 3.0 1.2 0.0 !    321:20  Unique
assign (resid  35 and name  HB#) (resid  35 and name   HA) 3.0 1.2 0.0 !    322:20  Unique
assign (resid  36 and name   HN) (resid  35 and name   HA) 3.0 1.2 0.5 !    326:20  Unique  10-8-16
assign (resid  12 and name HG##) (resid  64 and name  HD#) 3.5 1.7 0.0 !    327:20  Unique
assign (resid  10 and name HG2#) (resid  64 and name  HD#) 5.0 3.2 0.0 !    328:20  Unique
assign (resid  64 and name  HB#) (resid  64 and name  HD#) 5.0 3.2 0.0 !    330:20  Unique
assign (resid  63 and name  HB#) (resid  64 and name  HD#) 3.5 1.7 0.0 !    331:20  Unique
assign (resid  63 and name  HB#) (resid  64 and name  HD#) 3.5 1.7 0.0 !    332:20  Unique
assign (resid  64 and name  HB#) (resid  64 and name  HD#) 3.5 1.7 0.0 !    333:20  Unique
assign (resid   4 and name   HA) (resid   5 and name  HD#) 3.0 1.2 0.0 !    340:20  Unique
assign (resid   4 and name   HA) (resid   5 and name  HD#) 3.0 1.2 0.0 !    341:20  Unique
assign (resid  63 and name  HZ3) (resid  64 and name  HD#) 7.0 5.2 0.0 !    346:20  Unique
assign (resid  40 and name HD##) (resid  40 and name  HB#) 3.5 1.7 0.0 !    354:20  Unique
assign (resid  40 and name HD##) (resid  40 and name  HB#) 3.0 1.2 0.0 !    355:20  Unique
assign (resid  40 and name   HA) (resid  40 and name  HB#) 5.0 3.2 0.0 !    358:20  Unique
assign (resid  40 and name   HA) (resid  40 and name  HB#) 5.0 3.2 0.0 !    359:20  Unique
assign (resid  41 and name  HD#) (resid  40 and name  HB#) 5.0 3.2 0.0 !    360:20  Unique
assign (resid  41 and name  HD#) (resid  40 and name  HB#) 7.0 5.2 0.0 !    361:20  Unique
assign (resid  40 and name   HN) (resid  40 and name  HB#) 5.0 3.2 0.0 !    362:20  Unique
assign (resid  40 and name   HN) (resid  40 and name  HB#) 3.5 1.7 0.0 !    363:20  Unique
assign (resid  41 and name   HN) (resid  40 and name  HB#) 7.0 5.2 0.0 !    364:20  Unique
assign (resid  41 and name   HN) (resid  40 and name  HB#) 7.0 5.2 0.0 !    365:20  Unique
assign (resid  34 and name HG2#) (resid  37 and name  HA#) 3.5 1.7 0.0 !    367:20  Unique
assign (resid  34 and name HG2#) (resid  37 and name  HA#) 3.0 1.2 0.5 !    368:20  Unique 10-8-16
assign (resid  67 and name  HG#) (resid  68 and name  HA#) 5.0 3.2 0.0 !    370:20  Unique
assign (resid  69 and name HD##) (resid  68 and name  HA#) 7.0 5.2 0.0 !    371:20  Unique
assign (resid  18 and name  HB#) (resid  19 and name  HA#) 7.0 5.2 0.0 !    374:20  Unique
assign (resid  18 and name  HG#) (resid  19 and name  HA#) 7.0 5.2 0.0 !    375:20  Unique
!10-8-16 assign (resid  38 and name  HB#) (resid  37 and name  HA#) 7.0 5.2 0.0 !    376:20  Unique
assign (resid  37 and name   HN) (resid  37 and name  HA#) 3.0 1.2 0.0 !    392:20  Unique
assign (resid  38 and name   HN) (resid  37 and name  HA#) 3.5 1.7 0.0 !    393:20  Unique
assign (resid  38 and name   HN) (resid  37 and name  HA#) 3.5 1.7 0.0 !    394:20  Unique
assign (resid  37 and name   HN) (resid  37 and name  HA#) 3.0 1.2 0.0 !    395:20  Unique
assign (resid  69 and name   HN) (resid  68 and name  HA#) 3.0 1.2 0.0 !    396:20  Unique
assign (resid  68 and name   HN) (resid  68 and name  HA#) 3.5 1.7 0.0 !    397:20  Unique
assign (resid   9 and name   HN) (resid   9 and name  HA#) 5.0 3.2 0.0 !    398:20  Unique
assign (resid  10 and name   HN) (resid   9 and name  HA#) 5.0 3.2 0.0 !    399:20  Unique
assign (resid   9 and name   HN) (resid   9 and name  HA#) 5.0 3.2 0.0 !    401:20  Unique
assign (resid  10 and name   HN) (resid   9 and name  HA#) 7.0 5.2 0.0 !    402:20  Unique
assign (resid  11 and name   HA) (resid   9 and name  HA#) 7.0 5.2 0.0 !    403:20  Unique
assign (resid   8 and name HG2#) (resid   9 and name  HA#) 5.0 3.2 0.0 !    404:20  Unique
assign (resid  22 and name   HA) (resid  17 and name  HA#) 5.0 3.2 0.0 !    407:20  Unique
assign (resid  22 and name   HA) (resid  17 and name  HA#) 5.0 3.2 0.0 !    414:20  Unique
assign (resid  18 and name   HN) (resid  17 and name  HA#) 5.0 3.2 0.0 !    415:20  Unique
assign (resid  23 and name   HN) (resid  17 and name  HA#) 7.0 5.2 0.0 !    417:20  Unique
assign (resid  40 and name HD##) (resid  35 and name  HB#) 3.5 1.7 0.0 !    421:20  Unique
assign (resid  40 and name HD##) (resid  35 and name  HB#) 3.0 1.2 0.0 !    422:20  Unique
assign (resid  51 and name  HB#) (resid  51 and name  HD#) 3.0 1.2 0.0 !    431:20  Unique
assign (resid  51 and name  HG#) (resid  51 and name  HD#) 3.5 1.7 0.0 !    434:20  Unique
assign (resid  51 and name  HG#) (resid  51 and name  HD#) 3.5 1.7 0.0 !    435:20  Unique
assign (resid  51 and name  HB#) (resid  51 and name  HD#) 3.5 1.7 0.0 !    436:20  Unique
assign (resid  60 and name   HA) (resid  60 and name  HD#) 5.0 3.2 0.0 !    438:20  Unique
assign (resid  60 and name  HG#) (resid  60 and name  HD#) 3.0 1.2 0.0 !    440:20  Unique
assign (resid  56 and name   HB) (resid  60 and name  HD#) 5.0 3.2 0.0 !    441:20  Unique
assign (resid  60 and name  HB#) (resid  60 and name  HD#) 3.0 1.2 0.0 !    442:20  Unique
assign (resid  18 and name  HG#) (resid  18 and name  HD#) 3.0 1.2 0.0 !    443:20  Unique
assign (resid  18 and name  HB#) (resid  18 and name  HD#) 3.5 1.7 0.0 !    444:20  Unique
assign (resid  25 and name   HA) (resid  25 and name  HB#) 5.0 3.2 0.0 !    447:20  Unique
assign (resid  25 and name  HD#) (resid  25 and name  HB#) 3.5 1.7 0.0 !    449:20  Unique
assign (resid  16 and name  HD#) (resid  16 and name  HB#) 5.0 3.2 0.0 !    451:20  Unique
assign (resid  45 and name  HD#) (resid  25 and name  HB#) 7.0 5.2 0.0 !    452:20  Unique
assign (resid  69 and name HD##) (resid  69 and name  HB#) 3.0 1.2 0.0 !    453:20  Unique
assign (resid   7 and name   HA) (resid   7 and name  HB#) 3.5 1.7 0.0 !    457:20  Unique
assign (resid  69 and name   HA) (resid  69 and name  HB#) 3.5 1.7 0.0 !    460:20  Unique
assign (resid  65 and name   HA) (resid  65 and name  HB#) 3.0 1.2 0.0 !    462:20  Unique
assign (resid  69 and name   HN) (resid  69 and name  HB#) 3.5 1.7 0.0 !    466:20  Unique
assign (resid  65 and name   HN) (resid  65 and name  HB#) 3.5 1.7 0.0 !    468:20  Unique
assign (resid  69 and name   HN) (resid  69 and name  HB#) 5.0 3.2 0.0 !    469:20  Unique
assign (resid  70 and name   HN) (resid  69 and name  HB#) 5.0 3.2 0.0 !    470:20  Unique
assign (resid  41 and name  HD#) (resid  41 and name  HB#) 5.0 3.2 0.0 !    474:20  Unique
assign (resid   2 and name   HN) (resid   2 and name  HB#) 5.0 3.2 0.0 !    477:20  Unique
assign (resid  41 and name   HA) (resid  41 and name  HB#) 5.0 3.2 0.0 !    478:20  Unique
assign (resid  57 and name   HA) (resid  41 and name  HB#) 5.0 3.2 0.0 !    479:20  Unique
assign (resid  42 and name HD##) (resid  30 and name  HE#) 3.5 1.7 0.0 !    486:20  Unique
assign (resid  36 and name   HA) (resid  36 and name  HB#) 3.0 1.2 0.0 !    492:20  Unique
assign (resid  36 and name   HA) (resid  36 and name  HB#) 3.0 1.2 0.0 !    494:20  Unique
assign (resid  59 and name   HA) (resid  59 and name  HB#) 3.0 1.2 0.0 !    495:20  Unique
assign (resid  59 and name   HA) (resid  59 and name  HB#) 3.0 1.2 0.0 !    496:20  Unique
assign (resid  35 and name   HA) (resid  36 and name  HB#) 5.0 3.2 2.0 !    497:20  Unique 10-8-16
assign (resid  37 and name   HN) (resid  36 and name  HB#) 3.5 1.7 0.5 !    498:20  Unique
assign (resid  36 and name   HN) (resid  36 and name  HB#) 5.0 3.2 0.0 !    499:20  Unique
assign (resid  59 and name   HN) (resid  59 and name  HB#) 3.5 1.7 0.0 !    500:20  Unique
assign (resid  60 and name   HN) (resid  59 and name  HB#) 7.0 5.2 0.0 !    501:20  Unique
assign (resid  59 and name   HN) (resid  59 and name  HB#) 3.5 1.7 0.0 !    502:20  Unique
assign (resid  37 and name   HN) (resid  36 and name  HB#) 5.0 3.2 0.0 !    503:20  Unique
assign (resid  36 and name   HN) (resid  36 and name  HB#) 7.0 5.2 0.0 !    504:20  Unique
assign (resid  38 and name   HN) (resid  36 and name  HB#) 7.0 5.2 0.0 !    505:20  Unique
assign (resid  60 and name   HN) (resid  59 and name  HB#) 5.0 3.2 0.0 !    506:20  Unique
assign (resid  58 and name   HN) (resid  59 and name  HB#) 7.0 5.2 0.0 !    507:20  Unique
assign (resid  60 and name   HA) (resid  59 and name  HB#) 7.0 5.2 0.0 !    509:20  Unique
assign (resid  42 and name HD##) (resid  53 and name  HB#) 5.0 3.2 0.0 !    512:20  Unique
assign (resid  42 and name HD##) (resid  53 and name  HB#) 5.0 3.2 0.0 !    513:20  Unique
assign (resid  52 and name  HD#) (resid  52 and name  HB#) 5.0 3.2 0.0 !    517:20  Unique
assign (resid  46 and name   HA) (resid  46 and name  HB#) 5.0 3.2 0.0 !    521:20  Unique
assign (resid  46 and name   HA) (resid  46 and name  HB#) 5.0 3.2 0.0 !    522:20  Unique
assign (resid  46 and name  HD#) (resid  46 and name  HB#) 3.5 1.7 0.0 !    524:20  Unique
assign (resid  46 and name  HD#) (resid  46 and name  HB#) 3.5 1.7 0.0 !    525:20  Unique
assign (resid  46 and name  HE#) (resid  46 and name  HB#) 7.0 5.2 0.0 !    527:20  Unique
assign (resid  46 and name   HN) (resid  46 and name  HB#) 5.0 3.2 0.0 !    528:20  Unique
assign (resid  46 and name   HN) (resid  46 and name  HB#) 5.0 3.2 0.0 !    529:20  Unique
assign (resid  24 and name HG1#) (resid  24 and name   HB) 5.0 3.2 0.0 !    532:20  Unique
assign (resid  34 and name HG1#) (resid  34 and name   HB) 3.0 1.2 0.0 !    533:20  Unique
assign (resid  34 and name HG1#) (resid  34 and name   HB) 3.0 1.2 0.0 !    534:20  Unique
assign (resid  24 and name HG1#) (resid  24 and name   HB) 3.0 1.2 0.0 !    535:20  Unique
assign (resid  24 and name   HA) (resid  24 and name   HB) 3.5 1.7 0.0 !    539:20  Unique
assign (resid  34 and name   HA) (resid  34 and name   HB) 3.0 1.2 0.0 !    540:20  Unique
assign (resid  24 and name   HN) (resid  24 and name   HB) 3.0 1.2 0.0 !    541:20  Unique
assign (resid  34 and name   HN) (resid  34 and name   HB) 3.0 1.2 0.0 !    542:20  Unique
assign (resid  25 and name   HN) (resid  24 and name   HB) 5.0 3.2 0.0 !    544:20  Unique
assign (resid  61 and name HG2#) (resid  61 and name   HB) 3.0 1.2 0.0 !    548:20  Unique
assign (resid  61 and name HD1#) (resid  61 and name   HB) 5.0 3.2 0.0 !    549:20  Unique
assign (resid  61 and name HG1#) (resid  61 and name   HB) 5.0 3.2 0.0 !    550:20  Unique
assign (resid  61 and name   HN) (resid  61 and name   HB) 3.5 1.7 0.0 !    554:20  Unique
assign (resid  63 and name  HE1) (resid  61 and name   HB) 7.0 5.2 0.0 !    555:20  Unique
assign (resid  29 and name HG1#) (resid  29 and name   HB) 7.0 5.2 0.0 !    559:20  Unique
assign (resid  29 and name   HN) (resid  29 and name   HB) 5.0 3.2 0.0 !    562:20  Unique
assign (resid  52 and name   HA) (resid  52 and name  HB#) 7.0 5.2 0.0 !    567:20  Unique
assign (resid  26 and name   HN) (resid  26 and name  HG#) 3.0 1.2 0.0 !    569:20  Unique
assign (resid  26 and name   HN) (resid  26 and name  HG#) 3.5 1.7 0.0 !    570:20  Unique
assign (resid  26 and name   HA) (resid  26 and name  HG#) 3.0 1.2 0.0 !    573:20  Unique
assign (resid  26 and name   HA) (resid  26 and name  HG#) 3.5 1.7 0.0 !    574:20  Unique
assign (resid  26 and name  HB#) (resid  26 and name  HG#) 3.0 1.2 0.0 !    580:20  Unique
assign (resid  26 and name  HB#) (resid  26 and name  HG#) 3.0 1.2 0.0 !    581:20  Unique
assign (resid  13 and name  HD#) (resid  26 and name  HG#) 3.5 1.7 0.0 !    584:20  Unique
assign (resid  13 and name  HG#) (resid  26 and name  HG#) 7.0 5.2 0.0 !    585:20  Unique
assign (resid  23 and name  HE#) (resid  23 and name  HB#) 3.5 1.7 0.0 !    590:20  Unique
assign (resid  23 and name  HE#) (resid  23 and name  HB#) 3.5 1.7 0.0 !    591:20  Unique
assign (resid  23 and name   HA) (resid  23 and name  HB#) 3.0 1.2 0.0 !    592:20  Unique
assign (resid  23 and name   HA) (resid  23 and name  HB#) 3.0 1.2 0.0 !    593:20  Unique
assign (resid  24 and name   HN) (resid  23 and name  HB#) 5.0 3.2 0.0 !    595:20  Unique
assign (resid  24 and name   HN) (resid  23 and name  HB#) 5.0 3.2 0.0 !    596:20  Unique
assign (resid  23 and name   HN) (resid  23 and name  HB#) 5.0 3.2 0.0 !    597:20  Unique
assign (resid  23 and name   HN) (resid  23 and name  HB#) 5.0 3.2 0.0 !    598:20  Unique
assign (resid  16 and name   HN) (resid  23 and name  HB#) 7.0 5.2 0.0 !    599:20  Unique
assign (resid  25 and name  HE#) (resid  23 and name  HB#) 7.0 5.2 0.0 !    600:20  Unique
assign (resid  38 and name   HN) (resid  38 and name  HG#) 3.5 1.7 0.0 !    602:20  Unique
assign (resid  14 and name   HN) (resid  14 and name   HB) 7.0 5.2 0.0 !    605:20  Unique
assign (resid  45 and name  HE#) (resid  14 and name   HB) 3.5 1.7 0.0 !    606:20  Unique
assign (resid  14 and name HG##) (resid  14 and name   HB) 3.0 1.2 0.0 !    607:20  Unique
assign (resid  14 and name HG##) (resid  14 and name   HB) 3.5 1.7 0.0 !    608:20  Unique
assign (resid  61 and name HG2#) (resid  12 and name   HB) 3.5 1.7 0.0 !    609:20  Unique
assign (resid  12 and name HG##) (resid  12 and name   HB) 3.5 1.7 0.0 !    610:20  Unique
assign (resid  12 and name HG##) (resid  12 and name   HB) 3.5 1.7 0.0 !    611:20  Unique
assign (resid  13 and name   HN) (resid  12 and name   HB) 3.5 1.7 0.0 !    616:20  Unique
assign (resid  34 and name   HN) (resid  33 and name  HG#) 5.0 3.2 0.0 !    618:20  Unique
assign (resid  34 and name   HN) (resid  33 and name  HG#) 5.0 3.2 0.0 !    619:20  Unique
assign (resid  55 and name  HH2) (resid  33 and name  HG#) 5.0 3.2 0.0 !    621:20  Unique
assign (resid  55 and name  HH2) (resid  33 and name  HG#) 5.0 3.2 0.0 !    622:20  Unique
assign (resid  55 and name  HZ3) (resid  33 and name  HG#) 7.0 5.2 0.0 !    623:20  Unique
assign (resid  33 and name   HA) (resid  33 and name  HG#) 3.5 1.7 0.0 !    624:20  Unique
assign (resid  33 and name   HA) (resid  33 and name  HG#) 3.5 1.7 0.0 !    625:20  Unique
assign (resid  34 and name HD1#) (resid  33 and name  HG#) 5.0 3.2 0.0 !    628:20  Unique
assign (resid  34 and name HD1#) (resid  33 and name  HG#) 5.0 3.2 0.0 !    629:20  Unique
assign (resid  55 and name   HN) (resid  54 and name  HG#) 5.0 3.2 0.0 !    630:20  Unique
assign (resid  45 and name  HE#) (resid  54 and name  HG#) 5.0 3.2 0.0 !    631:20  Unique
assign (resid  54 and name   HA) (resid  54 and name  HG#) 5.0 3.2 0.0 !    632:20  Unique
assign (resid  43 and name HG##) (resid  54 and name  HG#) 5.0 3.2 0.0 !    635:20  Unique
assign (resid  45 and name  HE#) (resid  54 and name  HG#) 7.0 5.2 0.0 !    638:20  Unique
assign (resid  55 and name   HN) (resid  54 and name  HG#) 5.0 3.2 0.0 !    639:20  Unique
assign (resid  54 and name   HA) (resid  54 and name  HG#) 5.0 3.2 0.0 !    640:20  Unique
assign (resid  22 and name   HA) (resid  22 and name  HG#) 3.5 1.7 0.0 !    643:20  Unique
assign (resid  22 and name HE2#) (resid  22 and name  HG#) 3.5 1.7 0.0 !    644:20  Unique
assign (resid  22 and name HE2#) (resid  22 and name  HG#) 5.0 3.2 0.0 !    645:20  Unique
assign (resid  23 and name   HN) (resid  22 and name  HG#) 3.5 1.7 1.5 !    646:20  Unique
assign (resid  23 and name   HN) (resid  22 and name  HG#) 5.0 3.2 0.0 !    647:20  Unique
assign (resid  22 and name HE2#) (resid  22 and name  HG#) 5.0 3.2 0.0 !    648:20  Unique
assign (resid  22 and name HE2#) (resid  22 and name  HG#) 7.0 5.2 0.0 !    649:20  Unique
assign (resid  22 and name   HA) (resid  22 and name  HG#) 3.0 1.2 0.0 !    650:20  Unique
assign (resid  22 and name  HB#) (resid  22 and name  HG#) 3.0 1.2 0.0 !    652:20  Unique
assign (resid  22 and name  HB#) (resid  22 and name  HG#) 3.0 1.2 0.0 !    654:20  Unique
assign (resid  34 and name   HN) (resid  33 and name  HB#) 3.0 1.2 0.0 !    655:20  Unique
assign (resid  41 and name   HN) (resid  33 and name  HB#) 7.0 5.2 0.0 !    657:20  Unique
assign (resid  55 and name  HH2) (resid  33 and name  HB#) 5.0 3.2 0.0 !    658:20  Unique
assign (resid  55 and name  HZ3) (resid  33 and name  HB#) 5.0 3.2 0.0 !    659:20  Unique
assign (resid  33 and name   HA) (resid  33 and name  HB#) 3.0 1.2 0.0 !    661:20  Unique
assign (resid  30 and name   HA) (resid  30 and name  HB#) 3.5 1.7 0.0 !    662:20  Unique
assign (resid  42 and name HD##) (resid  30 and name  HB#) 5.0 3.2 0.0 !    668:20  Unique
assign (resid  30 and name   HN) (resid  30 and name  HB#) 7.0 5.2 0.0 !    670:20  Unique
assign (resid  27 and name  HB#) (resid  43 and name   HB) 3.5 1.7 0.0 !    672:20  Unique
assign (resid  30 and name   HA) (resid  30 and name  HB#) 5.0 3.2 0.0 !    678:20  Unique
assign (resid  31 and name   HN) (resid  30 and name  HB#) 7.0 5.2 0.0 !    680:20  Unique
assign (resid  30 and name   HN) (resid  30 and name  HB#) 5.0 3.2 0.0 !    683:20  Unique
assign (resid  18 and name  HD#) (resid  18 and name  HB#) 3.5 1.7 0.0 !    684:20  Unique
assign (resid  18 and name  HD#) (resid  18 and name  HB#) 3.5 1.7 0.0 !    685:20  Unique
assign (resid  18 and name   HA) (resid  18 and name  HB#) 3.0 1.2 0.0 !    686:20  Unique
assign (resid  18 and name   HA) (resid  18 and name  HB#) 3.0 1.2 0.0 !    689:20  Unique
assign (resid  67 and name   HA) (resid  67 and name  HB#) 3.0 1.2 0.0 !    690:20  Unique
assign (resid  67 and name   HA) (resid  67 and name  HB#) 3.0 1.2 0.0 !    692:20  Unique
assign (resid  18 and name  HG#) (resid  18 and name  HB#) 3.0 1.2 0.0 !    694:20  Unique
assign (resid  18 and name  HG#) (resid  18 and name  HB#) 3.0 1.2 0.0 !    695:20  Unique
assign (resid  67 and name   HN) (resid  67 and name  HB#) 5.0 3.2 0.0 !    696:20  Unique
assign (resid  58 and name   HN) (resid  57 and name  HB#) 7.0 5.2 0.0 !    697:20  Unique
assign (resid  57 and name   HN) (resid  57 and name  HB#) 5.0 3.2 0.0 !    699:20  Unique
assign (resid  58 and name   HN) (resid  57 and name  HB#) 5.0 3.2 0.0 !    700:20  Unique
assign (resid  40 and name HD##) (resid  57 and name  HB#) 5.0 3.2 0.0 !    701:20  Unique
assign (resid  40 and name HD##) (resid  57 and name  HB#) 5.0 3.2 0.0 !    702:20  Unique
assign (resid  57 and name  HG#) (resid  57 and name  HB#) 5.0 3.2 0.0 !    703:20  Unique
assign (resid  57 and name  HD#) (resid  57 and name  HB#) 3.0 1.2 0.0 !    704:20  Unique
assign (resid  54 and name   HA) (resid  54 and name  HB#) 3.5 1.7 0.0 !    709:20  Unique
assign (resid  57 and name   HA) (resid  57 and name  HB#) 3.5 1.7 0.0 !    710:20  Unique
assign (resid  55 and name   HN) (resid  54 and name  HB#) 7.0 5.2 0.0 !    712:20  Unique
assign (resid   3 and name   HN) (resid   3 and name  HB#) 3.5 1.7 0.0 !    713:20  Unique
assign (resid   3 and name   HA) (resid   3 and name  HB#) 5.0 3.2 0.0 !    714:20  Unique
assign (resid   3 and name  HG#) (resid   3 and name  HB#) 5.0 3.2 0.0 !    716:20  Unique
assign (resid  39 and name HG##) (resid  39 and name   HB) 3.0 1.2 0.0 !    717:20  Unique
assign (resid  39 and name HG##) (resid  39 and name   HB) 3.0 1.2 0.0 !    718:20  Unique
assign (resid  39 and name   HN) (resid  39 and name   HB) 3.0 1.2 0.0 !    720:20  Unique
assign (resid   3 and name   HN) (resid   3 and name  HB#) 5.0 3.2 0.0 !    721:20  Unique
assign (resid   3 and name   HA) (resid   3 and name  HB#) 3.5 1.7 0.0 !    722:20  Unique
assign (resid  20 and name  HG#) (resid  20 and name  HB#) 3.0 1.2 0.0 !    723:20  Unique
assign (resid  20 and name  HE#) (resid  20 and name  HB#) 5.0 3.2 0.0 !    724:20  Unique
assign (resid  41 and name  HE#) (resid  39 and name   HB) 5.0 3.2 0.0 !    727:20  Unique
assign (resid  12 and name   HN) (resid  11 and name  HB#) 5.0 3.2 0.0 !    729:20  Unique
assign (resid   5 and name  HG#) (resid   5 and name  HB#) 3.0 1.2 0.0 !    732:20  Unique
assign (resid   5 and name  HD#) (resid   5 and name  HB#) 3.5 1.7 0.0 !    733:20  Unique
assign (resid   5 and name  HD#) (resid   5 and name  HB#) 3.5 1.7 0.0 !    734:20  Unique
assign (resid   5 and name   HA) (resid   5 and name  HB#) 3.0 1.2 0.0 !    735:20  Unique
assign (resid   5 and name   HA) (resid   5 and name  HB#) 3.0 1.2 0.0 !    736:20  Unique
assign (resid  64 and name  HG#) (resid  64 and name  HB#) 3.0 1.2 0.0 !    738:20  Unique
assign (resid  64 and name  HD#) (resid  64 and name  HB#) 3.5 1.7 0.0 !    740:20  Unique
assign (resid  64 and name  HD#) (resid  64 and name  HB#) 3.5 1.7 0.0 !    741:20  Unique
assign (resid  64 and name   HA) (resid  64 and name  HB#) 3.0 1.2 0.0 !    742:20  Unique
assign (resid  64 and name   HA) (resid  64 and name  HB#) 3.0 1.2 0.0 !    743:20  Unique
assign (resid  65 and name   HN) (resid  64 and name  HB#) 5.0 3.2 0.0 !    744:20  Unique
assign (resid  38 and name   HN) (resid  38 and name  HB#) 3.0 1.2 0.0 !    745:20  Unique
assign (resid  38 and name   HN) (resid  38 and name  HB#) 3.5 1.7 0.0 !    746:20  Unique
assign (resid  12 and name   HN) (resid  11 and name  HB#) 5.0 3.2 0.0 !    751:20  Unique
assign (resid   3 and name   HA) (resid   3 and name  HG#) 5.0 3.2 0.0 !    757:20  Unique
assign (resid   3 and name   HN) (resid   3 and name  HG#) 7.0 5.2 0.0 !    758:20  Unique
assign (resid   3 and name   HN) (resid   3 and name  HG#) 7.0 5.2 0.0 !    759:20  Unique
assign (resid  23 and name   HN) (resid  22 and name  HB#) 7.0 5.2 0.0 !    760:20  Unique
assign (resid  22 and name   HA) (resid  22 and name  HB#) 3.0 1.2 0.0 !    764:20  Unique
assign (resid  17 and name  HA#) (resid  22 and name  HB#) 7.0 5.2 0.0 !    765:20  Unique
assign (resid  40 and name HD##) (resid  57 and name  HD#) 3.5 1.7 0.0 !    767:20  Unique
assign (resid  13 and name  HG#) (resid  13 and name  HD#) 3.0 1.2 0.0 !    769:20  Unique
assign (resid  13 and name  HE#) (resid  13 and name  HD#) 3.0 1.2 0.0 !    771:20  Unique
assign (resid  57 and name  HE#) (resid  57 and name  HD#) 3.0 1.2 0.0 !    773:20  Unique
assign (resid  13 and name   HA) (resid  13 and name  HD#) 7.0 5.2 0.0 !    775:20  Unique
assign (resid  58 and name   HN) (resid  57 and name  HD#) 7.0 5.2 0.0 !    776:20  Unique
assign (resid  57 and name   HN) (resid  57 and name  HD#) 3.5 1.7 1.0 !    777:20  Unique 10-8-16
assign (resid  57 and name  HG#) (resid  57 and name  HD#) 3.0 1.2 0.0 !    778:20  Unique
assign (resid  65 and name HD##) (resid  63 and name  HB#) 5.0 3.2 0.0 !    779:20  Unique
assign (resid  64 and name  HD#) (resid  63 and name  HB#) 3.5 1.7 0.0 !    782:20  Unique
assign (resid  64 and name  HD#) (resid  63 and name  HB#) 3.5 1.7 0.0 !    783:20  Unique
assign (resid  63 and name   HA) (resid  63 and name  HB#) 3.5 1.7 0.0 !    784:20  Unique
assign (resid   6 and name   HA) (resid   6 and name  HB#) 3.0 1.2 0.0 !    785:20  Unique
assign (resid  63 and name   HA) (resid  63 and name  HB#) 3.5 1.7 0.0 !    786:20  Unique
assign (resid  63 and name  HD1) (resid  63 and name  HB#) 5.0 3.2 0.0 !    787:20  Unique
assign (resid  63 and name  HD1) (resid  63 and name  HB#) 5.0 3.2 0.0 !    788:20  Unique
assign (resid  63 and name   HN) (resid  63 and name  HB#) 3.5 1.7 0.0 !    789:20  Unique
assign (resid  63 and name   HN) (resid  63 and name  HB#) 5.0 3.2 0.0 !    790:20  Unique
assign (resid   6 and name   HA) (resid   6 and name  HB#) 3.0 1.2 0.0 !    791:20  Unique
assign (resid   6 and name   HN) (resid   6 and name  HB#) 7.0 5.2 0.0 !    794:20  Unique
assign (resid   6 and name   HN) (resid   6 and name  HB#) 7.0 5.2 0.0 !    795:20  Unique
assign (resid  61 and name HG2#) (resid  61 and name HG1#) 5.0 3.2 0.0 !    796:20  Unique
assign (resid  61 and name HG2#) (resid  61 and name HG1#) 3.5 1.7 0.0 !    797:20  Unique
assign (resid  61 and name HD1#) (resid  61 and name HG1#) 3.5 1.7 0.0 !    798:20  Unique
assign (resid  61 and name HD1#) (resid  61 and name HG1#) 5.0 3.2 0.0 !    799:20  Unique
assign (resid  61 and name   HB) (resid  61 and name HG1#) 3.5 1.7 0.0 !    800:20  Unique
assign (resid  24 and name   HN) (resid  24 and name HG1#) 5.0 3.2 0.0 !    809:20  Unique
assign (resid  24 and name   HN) (resid  24 and name HG1#) 5.0 3.2 0.0 !    810:20  Unique
assign (resid  29 and name   HN) (resid  29 and name HG1#) 5.0 3.2 0.0 !    811:20  Unique
assign (resid  61 and name   HN) (resid  61 and name HG1#) 5.0 3.2 0.0 !    813:20  Unique
assign (resid  61 and name   HN) (resid  61 and name HG1#) 5.0 3.2 0.0 !    814:20  Unique
assign (resid  41 and name  HD#) (resid  61 and name HG1#) 7.0 5.2 0.0 !    815:20  Unique
assign (resid  34 and name   HA) (resid  34 and name HG1#) 5.0 3.2 0.0 !    816:20  Unique
assign (resid  39 and name   HA) (resid  34 and name HG1#) 3.5 1.7 0.0 !    819:20  Unique
assign (resid  30 and name  HE#) (resid  30 and name  HD#) 3.5 1.7 0.0 !    821:20  Unique
assign (resid  30 and name  HE#) (resid  30 and name  HD#) 3.0 1.2 0.0 !    822:20  Unique
assign (resid  34 and name   HB) (resid  34 and name HG1#) 3.0 1.2 0.0 !    823:20  Unique
assign (resid  29 and name   HB) (resid  29 and name HG1#) 5.0 3.2 0.0 !    827:20  Unique
assign (resid  34 and name HD1#) (resid  34 and name HG1#) 3.0 1.2 0.0 !    828:20  Unique
assign (resid  12 and name HG##) (resid  29 and name HG1#) 5.0 3.2 0.0 !    830:20  Unique
assign (resid  29 and name HD1#) (resid  29 and name HG1#) 5.0 3.2 0.0 !    834:20  Unique
assign (resid  12 and name HG##) (resid  29 and name HG1#) 5.0 3.2 0.0 !    835:20  Unique
assign (resid  61 and name   HA) (resid  61 and name HG1#) 5.0 3.2 0.0 !    840:20  Unique
assign (resid  55 and name   HN) (resid  55 and name  HB#) 5.0 3.2 0.0 !    843:20  Unique
assign (resid  55 and name   HN) (resid  55 and name  HB#) 7.0 5.2 0.0 !    844:20  Unique
assign (resid  55 and name  HD1) (resid  55 and name  HB#) 5.0 3.2 0.0 !    845:20  Unique
assign (resid  55 and name  HD1) (resid  55 and name  HB#) 5.0 3.2 0.0 !    846:20  Unique
assign (resid  64 and name  HD#) (resid  64 and name  HG#) 3.0 1.2 0.0 !    850:20  Unique
assign (resid  64 and name  HD#) (resid  64 and name  HG#) 3.0 1.2 0.0 !    851:20  Unique
assign (resid   5 and name  HD#) (resid   5 and name  HG#) 3.0 1.2 0.0 !    852:20  Unique
assign (resid   5 and name   HA) (resid   5 and name  HG#) 3.0 1.2 0.0 !    853:20  Unique
assign (resid  64 and name  HB#) (resid  64 and name  HG#) 3.0 1.2 0.0 !    855:20  Unique
assign (resid  64 and name  HB#) (resid  64 and name  HG#) 3.0 1.2 0.0 !    856:20  Unique
assign (resid  65 and name   HN) (resid  64 and name  HG#) 5.0 3.2 0.0 !    857:20  Unique
assign (resid  65 and name   HN) (resid  64 and name  HG#) 5.0 3.2 0.0 !    858:20  Unique
assign (resid  60 and name  HD#) (resid  60 and name  HG#) 3.5 1.7 0.0 !    860:20  Unique
assign (resid  60 and name   HN) (resid  60 and name  HG#) 7.0 5.2 0.0 !    861:20  Unique
assign (resid  18 and name   HA) (resid  18 and name  HG#) 3.5 1.7 0.0 !    862:20  Unique
assign (resid  18 and name  HD#) (resid  18 and name  HG#) 3.0 1.2 0.0 !    863:20  Unique
assign (resid  40 and name HD##) (resid  57 and name  HG#) 3.5 1.7 0.0 !    865:20  Unique
assign (resid  62 and name   HN) (resid  62 and name HG1#) 5.0 3.2 0.0 !    868:20  Unique
assign (resid  63 and name   HN) (resid  62 and name HG1#) 7.0 5.2 0.0 !    869:20  Unique
assign (resid  62 and name   HA) (resid  62 and name HG1#) 3.5 1.7 0.0 !    870:20  Unique
assign (resid  13 and name  HE#) (resid  62 and name HG1#) 7.0 5.2 0.0 !    871:20  Unique
assign (resid  51 and name  HB#) (resid  51 and name  HG#) 3.0 1.2 0.0 !    874:20  Unique
assign (resid  51 and name   HA) (resid  51 and name  HG#) 5.0 3.2 0.0 !    876:20  Unique
assign (resid  13 and name  HE#) (resid  13 and name  HG#) 3.0 1.2 0.0 !    877:20  Unique
assign (resid  26 and name   HA) (resid  13 and name  HG#) 3.5 1.7 0.0 !    880:20  Unique
assign (resid  57 and name  HE#) (resid  57 and name  HG#) 3.5 1.7 0.0 !    882:20  Unique
assign (resid  39 and name   HA) (resid  57 and name  HG#) 5.0 3.2 0.0 !    883:20  Unique
assign (resid  57 and name   HN) (resid  57 and name  HG#) 5.0 3.2 0.0 !    884:20  Unique
assign (resid  69 and name   HN) (resid  69 and name   HG) 7.0 5.2 0.0 !    885:20  Unique
assign (resid  13 and name  HE#) (resid  62 and name HG1#) 5.0 3.2 0.0 !    886:20  Unique
assign (resid  62 and name   HA) (resid  62 and name HG1#) 5.0 3.2 0.0 !    889:20  Unique
assign (resid  62 and name HD1#) (resid  62 and name HG1#) 3.0 1.2 0.0 !    892:20  Unique
assign (resid  42 and name HD##) (resid  42 and name   HG) 3.5 1.7 0.0 !    894:20  Unique
assign (resid  42 and name HD##) (resid  42 and name   HG) 3.0 1.2 0.0 !    895:20  Unique
assign (resid  30 and name   HA) (resid  30 and name  HG#) 3.5 1.7 0.0 !    898:20  Unique
assign (resid  30 and name   HA) (resid  30 and name  HG#) 5.0 3.2 0.0 !    899:20  Unique
assign (resid  30 and name  HE#) (resid  30 and name  HG#) 3.5 1.7 0.0 !    900:20  Unique
assign (resid  30 and name  HE#) (resid  30 and name  HG#) 5.0 3.2 0.0 !    901:20  Unique
assign (resid  24 and name HG1#) (resid  15 and name  HG#) 5.0 3.2 0.0 !    903:20  Unique
assign (resid  42 and name HD##) (resid  30 and name  HG#) 5.0 3.2 0.0 !    904:20  Unique
assign (resid  67 and name   HA) (resid  67 and name  HG#) 3.5 1.7 0.0 !    907:20  Unique
assign (resid  11 and name  HB#) (resid  11 and name  HG#) 3.0 1.2 0.0 !    909:20  Unique
assign (resid  20 and name   HA) (resid  20 and name  HG#) 3.0 1.2 0.0 !    910:20  Unique
assign (resid  20 and name  HE#) (resid  20 and name  HG#) 3.0 1.2 0.0 !    911:20  Unique
assign (resid  11 and name  HE#) (resid  11 and name  HG#) 3.5 1.7 0.0 !    912:20  Unique
assign (resid  20 and name  HB#) (resid  20 and name  HG#) 3.0 1.2 0.0 !    913:20  Unique
assign (resid  11 and name  HB#) (resid  11 and name  HG#) 3.5 1.7 0.0 !    914:20  Unique
!10-8-17 assign (resid  21 and name   HB) (resid  20 and name  HG#) 7.0 5.2 0.0 !    915:20  Unique
assign (resid  45 and name  HD#) (resid  27 and name  HB#) 3.5 1.7 0.0 !    916:20  Unique
assign (resid  12 and name HG##) (resid  27 and name  HB#) 3.0 1.2 0.0 !    920:20  Unique
assign (resid  43 and name   HB) (resid  27 and name  HB#) 3.5 1.7 0.0 !    921:20  Unique
assign (resid  38 and name  HB#) (resid  40 and name HD##) 3.5 1.7 0.0 !    924:20  Unique
assign (resid  69 and name   HN) (resid  67 and name  HG#) 5.0 3.2 0.0 !    930:20  Unique
assign (resid  11 and name   HN) (resid  11 and name  HG#) 7.0 5.2 0.0 !    933:20  Unique
assign (resid  42 and name   HG) (resid  42 and name HD##) 3.0 1.2 0.0 !    936:20  Unique
assign (resid  42 and name  HB#) (resid  42 and name HD##) 3.5 1.7 0.0 !    937:20  Unique
assign (resid  30 and name  HB#) (resid  42 and name HD##) 5.0 3.2 0.0 !    939:20  Unique
assign (resid  30 and name  HE#) (resid  42 and name HD##) 7.0 5.2 0.0 !    940:20  Unique
assign (resid  31 and name  HB#) (resid  42 and name HD##) 7.0 5.2 0.0 !    941:20  Unique
assign (resid  42 and name   HA) (resid  42 and name HD##) 5.0 3.2 0.0 !    942:20  Unique
assign (resid  31 and name  HB#) (resid  42 and name HD##) 5.0 3.2 0.0 !    943:20  Unique
assign (resid  43 and name   HN) (resid  42 and name HD##) 5.0 3.2 0.0 !    945:20  Unique
assign (resid  31 and name   HN) (resid  42 and name HD##) 5.0 3.2 0.0 !    946:20  Unique
assign (resid  55 and name  HZ2) (resid  42 and name HD##) 5.0 3.2 0.0 !    947:20  Unique
assign (resid  41 and name   HN) (resid  40 and name HD##) 5.0 3.2 0.0 !    950:20  Unique
assign (resid  40 and name   HA) (resid  40 and name HD##) 5.0 3.2 0.0 !    953:20  Unique
assign (resid  35 and name   HA) (resid  40 and name HD##) 5.0 3.2 0.0 !    954:20  Unique
assign (resid  39 and name   HA) (resid  40 and name HD##) 7.0 5.2 0.0 !    955:20  Unique
assign (resid  55 and name  HB#) (resid  40 and name HD##) 5.0 3.2 0.0 !    956:20  Unique
assign (resid  55 and name  HB#) (resid  40 and name HD##) 7.0 5.2 0.0 !    957:20  Unique
assign (resid  35 and name  HB#) (resid  40 and name HD##) 3.5 1.7 0.0 !    958:20  Unique
assign (resid  61 and name HG2#) (resid  14 and name HG##) 5.0 3.2 0.0 !    962:20  Unique
assign (resid  61 and name HG2#) (resid  12 and name HG##) 3.0 1.2 0.0 !    963:20  Unique
assign (resid  12 and name HG##) (resid  14 and name HG##) 3.0 1.2 0.0 !    965:20  Unique
assign (resid  13 and name  HB#) (resid  14 and name HG##) 7.0 5.2 0.0 !    970:20  Unique
assign (resid  15 and name  HB#) (resid  14 and name HG##) 5.0 3.2 0.0 !    972:20  Unique
assign (resid  29 and name HG1#) (resid  12 and name HG##) 3.5 1.7 0.0 !    975:20  Unique
assign (resid  12 and name   HB) (resid  12 and name HG##) 3.0 1.2 0.0 !    977:20  Unique
assign (resid  61 and name   HA) (resid  14 and name HG##) 3.5 1.7 0.0 !    978:20  Unique
assign (resid  13 and name   HA) (resid  14 and name HG##) 5.0 3.2 0.0 !    982:20  Unique
assign (resid  45 and name  HE#) (resid  14 and name HG##) 3.5 1.7 0.0 !    984:20  Unique
assign (resid  63 and name  HZ3) (resid  12 and name HG##) 5.0 3.2 0.0 !    985:20  Unique
assign (resid  12 and name   HN) (resid  12 and name HG##) 3.5 1.7 0.0 !    986:20  Unique
assign (resid  63 and name  HE3) (resid  12 and name HG##) 5.0 3.2 0.0 !    987:20  Unique
assign (resid  13 and name   HN) (resid  12 and name HG##) 5.0 3.2 0.0 !    988:20  Unique
assign (resid  15 and name   HN) (resid  14 and name HG##) 7.0 5.2 0.0 !    991:20  Unique
assign (resid  14 and name   HN) (resid  14 and name HG##) 5.0 3.2 0.0 !    992:20  Unique
assign (resid  12 and name HG##) (resid  10 and name HG2#) 5.0 3.2 0.0 !    995:20  Unique
assign (resid  12 and name HG##) (resid  10 and name HG2#) 3.0 1.2 0.0 !    996:20  Unique
assign (resid  29 and name HD1#) (resid  10 and name HG2#) 5.0 3.2 0.0 !    997:20  Unique
assign (resid  29 and name HG1#) (resid  10 and name HG2#) 3.5 1.7 0.0 !    998:20  Unique
assign (resid  64 and name  HD#) (resid  10 and name HG2#) 3.5 1.7 0.0 !   1002:20  Unique
assign (resid  63 and name  HZ3) (resid  10 and name HG2#) 3.5 1.7 0.0 !   1005:20  Unique
assign (resid  10 and name   HN) (resid  10 and name HG2#) 7.0 5.2 0.0 !   1007:20  Unique
assign (resid  11 and name   HN) (resid  10 and name HG2#) 3.5 1.7 0.0 !   1008:20  Unique
assign (resid  39 and name HG##) (resid  32 and name HG2#) 3.0 1.2 0.0 !   1010:20  Unique
assign (resid  34 and name HD1#) (resid  32 and name HG2#) 5.0 3.2 0.0 !   1011:20  Unique
assign (resid  32 and name   HB) (resid  32 and name HG2#) 3.0 1.2 0.0 !   1016:20  Unique
assign (resid  41 and name   HA) (resid  32 and name HG2#) 5.0 3.2 0.0 !   1018:20  Unique
assign (resid  32 and name   HA) (resid  32 and name HG2#) 5.0 3.2 0.0 !   1019:20  Unique
assign (resid  55 and name  HZ3) (resid  32 and name HG2#) 5.0 3.2 0.0 !   1020:20  Unique
assign (resid  41 and name  HE#) (resid  32 and name HG2#) 3.5 1.7 0.0 !   1021:20  Unique
assign (resid  41 and name  HD#) (resid  32 and name HG2#) 3.5 1.7 0.0 !   1022:20  Unique
assign (resid  32 and name   HN) (resid  32 and name HG2#) 5.0 3.2 0.0 !   1023:20  Unique
assign (resid  33 and name   HN) (resid  32 and name HG2#) 3.5 1.7 0.0 !   1025:20  Unique
assign (resid  61 and name   HA) (resid  14 and name HG##) 5.0 3.2 0.0 !   1031:20  Unique
assign (resid  13 and name   HA) (resid  14 and name HG##) 7.0 5.2 0.0 !   1033:20  Unique
assign (resid  45 and name  HE#) (resid  14 and name HG##) 3.5 1.7 0.0 !   1034:20  Unique
assign (resid  25 and name  HD#) (resid  14 and name HG##) 7.0 5.2 0.0 !   1035:20  Unique
assign (resid  60 and name   HN) (resid  14 and name HG##) 7.0 5.2 0.0 !   1036:20  Unique
assign (resid  16 and name  HD#) (resid  14 and name HG##) 7.0 5.2 0.0 !   1037:20  Unique
assign (resid  15 and name   HN) (resid  14 and name HG##) 3.5 1.7 0.0 !   1038:20  Unique
assign (resid  14 and name   HN) (resid  14 and name HG##) 5.0 3.2 0.0 !   1039:20  Unique
assign (resid  56 and name   HB) (resid  56 and name HG##) 3.0 1.2 0.0 !   1040:20  Unique
assign (resid  56 and name   HN) (resid  56 and name HG##) 5.0 3.2 0.0 !   1042:20  Unique
assign (resid  57 and name   HN) (resid  56 and name HG##) 3.5 1.7 0.0 !   1043:20  Unique
assign (resid  39 and name   HB) (resid  39 and name HG##) 3.0 1.2 0.0 !   1046:20  Unique
assign (resid  38 and name  HG#) (resid  39 and name HG##) 5.0 3.2 0.0 !   1047:20  Unique
assign (resid  39 and name   HA) (resid  39 and name HG##) 3.0 1.2 0.0 !   1048:20  Unique
assign (resid  34 and name   HA) (resid  39 and name HG##) 3.0 1.2 0.0 !   1049:20  Unique
assign (resid  39 and name   HN) (resid  39 and name HG##) 3.0 1.2 0.0 !   1050:20  Unique
assign (resid  21 and name   HB) (resid  21 and name HG2#) 3.0 1.2 0.0 !   1054:20  Unique
assign (resid   8 and name   HA) (resid   8 and name HG2#) 3.0 1.2 0.0 !   1055:20  Unique
assign (resid  31 and name   HA) (resid   8 and name HG2#) 5.0 3.2 0.0 !   1056:20  Unique
assign (resid   8 and name   HB) (resid   8 and name HG2#) 3.0 1.2 0.0 !   1058:20  Unique
assign (resid  18 and name  HG#) (resid  21 and name HG2#) 3.0 1.2 0.0 !   1067:20  Unique
assign (resid  61 and name HD1#) (resid  43 and name HG##) 3.0 1.2 0.0 !   1073:20  Unique
assign (resid  43 and name   HB) (resid  43 and name HG##) 3.0 1.2 0.0 !   1076:20  Unique
assign (resid  39 and name   HB) (resid  39 and name HG##) 3.0 1.2 0.0 !   1077:20  Unique
assign (resid  32 and name HG2#) (resid  39 and name HG##) 3.5 1.7 0.0 !   1079:20  Unique
assign (resid  41 and name  HB#) (resid  43 and name HG##) 7.0 5.2 0.0 !   1082:20  Unique
assign (resid  14 and name   HB) (resid  43 and name HG##) 5.0 3.2 0.0 !   1083:20  Unique
assign (resid  32 and name   HB) (resid  39 and name HG##) 3.5 1.7 0.0 !   1084:20  Unique
assign (resid  39 and name   HA) (resid  39 and name HG##) 3.0 1.2 0.0 !   1085:20  Unique
assign (resid  29 and name   HA) (resid  43 and name HG##) 3.5 1.7 0.0 !   1086:20  Unique
assign (resid  34 and name   HA) (resid  39 and name HG##) 5.0 3.2 0.0 !   1088:20  Unique
assign (resid  43 and name   HA) (resid  43 and name HG##) 3.0 1.2 0.0 !   1089:20  Unique
assign (resid  32 and name   HA) (resid  39 and name HG##) 7.0 5.2 0.0 !   1090:20  Unique
assign (resid  41 and name  HE#) (resid  39 and name HG##) 3.5 1.7 0.0 !   1091:20  Unique
assign (resid  41 and name  HD#) (resid  39 and name HG##) 5.0 3.2 0.0 !   1092:20  Unique
assign (resid  41 and name  HD#) (resid  43 and name HG##) 7.0 5.2 0.0 !   1093:20  Unique
assign (resid  39 and name   HN) (resid  39 and name HG##) 3.5 1.7 0.0 !   1095:20  Unique
assign (resid  43 and name   HN) (resid  43 and name HG##) 3.5 1.7 0.0 !   1097:20  Unique
assign (resid  50 and name   HB) (resid  50 and name HG##) 3.0 1.2 0.0 !   1099:20  Unique
assign (resid  42 and name   HG) (resid  42 and name HD##) 3.0 1.2 0.0 !   1102:20  Unique
assign (resid  42 and name  HB#) (resid  42 and name HD##) 3.5 1.7 0.0 !   1103:20  Unique
assign (resid  53 and name  HB#) (resid  42 and name HD##) 5.0 3.2 0.0 !   1105:20  Unique
assign (resid  53 and name  HB#) (resid  42 and name HD##) 7.0 5.2 0.0 !   1106:20  Unique
assign (resid  30 and name  HB#) (resid  42 and name HD##) 7.0 5.2 0.0 !   1107:20  Unique
assign (resid  42 and name   HA) (resid  42 and name HD##) 3.5 1.7 0.0 !   1108:20  Unique
assign (resid  55 and name   HA) (resid  42 and name HD##) 5.0 3.2 0.0 !   1110:20  Unique
assign (resid  54 and name   HA) (resid  42 and name HD##) 5.0 3.2 0.0 !   1111:20  Unique
assign (resid  55 and name  HD1) (resid  42 and name HD##) 7.0 5.2 0.0 !   1112:20  Unique
assign (resid  54 and name   HN) (resid  42 and name HD##) 5.0 3.2 0.0 !   1113:20  Unique
assign (resid  43 and name   HN) (resid  42 and name HD##) 3.5 1.7 0.0 !   1115:20  Unique
assign (resid  31 and name   HN) (resid  42 and name HD##) 7.0 5.2 0.0 !   1116:20  Unique
assign (resid  55 and name  HE1) (resid  42 and name HD##) 7.0 5.2 0.0 !   1117:20  Unique
assign (resid  56 and name   HN) (resid  56 and name HG##) 3.5 1.7 0.0 !   1119:20  Unique
assign (resid  57 and name   HN) (resid  56 and name HG##) 5.0 3.2 0.0 !   1121:20  Unique
assign (resid  60 and name   HN) (resid  56 and name HG##) 7.0 5.2 0.0 !   1122:20  Unique
assign (resid  41 and name  HD#) (resid  56 and name HG##) 5.0 3.2 0.0 !   1123:20  Unique
assign (resid  56 and name   HA) (resid  56 and name HG##) 3.5 1.7 0.0 !   1124:20  Unique
assign (resid  55 and name   HA) (resid  56 and name HG##) 5.0 3.2 0.0 !   1125:20  Unique
assign (resid  41 and name  HB#) (resid  56 and name HG##) 7.0 5.2 0.0 !   1128:20  Unique
assign (resid  56 and name   HB) (resid  56 and name HG##) 3.5 1.7 0.0 !   1130:20  Unique
assign (resid  60 and name  HB#) (resid  56 and name HG##) 3.5 1.7 0.0 !   1131:20  Unique
assign (resid  43 and name HG##) (resid  56 and name HG##) 3.0 1.2 0.0 !   1132:20  Unique
assign (resid  61 and name HD1#) (resid  56 and name HG##) 3.0 1.2 0.0 !   1133:20  Unique
assign (resid  50 and name   HB) (resid  50 and name HG##) 3.0 1.2 0.0 !   1145:20  Unique
assign (resid  48 and name   HN) (resid  50 and name HG##) 3.5 1.7 1.5 !   1148:20  Unique  10-8-17
assign (resid  63 and name  HE1) (resid  58 and name  HB#) 5.0 3.2 0.0 !   1150:20  Unique
assign (resid  58 and name   HN) (resid  58 and name  HB#) 3.0 1.2 0.0 !   1151:20  Unique
assign (resid  59 and name   HN) (resid  58 and name  HB#) 3.5 1.7 0.0 !   1152:20  Unique
assign (resid  41 and name  HD#) (resid  58 and name  HB#) 3.5 1.7 0.0 !   1153:20  Unique
assign (resid  41 and name  HE#) (resid  58 and name  HB#) 3.0 1.2 0.0 !   1154:20  Unique
assign (resid  63 and name  HH2) (resid  58 and name  HB#) 7.0 5.2 0.0 !   1155:20  Unique
assign (resid  57 and name   HA) (resid  58 and name  HB#) 5.0 3.2 0.0 !   1157:20  Unique
assign (resid  59 and name   HA) (resid  58 and name  HB#) 5.0 3.2 0.0 !   1158:20  Unique
assign (resid  58 and name   HA) (resid  58 and name  HB#) 3.0 1.2 0.0 !   1159:20  Unique
assign (resid  39 and name HG##) (resid  58 and name  HB#) 5.0 3.2 0.0 !   1160:20  Unique
assign (resid  39 and name HG##) (resid  58 and name  HB#) 5.0 3.2 0.0 !   1161:20  Unique
assign (resid  56 and name   HN) (resid  43 and name HG##) 7.0 5.2 0.0 !   1164:20  Unique
assign (resid  30 and name   HN) (resid  29 and name HG2#) 5.0 3.2 0.0 !   1165:20  Unique
assign (resid  43 and name   HN) (resid  43 and name HG##) 3.0 1.2 0.0 !   1166:20  Unique
assign (resid  42 and name   HN) (resid  29 and name HG2#) 5.0 3.2 0.0 !   1169:20  Unique
assign (resid  31 and name   HN) (resid  29 and name HG2#) 3.5 1.7 0.0 !   1171:20  Unique
assign (resid  41 and name  HD#) (resid  29 and name HG2#) 3.5 1.7 0.0 !   1172:20  Unique
assign (resid  41 and name  HE#) (resid  29 and name HG2#) 5.0 3.2 0.0 !   1173:20  Unique
assign (resid  45 and name  HE#) (resid  43 and name HG##) 5.0 3.2 0.0 !   1174:20  Unique
assign (resid  41 and name   HA) (resid  29 and name HG2#) 5.0 3.2 0.0 !   1175:20  Unique
assign (resid  55 and name   HA) (resid  43 and name HG##) 5.0 3.2 0.0 !   1176:20  Unique
assign (resid  43 and name   HA) (resid  43 and name HG##) 3.0 1.2 0.0 !   1177:20  Unique
assign (resid  29 and name   HA) (resid  29 and name HG2#) 3.0 1.2 0.0 !   1179:20  Unique
assign (resid  29 and name   HA) (resid  43 and name HG##) 7.0 5.2 0.0 !   1181:20  Unique
assign (resid  42 and name   HA) (resid  43 and name HG##) 5.0 3.2 0.0 !   1182:20  Unique
assign (resid  29 and name   HB) (resid  29 and name HG2#) 3.5 1.7 0.0 !   1185:20  Unique
assign (resid  32 and name HG2#) (resid  29 and name HG2#) 5.0 3.2 0.0 !   1187:20  Unique
assign (resid  43 and name   HB) (resid  43 and name HG##) 3.5 1.7 0.0 !   1189:20  Unique
assign (resid  29 and name HG1#) (resid  29 and name HG2#) 5.0 3.2 0.0 !   1192:20  Unique
assign (resid  29 and name HD1#) (resid  29 and name HG2#) 3.0 1.2 0.0 !   1193:20  Unique
assign (resid  43 and name HG##) (resid  29 and name HG2#) 3.5 1.7 0.0 !   1194:20  Unique
assign (resid  61 and name HD1#) (resid  43 and name HG##) 7.0 5.2 0.0 !   1195:20  Unique
assign (resid  42 and name HD##) (resid  43 and name HG##) 5.0 3.2 0.0 !   1196:20  Unique
assign (resid  63 and name  HE1) (resid  12 and name HG##) 5.0 3.2 0.0 !   1201:20  Unique
!K30 10-8-13 assign (resid  30 and name   HN) (resid  12 and name HG##) 7.0 5.2 0.0 !   1202:20  Unique
assign (resid  12 and name   HN) (resid  12 and name HG##) 3.0 1.2 0.0 !   1203:20  Unique
assign (resid  13 and name   HN) (resid  12 and name HG##) 5.0 3.2 0.0 !   1205:20  Unique
assign (resid  63 and name  HE3) (resid  12 and name HG##) 7.0 5.2 0.0 !   1206:20  Unique
assign (resid  28 and name   HA) (resid  12 and name HG##) 5.0 3.2 0.0 !   1207:20  Unique
assign (resid  13 and name   HA) (resid  12 and name HG##) 5.0 3.2 0.0 !   1208:20  Unique
assign (resid  41 and name  HB#) (resid  12 and name HG##) 7.0 5.2 0.0 !   1211:20  Unique
assign (resid  64 and name  HG#) (resid  12 and name HG##) 7.0 5.2 0.0 !   1212:20  Unique
assign (resid  12 and name   HB) (resid  12 and name HG##) 3.0 1.2 0.0 !   1214:20  Unique
assign (resid  29 and name HG1#) (resid  12 and name HG##) 3.5 1.7 0.0 !   1215:20  Unique
assign (resid  29 and name HG2#) (resid  12 and name HG##) 3.5 1.7 1.0 !   1217:20  Unique  10-8-12
assign (resid  61 and name HG2#) (resid  12 and name HG##) 3.5 1.7 0.0 !   1221:20  Unique
assign (resid  62 and name HG1#) (resid  62 and name HG2#) 3.0 1.2 0.0 !   1222:20  Unique
assign (resid  34 and name HG1#) (resid  34 and name HG2#) 5.0 3.2 0.0 !   1224:20  Unique
assign (resid  34 and name   HB) (resid  34 and name HG2#) 3.0 1.2 0.0 !   1225:20  Unique
assign (resid  34 and name HG1#) (resid  34 and name HG2#) 3.5 1.7 0.0 !   1226:20  Unique
assign (resid  38 and name  HG#) (resid  34 and name HG2#) 5.0 3.2 0.0 !   1229:20  Unique
assign (resid  37 and name  HA#) (resid  34 and name HG2#) 3.5 1.7 0.0 !   1230:20  Unique
assign (resid  62 and name   HA) (resid  62 and name HG2#) 3.0 1.2 0.0 !   1234:20  Unique
assign (resid  38 and name   HN) (resid  34 and name HG2#) 5.0 3.2 0.0 !   1237:20  Unique
assign (resid  37 and name   HN) (resid  34 and name HG2#) 3.5 1.7 0.0 !   1238:20  Unique
assign (resid  63 and name   HN) (resid  62 and name HG2#) 3.5 1.7 0.0 !   1240:20  Unique
assign (resid  13 and name   HN) (resid  62 and name HG2#) 5.0 3.2 0.0 !   1241:20  Unique
assign (resid  62 and name   HN) (resid  62 and name HG2#) 5.0 3.2 0.0 !   1242:20  Unique
assign (resid  35 and name   HN) (resid  34 and name HG2#) 3.0 1.2 0.0 !   1243:20  Unique
assign (resid  61 and name HG2#) (resid  62 and name HG2#) 5.0 3.2 0.0 !   1244:20  Unique
assign (resid  61 and name HD1#) (resid  61 and name HG2#) 3.0 1.2 0.0 !   1245:20  Unique
assign (resid  12 and name HG##) (resid  61 and name HG2#) 3.5 1.7 0.0 !   1246:20  Unique
assign (resid  61 and name   HB) (resid  61 and name HG2#) 3.0 1.2 0.0 !   1249:20  Unique
assign (resid  62 and name   HB) (resid  61 and name HG2#) 5.0 3.2 0.0 !   1250:20  Unique
assign (resid  12 and name   HB) (resid  61 and name HG2#) 3.5 1.7 0.0 !   1251:20  Unique
assign (resid  61 and name HG1#) (resid  61 and name HG2#) 3.0 1.2 0.0 !   1252:20  Unique
assign (resid  63 and name  HH2) (resid  61 and name HG2#) 7.0 5.2 0.0 !   1257:20  Unique
assign (resid  63 and name  HZ3) (resid  61 and name HG2#) 5.0 3.2 0.0 !   1258:20  Unique
assign (resid  63 and name  HZ2) (resid  61 and name HG2#) 5.0 3.2 0.0 !   1259:20  Unique
assign (resid  13 and name   HN) (resid  61 and name HG2#) 5.0 3.2 0.0 !   1261:20  Unique
assign (resid  63 and name   HN) (resid  61 and name HG2#) 7.0 5.2 0.0 !   1262:20  Unique
assign (resid  62 and name   HN) (resid  61 and name HG2#) 3.5 1.7 0.0 !   1263:20  Unique
assign (resid  63 and name  HE1) (resid  61 and name HG2#) 7.0 5.2 0.0 !   1264:20  Unique
assign (resid  61 and name HG2#) (resid  29 and name HD1#) 3.5 1.7 0.0 !   1265:20  Unique
assign (resid  12 and name HG##) (resid  29 and name HD1#) 3.0 1.2 0.0 !   1266:20  Unique
assign (resid  29 and name HG2#) (resid  29 and name HD1#) 3.0 1.2 0.0 !   1269:20  Unique
assign (resid  29 and name HG1#) (resid  29 and name HD1#) 3.0 1.2 0.0 !   1271:20  Unique
assign (resid  41 and name  HB#) (resid  29 and name HD1#) 5.0 3.2 0.0 !   1274:20  Unique
assign (resid  41 and name  HE#) (resid  29 and name HD1#) 5.0 3.2 0.0 !   1278:20  Unique
assign (resid  63 and name  HZ3) (resid  29 and name HD1#) 5.0 3.2 0.0 !   1279:20  Unique
assign (resid  63 and name  HH2) (resid  29 and name HD1#) 5.0 3.2 0.0 !   1280:20  Unique
assign (resid  41 and name  HD#) (resid  29 and name HD1#) 5.0 3.2 0.0 !   1281:20  Unique
assign (resid  29 and name   HN) (resid  29 and name HD1#) 5.0 3.2 0.0 !   1282:20  Unique
assign (resid  30 and name   HN) (resid  29 and name HD1#) 7.0 5.2 0.0 !   1283:20  Unique
assign (resid  61 and name HG2#) (resid  61 and name HD1#) 3.0 1.2 0.0 !   1286:20  Unique
assign (resid  61 and name HG1#) (resid  61 and name HD1#) 3.0 1.2 0.0 !   1291:20  Unique
assign (resid  61 and name   HB) (resid  61 and name HD1#) 3.0 1.2 0.0 !   1292:20  Unique
assign (resid  41 and name  HB#) (resid  61 and name HD1#) 3.5 1.7 0.0 !   1294:20  Unique
assign (resid  41 and name  HB#) (resid  61 and name HD1#) 5.0 3.2 0.0 !   1295:20  Unique
assign (resid  58 and name   HA) (resid  61 and name HD1#) 3.0 1.2 0.0 !   1296:20  Unique
assign (resid  63 and name  HH2) (resid  61 and name HD1#) 5.0 3.2 0.0 !   1299:20  Unique
assign (resid  41 and name  HD#) (resid  61 and name HD1#) 3.5 1.7 0.0 !   1301:20  Unique
assign (resid  61 and name   HN) (resid  61 and name HD1#) 3.5 1.7 0.5 !   1302:20  Unique 10-8-16
assign (resid  62 and name   HN) (resid  61 and name HD1#) 5.0 3.2 0.0 !   1303:20  Unique
assign (resid  14 and name HG##) (resid  61 and name   HA) 5.0 3.2 0.0 !   1306:20  Unique
assign (resid  29 and name HG2#) (resid  29 and name   HA) 3.0 1.2 0.0 !   1307:20  Unique
assign (resid  62 and name HD1#) (resid  62 and name   HB) 3.0 1.2 0.0 !   1312:20  Unique
assign (resid  51 and name   HA) (resid  51 and name  HB#) 3.5 1.7 0.0 !   1313:20  Unique
assign (resid  33 and name   HN) (resid  32 and name   HA) 3.0 1.2 0.0 !   1316:20  Unique
assign (resid  32 and name   HB) (resid  32 and name   HA) 3.5 1.7 0.0 !   1318:20  Unique
assign (resid  41 and name   HA) (resid  32 and name   HA) 5.0 3.2 0.0 !   1320:20  Unique
assign (resid  32 and name HG2#) (resid  32 and name   HA) 3.5 1.7 0.0 !   1321:20  Unique
assign (resid  55 and name  HZ3) (resid  32 and name   HA) 5.0 3.2 0.0 !   1324:20  Unique
assign (resid  42 and name   HN) (resid  32 and name   HA) 5.0 3.2 0.0 !   1325:20  Unique
assign (resid  53 and name   HA) (resid  53 and name  HB#) 5.0 3.2 0.0 !   1329:20  Unique
assign (resid  38 and name   HA) (resid  38 and name  HB#) 3.0 1.2 0.0 !   1330:20  Unique
assign (resid  39 and name   HN) (resid  38 and name  HB#) 5.0 3.2 0.0 !   1334:20  Unique
assign (resid  23 and name   HN) (resid  23 and name  HG#) 5.0 3.2 0.0 !   1339:20  Unique
assign (resid  23 and name   HN) (resid  23 and name  HG#) 5.0 3.2 0.0 !   1340:20  Unique
assign (resid  28 and name   HN) (resid  27 and name  HB#) 3.0 1.2 0.0 !   1342:20  Unique
assign (resid  27 and name   HN) (resid  27 and name  HB#) 3.0 1.2 0.0 !   1343:20  Unique
assign (resid  57 and name   HA) (resid  40 and name HD##) 3.5 1.7 0.0 !   1344:20  Unique
assign (resid  40 and name   HA) (resid  40 and name HD##) 3.0 1.2 0.0 !   1345:20  Unique
assign (resid  45 and name   HA) (resid  27 and name  HB#) 5.0 3.2 0.0 !   1346:20  Unique
assign (resid  41 and name   HN) (resid  40 and name HD##) 5.0 3.2 0.0 !   1348:20  Unique
assign (resid  51 and name  HG#) (resid  51 and name  HB#) 3.0 1.2 0.0 !   1352:20  Unique
assign (resid  51 and name   HA) (resid  51 and name  HD#) 7.0 5.2 0.0 !   1354:20  Unique
assign (resid  15 and name  HG#) (resid  24 and name HG1#) 3.0 1.2 0.0 !   1355:20  Unique
assign (resid  51 and name  HB#) (resid  51 and name  HG#) 5.0 3.2 0.0 !   1356:20  Unique
assign (resid  63 and name  HH2) (resid   7 and name HD##) 5.0 3.2 0.0 !   1358:20  Unique
assign (resid  63 and name  HZ3) (resid   7 and name HD##) 5.0 3.2 0.0 !   1359:20  Unique
assign (resid  13 and name   HA) (resid  13 and name  HB#) 7.0 5.2 0.0 !   1360:20  Unique
assign (resid  23 and name  HE#) (resid  23 and name  HB#) 3.5 1.7 0.0 !   1361:20  Unique
assign (resid  39 and name   HA) (resid  34 and name HD1#) 3.5 1.7 0.0 !   1362:20  Unique
assign (resid  40 and name   HN) (resid  40 and name   HG) 5.0 3.2 0.0 !   1371:20  Unique
assign (resid  40 and name   HA) (resid  40 and name   HG) 5.0 3.2 0.0 !   1372:20  Unique
assign (resid  41 and name  HD#) (resid  41 and name  HB#) 7.0 5.2 0.0 !   1376:20  Unique
assign (resid   2 and name   HN) (resid   2 and name  HB#) 7.0 5.2 0.0 !   1377:20  Unique
assign (resid  42 and name   HN) (resid  42 and name   HA) 7.0 5.2 0.0 !   1379:20  Unique
assign (resid  55 and name   HA) (resid  42 and name   HA) 5.0 3.2 0.0 !   1381:20  Unique
assign (resid  42 and name   HG) (resid  42 and name   HA) 5.0 3.2 0.0 !   1382:20  Unique
assign (resid  42 and name   HN) (resid  42 and name  HB#) 7.0 5.2 0.0 !   1383:20  Unique
assign (resid  31 and name   HN) (resid  42 and name  HB#) 5.0 3.2 0.0 !   1384:20  Unique
assign (resid  42 and name HD##) (resid  42 and name  HB#) 5.0 3.2 0.0 !   1386:20  Unique
assign (resid  50 and name   HB) (resid  50 and name   HA) 3.5 1.7 0.0 !   1387:20  Unique
assign (resid  48 and name   HN) (resid  50 and name HG##) 5.0 3.2 0.0 !   1390:20  Unique
assign (resid  52 and name  HB#) (resid  52 and name   HA) 3.5 1.7 0.0 !   1391:20  Unique
assign (resid  52 and name  HB#) (resid  52 and name   HA) 5.0 3.2 0.0 !   1392:20  Unique
assign (resid  16 and name  HB#) (resid  16 and name   HA) 5.0 3.2 0.0 !   1394:20  Unique
assign (resid  52 and name  HE#) (resid  52 and name   HA) 5.0 3.2 0.0 !   1395:20  Unique
assign (resid  53 and name   HA) (resid  53 and name  HB#) 7.0 5.2 0.0 !   1397:20  Unique
assign (resid  45 and name  HE#) (resid  54 and name  HB#) 7.0 5.2 0.0 !   1398:20  Unique
assign (resid  55 and name   HN) (resid  54 and name  HB#) 7.0 5.2 0.0 !   1399:20  Unique
assign (resid  25 and name  HB#) (resid  54 and name  HB#) 7.0 5.2 0.0 !   1400:20  Unique
assign (resid  54 and name   HA) (resid  55 and name  HB#) 5.0 3.2 0.0 !   1402:20  Unique
assign (resid  40 and name HD##) (resid  55 and name  HB#) 5.0 3.2 0.0 !   1403:20  Unique
assign (resid  55 and name   HA) (resid  56 and name HG##) 5.0 3.2 0.0 !   1404:20  Unique
assign (resid  60 and name   HN) (resid  56 and name HG##) 5.0 3.2 0.0 !   1405:20  Unique
assign (resid  54 and name  HB#) (resid  56 and name HG##) 3.5 1.7 0.0 !   1406:20  Unique
assign (resid  43 and name HG##) (resid  56 and name HG##) 3.5 1.7 0.0 !   1408:20  Unique
assign (resid  57 and name   HN) (resid  57 and name  HG#) 7.0 5.2 0.0 !   1411:20  Unique
assign (resid  67 and name   HN) (resid  67 and name   HA) 3.5 1.7 0.0 !   1412:20  Unique
assign (resid  60 and name   HN) (resid  60 and name  HB#) 5.0 3.2 0.0 !   1416:20  Unique
assign (resid  60 and name   HN) (resid  60 and name  HB#) 7.0 5.2 0.0 !   1417:20  Unique
assign (resid  61 and name   HN) (resid  60 and name  HB#) 7.0 5.2 0.0 !   1418:20  Unique
assign (resid  60 and name   HA) (resid  60 and name  HB#) 7.0 5.2 0.0 !   1419:20  Unique
assign (resid  60 and name  HD#) (resid  60 and name  HB#) 7.0 5.2 0.0 !   1420:20  Unique
assign (resid  60 and name   HN) (resid  60 and name  HD#) 5.0 3.2 0.0 !   1424:20  Unique
assign (resid  61 and name   HN) (resid  60 and name  HD#) 7.0 5.2 0.0 !   1425:20  Unique
assign (resid  63 and name  HD1) (resid  61 and name HG2#) 5.0 3.2 0.0 !   1427:20  Unique
assign (resid  61 and name HG2#) (resid  62 and name   HA) 5.0 3.2 0.0 !   1428:20  Unique
assign (resid  62 and name   HN) (resid  62 and name   HA) 3.5 1.7 0.0 !   1429:20  Unique
assign (resid  62 and name   HN) (resid  62 and name   HB) 5.0 3.2 0.0 !   1430:20  Unique
assign (resid  13 and name  HE#) (resid  62 and name HD1#) 3.5 1.7 0.0 !   1435:20  Unique
assign (resid  62 and name   HA) (resid  62 and name HD1#) 5.0 3.2 0.0 !   1436:20  Unique
assign (resid  60 and name   HA) (resid  62 and name HD1#) 5.0 3.2 0.0 !   1438:20  Unique
assign (resid  13 and name   HA) (resid  62 and name HD1#) 5.0 3.2 0.0 !   1439:20  Unique
assign (resid  62 and name   HN) (resid  62 and name HD1#) 3.5 1.7 0.0 !   1440:20  Unique
assign (resid  25 and name   HN) (resid  62 and name HD1#) 5.0 3.2 0.0 !   1441:20  Unique
assign (resid  67 and name  HB#) (resid  62 and name HG2#) 5.0 3.2 0.0 !   1443:20  Unique
assign (resid  38 and name   HA) (resid  38 and name  HB#) 3.5 1.7 0.0 !   1444:20  Unique
assign (resid  40 and name HD##) (resid  38 and name  HB#) 3.5 1.7 0.0 !   1445:20  Unique
assign (resid  55 and name  HB#) (resid  40 and name HD##) 3.5 1.7 0.0 !   1460:20  Unique
assign (resid  38 and name   HA) (resid  40 and name HD##) 5.0 3.2 0.0 !   1461:20  Unique
assign (resid  67 and name  HB#) (resid  69 and name HD##) 5.0 3.2 0.0 !   1465:20  Unique
assign (resid  65 and name   HA) (resid  65 and name HD##) 3.0 1.2 0.0 !   1468:20  Unique
assign (resid   6 and name   HA) (resid   7 and name HD##) 5.0 3.2 0.0 !   1469:20  Unique
assign (resid  63 and name  HB#) (resid  65 and name HD##) 5.0 3.2 0.0 !   1470:20  Unique
assign (resid   6 and name  HB#) (resid   7 and name HD##) 3.5 1.7 0.0 !   1471:20  Unique
assign (resid  44 and name   HN) (resid  27 and name  HB#) 5.0 3.2 0.0 !   1476:20  Unique
assign (resid  67 and name   HN) (resid  65 and name HD##) 5.0 3.2 0.0 !   1479:20  Unique
assign (resid  65 and name   HN) (resid  65 and name HD##) 5.0 3.2 0.0 !   1480:20  Unique
assign (resid  29 and name   HB) (resid   7 and name HD##) 5.0 3.2 0.0 !   1481:20  Unique
assign (resid  32 and name   HN) (resid   7 and name HD##) 7.0 5.2 0.0 !   1483:20  Unique
assign (resid  69 and name HD##) (resid  67 and name  HB#) 7.0 5.2 0.0 !   1484:20  Unique
assign (resid  26 and name  HB#) (resid  13 and name  HD#) 5.0 3.2 0.0 !   1485:20  Unique
assign (resid  13 and name  HG#) (resid  13 and name  HD#) 3.0 1.2 0.0 !   1487:20  Unique
assign (resid  46 and name  HE#) (resid  11 and name  HD#) 5.0 3.2 0.0 !   1493:20  Unique
assign (resid  67 and name  HB#) (resid  67 and name  HD#) 3.0 1.2 0.0 !   1496:20  Unique
assign (resid  17 and name  HA#) (resid  18 and name  HG#) 7.0 5.2 0.0 !   1498:20  Unique
assign (resid  70 and name   HN) (resid  70 and name  HB#) 5.0 3.2 0.0 !   1499:20  Unique
assign (resid  70 and name   HA) (resid  70 and name  HB#) 3.0 1.2 0.0 !   1500:20  Unique
assign (resid  70 and name   HA) (resid  70 and name  HG#) 3.5 1.7 0.0 !   1501:20  Unique
assign (resid  70 and name   HA) (resid  70 and name  HG#) 5.0 3.2 0.0 !   1502:20  Unique
assign (resid  70 and name  HB#) (resid  70 and name  HG#) 3.0 1.2 0.0 !   1503:20  Unique
assign (resid  72 and name   HN) (resid  72 and name  HB#) 5.0 3.2 0.0 !   1505:20  Unique
assign (resid  43 and name HG##) (resid  27 and name  HB#) 3.0 1.2 0.0 !   1509:20  Unique
assign (resid  45 and name  HD#) (resid  14 and name HG##) 7.0 5.2 0.0 !   1515:20  Unique
assign (resid  56 and name   HA) (resid  56 and name   HB) 5.0 3.2 0.0 !   1518:20  Unique
assign (resid  11 and name  HB#) (resid  45 and name   HA) 5.0 3.2 2.0 !   1522:20  Unique 10-8-16
assign (resid  29 and name HG1#) (resid  43 and name HG##) 5.0 3.2 0.0 !   1524:20  Unique
assign (resid  34 and name HG1#) (resid  39 and name HG##) 5.0 3.2 0.0 !   1526:20  Unique
assign (resid  64 and name   HA) ((resid  65 and name HD##)) 5.0 3.2 0.0 !     95:20  Single
assign (resid  65 and name   HA) ((resid  65 and name HD##)) 3.0 1.2 0.0 !    202:20  Single
assign (resid  64 and name  HG#)    (resid  64 and name  HD#) 3.0 1.2 0.0 !    329:20  Double
assign (resid  61 and name HG2#) (resid  63 and name   HN) 5.0 3.2 0.0 !      0:10  Unique
assign (resid  62 and name HG2#) (resid  63 and name   HN) 3.5 1.7 0.0 !      4:10  Unique
assign (resid  63 and name  HB#) (resid  63 and name   HN) 5.0 3.2 0.0 !      5:10  Unique
assign (resid  63 and name  HB#) (resid  63 and name   HN) 5.0 3.2 0.0 !      6:10  Unique
assign (resid  62 and name   HA) (resid  63 and name   HN) 3.5 1.7 0.0 !      7:10  Unique
assign (resid  63 and name  HD1) (resid  63 and name   HN) 5.0 3.2 0.0 !     10:10  Unique
assign (resid  62 and name   HN) (resid  63 and name   HN) 5.0 3.2 0.0 !     12:10  Unique
assign (resid  63 and name  HZ2) (resid  63 and name   HN) 7.0 5.2 0.0 !     13:10  Unique
assign (resid  63 and name  HE1) (resid  63 and name   HN) 7.0 5.2 0.0 !     14:10  Unique
assign (resid  61 and name HG2#) (resid  63 and name  HE1) 5.0 3.2 0.0 !     15:10  Unique
assign (resid  42 and name HD##) (resid  55 and name  HE1) 7.0 5.2 0.0 !     16:10  Unique
assign (resid  42 and name HD##) (resid  55 and name  HE1) 7.0 5.2 0.0 !     17:10  Unique
assign (resid  61 and name   HB) (resid  63 and name  HE1) 5.0 3.2 0.0 !     18:10  Unique
assign (resid  58 and name  HB#) (resid  63 and name  HE1) 7.0 5.2 0.0 !     19:10  Unique
assign (resid  61 and name HD1#) (resid  63 and name  HE1) 7.0 5.2 0.0 !     20:10  Unique
assign (resid  58 and name   HA) (resid  63 and name  HE1) 5.0 3.2 0.0 !     22:10  Unique
assign (resid  63 and name  HH2) (resid  63 and name  HE1) 5.0 3.2 0.0 !     24:10  Unique
assign (resid  63 and name  HZ2) (resid  63 and name  HE1) 3.5 1.7 0.0 !     25:10  Unique
assign (resid  63 and name   HN) (resid  63 and name  HE1) 7.0 5.2 0.0 !     26:10  Unique
assign (resid  63 and name  HZ3) (resid  63 and name  HE1) 7.0 5.2 0.0 !     27:10  Unique
assign (resid  63 and name  HD1) (resid  63 and name  HE1) 3.0 1.2 0.0 !     28:10  Unique
assign (resid  55 and name  HZ2) (resid  55 and name  HE1) 5.0 3.2 0.0 !     30:10  Unique
assign (resid  55 and name  HD1) (resid  55 and name  HE1) 5.0 3.2 0.0 !     31:10  Unique
assign (resid  29 and name HG2#) (resid  30 and name   HN) 3.5 1.7 0.0 !     35:10  Unique
assign (resid  30 and name  HB#) (resid  30 and name   HN) 5.0 3.2 0.0 !     36:10  Unique
assign (resid  29 and name   HB) (resid  30 and name   HN) 7.0 5.2 0.0 !     37:10  Unique
assign (resid  29 and name   HA) (resid  30 and name   HN) 5.0 3.2 0.0 !     38:10  Unique
assign (resid  30 and name   HA) (resid  30 and name   HN) 5.0 3.2 0.0 !     39:10  Unique
assign (resid  43 and name   HA) (resid  30 and name   HN) 5.0 3.2 0.0 !     40:10  Unique
assign (resid  31 and name   HN) (resid  30 and name   HN) 5.0 3.2 0.0 !     41:10  Unique
assign (resid  42 and name HD##) (resid  42 and name   HN) 7.0 5.2 0.0 !     44:10  Unique
assign (resid  42 and name  HB#) (resid  42 and name   HN) 5.0 3.2 0.0 !     47:10  Unique
assign (resid  29 and name HG2#) (resid  42 and name   HN) 5.0 3.2 0.0 !     48:10  Unique
assign (resid  32 and name HG2#) (resid  42 and name   HN) 7.0 5.2 0.0 !     49:10  Unique
assign (resid  41 and name   HA) (resid  42 and name   HN) 5.0 3.2 0.0 !     52:10  Unique
assign (resid  32 and name   HA) (resid  42 and name   HN) 5.0 3.2 0.0 !     53:10  Unique
assign (resid  55 and name  HZ3) (resid  42 and name   HN) 7.0 5.2 0.0 !     54:10  Unique
assign (resid  41 and name  HD#) (resid  42 and name   HN) 5.0 3.2 0.0 !     56:10  Unique
assign (resid  31 and name   HN) (resid  42 and name   HN) 7.0 5.2 0.0 !     57:10  Unique
assign (resid  61 and name HG2#) (resid  62 and name   HN) 5.0 3.2 0.0 !     60:10  Unique
assign (resid  12 and name HG##) (resid  62 and name   HN) 5.0 3.2 0.0 !     61:10  Unique
assign (resid  14 and name HG##) (resid  62 and name   HN) 5.0 3.2 0.0 !     62:10  Unique
assign (resid  34 and name HG2#) (resid  35 and name   HN) 3.0 1.2 0.0 !     64:10  Unique
assign (resid  62 and name   HB) (resid  62 and name   HN) 5.0 3.2 0.0 !     67:10  Unique
assign (resid  12 and name   HB) (resid  62 and name   HN) 5.0 3.2 0.0 !     69:10  Unique
assign (resid  34 and name HG1#) (resid  35 and name   HN) 5.0 3.2 0.0 !     70:10  Unique
assign (resid  34 and name HG1#) (resid  35 and name   HN) 5.0 3.2 0.0 !     71:10  Unique
assign (resid  39 and name HG##) (resid  35 and name   HN) 5.0 3.2 0.0 !     72:10  Unique
assign (resid  35 and name  HB#) (resid  35 and name   HN) 5.0 3.2 0.0 !     75:10  Unique
assign (resid  14 and name   HA) (resid  62 and name   HN) 7.0 5.2 0.0 !     79:10  Unique
assign (resid  39 and name   HA) (resid  35 and name   HN) 3.5 1.7 0.0 !     81:10  Unique
assign (resid  38 and name   HN) (resid  35 and name   HN) 5.0 3.2 0.0 !     82:10  Unique
assign (resid  37 and name   HN) (resid  35 and name   HN) 7.0 5.2 0.0 !     83:10  Unique
assign (resid  13 and name   HN) (resid  62 and name   HN) 5.0 3.2 0.0 !     85:10  Unique
assign (resid  15 and name  HG#) (resid  16 and name   HN) 7.0 5.2 0.0 !     90:10  Unique
assign (resid  16 and name  HB#) (resid  16 and name   HN) 7.0 5.2 0.0 !     94:10  Unique
assign (resid  16 and name  HB#) (resid  16 and name   HN) 5.0 3.2 0.0 !     95:10  Unique
assign (resid  15 and name   HA) (resid  16 and name   HN) 5.0 3.2 0.0 !     96:10  Unique
assign (resid  24 and name   HA) (resid  16 and name   HN) 5.0 3.2 0.0 !     97:10  Unique
assign (resid  25 and name  HE#) (resid  16 and name   HN) 7.0 5.2 0.0 !     98:10  Unique
assign (resid  25 and name  HD#) (resid  16 and name   HN) 5.0 3.2 0.0 !     99:10  Unique
assign (resid  23 and name   HN) (resid  16 and name   HN) 5.0 3.2 0.0 !    101:10  Unique
assign (resid  60 and name   HE) (resid  16 and name   HN) 5.0 3.2 0.0 !    103:10  Unique
assign (resid  12 and name HG##) (resid  11 and name   HN) 7.0 5.2 0.0 !    104:10  Unique
assign (resid  29 and name HD1#) (resid  11 and name   HN) 7.0 5.2 0.0 !    105:10  Unique
assign (resid  10 and name HG2#) (resid  11 and name   HN) 3.5 1.7 0.0 !    106:10  Unique
assign (resid  11 and name  HB#) (resid  11 and name   HN) 5.0 3.2 0.0 !    108:10  Unique
assign (resid  11 and name  HB#) (resid  11 and name   HN) 5.0 3.2 0.0 !    109:10  Unique
assign (resid  63 and name  HZ3) (resid  11 and name   HN) 7.0 5.2 0.0 !    112:10  Unique
assign (resid  10 and name   HN) (resid  11 and name   HN) 7.0 5.2 0.0 !    113:10  Unique
assign (resid  12 and name   HN) (resid  11 and name   HN) 5.0 3.2 0.0 !    115:10  Unique
assign (resid  34 and name HG2#) (resid  36 and name   HN) 5.0 3.2 0.0 !    116:10  Unique
assign (resid  34 and name   HB) (resid  36 and name   HN) 7.0 5.2 0.0 !    117:10  Unique
assign (resid  36 and name  HB#) (resid  36 and name   HN) 5.0 3.2 0.0 !    119:10  Unique
assign (resid  35 and name  HB#) (resid  36 and name   HN) 5.0 3.2 0.0 !    120:10  Unique
assign (resid  36 and name  HB#) (resid  36 and name   HN) 5.0 3.2 0.0 !    121:10  Unique
assign (resid  37 and name  HA#) (resid  36 and name   HN) 7.0 5.2 0.0 !    122:10  Unique
assign (resid  36 and name   HA) (resid  36 and name   HN) 3.5 1.7 0.0 !    123:10  Unique
assign (resid  35 and name   HA) (resid  36 and name   HN) 3.5 1.7 0.0 !    124:10  Unique
assign (resid  38 and name   HN) (resid  36 and name   HN) 7.0 5.2 0.0 !    125:10  Unique
assign (resid  37 and name   HN) (resid  36 and name   HN) 5.0 3.2 0.0 !    126:10  Unique
!10-8-16 assign (resid  38 and name  HB#) (resid  36 and name   HN) 7.0 5.2 0.0 !    128:10  Unique
assign (resid  39 and name HG##) (resid  40 and name   HN) 3.5 1.7 0.0 !    129:10  Unique
assign (resid  39 and name HG##) (resid  40 and name   HN) 3.5 1.7 0.0 !    130:10  Unique
assign (resid  22 and name  HG#) (resid  23 and name   HN) 3.5 1.7 0.0 !    133:10  Unique
assign (resid  39 and name   HA) (resid  40 and name   HN) 3.5 1.7 0.0 !    135:10  Unique
assign (resid  32 and name   HB) (resid  40 and name   HN) 7.0 5.2 0.0 !    136:10  Unique
assign (resid  40 and name   HA) (resid  40 and name   HN) 5.0 3.2 0.0 !    138:10  Unique
assign (resid  22 and name   HA) (resid  23 and name   HN) 3.0 1.2 0.0 !    140:10  Unique
assign (resid  41 and name  HD#) (resid  40 and name   HN) 5.0 3.2 0.0 !    141:10  Unique
assign (resid  34 and name   HN) (resid  35 and name   HN) 5.0 3.2 0.0 !    142:10  Unique
assign (resid  34 and name   HN) (resid  40 and name   HN) 5.0 3.2 0.0 !    143:10  Unique
assign (resid  24 and name   HN) (resid  23 and name   HN) 7.0 5.2 0.0 !    147:10  Unique
assign (resid  25 and name  HB#) (resid  25 and name   HN) 5.0 3.2 0.0 !    152:10  Unique
assign (resid  25 and name  HB#) (resid  25 and name   HN) 5.0 3.2 0.0 !    153:10  Unique
assign (resid  24 and name   HA) (resid  25 and name   HN) 5.0 3.2 0.0 !    156:10  Unique
assign (resid  25 and name   HA) (resid  25 and name   HN) 5.0 3.2 0.0 !    157:10  Unique
assign (resid  25 and name  HE#) (resid  25 and name   HN) 5.0 3.2 0.0 !    158:10  Unique
assign (resid  25 and name  HD#) (resid  25 and name   HN) 7.0 5.2 0.0 !    160:10  Unique
assign (resid  24 and name   HN) (resid  25 and name   HN) 7.0 5.2 0.0 !    161:10  Unique
assign (resid  14 and name   HN) (resid  25 and name   HN) 5.0 3.2 0.0 !    162:10  Unique
assign (resid  16 and name   HN) (resid  15 and name   HN) 7.0 5.2 0.0 !    165:10  Unique
assign (resid  15 and name   HA) (resid  15 and name   HN) 5.0 3.2 0.0 !    168:10  Unique
assign (resid  60 and name   HA) (resid  15 and name   HN) 7.0 5.2 0.0 !    169:10  Unique
assign (resid  61 and name   HA) (resid  15 and name   HN) 7.0 5.2 0.0 !    170:10  Unique
assign (resid  13 and name  HE#) (resid  15 and name   HN) 7.0 5.2 0.0 !    171:10  Unique
assign (resid  15 and name  HG#) (resid  15 and name   HN) 5.0 3.2 0.0 !    173:10  Unique
assign (resid  15 and name  HB#) (resid  15 and name   HN) 5.0 3.2 0.0 !    174:10  Unique
assign (resid  15 and name  HG#) (resid  15 and name   HN) 7.0 5.2 0.0 !    176:10  Unique
assign (resid  14 and name HG##) (resid  15 and name   HN) 5.0 3.2 0.0 !    177:10  Unique
assign (resid  14 and name HG##) (resid  15 and name   HN) 7.0 5.2 0.0 !    179:10  Unique
assign (resid  72 and name   HA) (resid  72 and name   HN) 5.0 3.2 0.0 !    182:10  Unique
assign (resid  71 and name   HA) (resid  72 and name   HN) 5.0 3.2 0.0 !    183:10  Unique
assign (resid  12 and name HG##) (resid  27 and name   HN) 7.0 5.2 0.0 !    187:10  Unique
assign (resid  14 and name HG##) (resid  27 and name   HN) 5.0 3.2 0.0 !    189:10  Unique
assign (resid  27 and name  HB#) (resid  27 and name   HN) 5.0 3.2 0.0 !    190:10  Unique
assign (resid  26 and name  HG#) (resid  27 and name   HN) 7.0 5.2 0.0 !    197:10  Unique
assign (resid  26 and name  HG#) (resid  27 and name   HN) 7.0 5.2 0.0 !    198:10  Unique
assign (resid  26 and name   HA) (resid  27 and name   HN) 3.5 1.7 0.0 !    201:10  Unique
assign (resid  27 and name   HA) (resid  27 and name   HN) 5.0 3.2 0.0 !    203:10  Unique
assign (resid  13 and name   HA) (resid  27 and name   HN) 5.0 3.2 0.0 !    204:10  Unique
assign (resid  14 and name   HN) (resid  27 and name   HN) 7.0 5.2 0.0 !    207:10  Unique
assign (resid   6 and name  HB#) (resid   7 and name   HN) 5.0 3.2 0.0 !    210:10  Unique
assign (resid   7 and name HD##) (resid   7 and name   HN) 7.0 5.2 0.0 !    212:10  Unique
assign (resid  42 and name HD##) (resid  55 and name   HN) 7.0 5.2 0.0 !    213:10  Unique
assign (resid  55 and name  HB#) (resid  55 and name   HN) 5.0 3.2 0.0 !    217:10  Unique
assign (resid  55 and name  HB#) (resid  55 and name   HN) 5.0 3.2 0.0 !    218:10  Unique
assign (resid  54 and name   HA) (resid  55 and name   HN) 5.0 3.2 0.0 !    219:10  Unique
assign (resid  55 and name   HA) (resid  55 and name   HN) 5.0 3.2 0.0 !    220:10  Unique
assign (resid  55 and name  HD1) (resid  55 and name   HN) 5.0 3.2 0.0 !    221:10  Unique
assign (resid  54 and name   HN) (resid  55 and name   HN) 7.0 5.2 0.0 !    222:10  Unique
assign (resid  39 and name HG##) (resid  39 and name   HN) 5.0 3.2 0.0 !    224:10  Unique
assign (resid  39 and name HG##) (resid  39 and name   HN) 3.5 1.7 0.0 !    226:10  Unique
assign (resid  38 and name  HB#) (resid  39 and name   HN) 3.0 1.2 0.0 !    228:10  Unique
assign (resid  39 and name   HB) (resid  39 and name   HN) 3.0 1.2 0.0 !    229:10  Unique
assign (resid  39 and name   HA) (resid  39 and name   HN) 5.0 3.2 0.0 !    232:10  Unique
assign (resid  38 and name   HA) (resid  39 and name   HN) 3.0 1.2 0.0 !    233:10  Unique
assign (resid  38 and name   HN) (resid  39 and name   HN) 5.0 3.2 0.0 !    234:10  Unique
assign (resid  39 and name HG##) (resid  33 and name   HN) 7.0 5.2 0.0 !    236:10  Unique
assign (resid  39 and name HG##) (resid  33 and name   HN) 7.0 5.2 0.0 !    237:10  Unique
assign (resid  34 and name HD1#) (resid  33 and name   HN) 7.0 5.2 0.0 !    238:10  Unique
assign (resid  32 and name HG2#) (resid  33 and name   HN) 5.0 3.2 0.0 !    239:10  Unique
assign (resid  33 and name  HG#) (resid  33 and name   HN) 7.0 5.2 0.0 !    241:10  Unique
assign (resid  32 and name   HB) (resid  33 and name   HN) 7.0 5.2 0.0 !    242:10  Unique
assign (resid  39 and name   HA) (resid  33 and name   HN) 7.0 5.2 0.0 !    243:10  Unique
assign (resid  33 and name   HA) (resid  33 and name   HN) 5.0 3.2 0.0 !    244:10  Unique
assign (resid  32 and name   HA) (resid  33 and name   HN) 5.0 3.2 0.0 !    247:10  Unique
assign (resid  55 and name  HZ3) (resid  33 and name   HN) 5.0 3.2 0.0 !    248:10  Unique
assign (resid  41 and name  HD#) (resid  33 and name   HN) 5.0 3.2 0.0 !    250:10  Unique
assign (resid  42 and name   HN) (resid  33 and name   HN) 7.0 5.2 0.0 !    251:10  Unique
assign (resid  34 and name   HN) (resid  33 and name   HN) 7.0 5.2 0.0 !    252:10  Unique
assign (resid   2 and name  HB#) (resid   4 and name   HN) 7.0 5.2 0.0 !    257:10  Unique
assign (resid   3 and name  HG#) (resid   4 and name   HN) 5.0 3.2 0.0 !    258:10  Unique
assign (resid   5 and name  HD#) (resid   4 and name   HN) 5.0 3.2 0.0 !    259:10  Unique
assign (resid   3 and name   HA) (resid   4 and name   HN) 3.0 1.2 0.0 !    260:10  Unique
assign (resid  21 and name HG2#) (resid  22 and name   HN) 7.0 5.2 0.0 !    265:10  Unique
assign (resid  22 and name  HB#) (resid  22 and name   HN) 5.0 3.2 0.0 !    266:10  Unique
!10-8-13 T21  assign (resid  20 and name  HG#) (resid  22 and name   HN) 7.0 5.2 0.0 !    267:10  Unique
assign (resid  22 and name  HG#) (resid  22 and name   HN) 5.0 3.2 0.0 !    269:10  Unique
assign (resid  22 and name  HB#) (resid  22 and name   HN) 3.5 1.7 0.0 !    270:10  Unique
assign (resid  20 and name   HA) (resid  22 and name   HN) 7.0 5.2 0.0 !    271:10  Unique
assign (resid  18 and name   HA) (resid  22 and name   HN) 7.0 5.2 0.0 !    272:10  Unique
assign (resid  21 and name   HN) (resid  22 and name   HN) 7.0 5.2 0.0 !    275:10  Unique
assign (resid  23 and name   HN) (resid  22 and name   HN) 7.0 5.2 0.0 !    276:10  Unique
assign (resid  34 and name HD1#) (resid  34 and name   HN) 3.5 1.7 0.0 !    278:10  Unique
assign (resid  39 and name HG##) (resid  34 and name   HN) 5.0 3.2 0.0 !    279:10  Unique
assign (resid  34 and name HG1#) (resid  34 and name   HN) 5.0 3.2 0.0 !    280:10  Unique
assign (resid  34 and name HG1#) (resid  34 and name   HN) 5.0 3.2 0.0 !    281:10  Unique
assign (resid  33 and name   HA) (resid  34 and name   HN) 3.0 1.2 0.0 !    284:10  Unique
assign (resid  39 and name   HA) (resid  34 and name   HN) 7.0 5.2 0.0 !    285:10  Unique
assign (resid  29 and name HD1#) (resid  29 and name   HN) 5.0 3.2 0.0 !    289:10  Unique
assign (resid  29 and name HG1#) (resid  29 and name   HN) 5.0 3.2 0.0 !    290:10  Unique
assign (resid  64 and name  HB#) (resid  65 and name   HN) 3.5 1.7 0.0 !    293:10  Unique
assign (resid  64 and name  HB#) (resid  65 and name   HN) 5.0 3.2 0.0 !    294:10  Unique
assign (resid  28 and name  HB#) (resid  29 and name   HN) 5.0 3.2 0.0 !    296:10  Unique
assign (resid  65 and name   HA) (resid  65 and name   HN) 3.5 1.7 0.0 !    298:10  Unique
assign (resid  64 and name   HA) (resid  65 and name   HN) 3.0 1.2 0.0 !    299:10  Unique
assign (resid  28 and name   HA) (resid  29 and name   HN) 5.0 3.2 0.0 !    301:10  Unique
assign (resid  12 and name   HN) (resid  29 and name   HN) 7.0 5.2 0.0 !    303:10  Unique
assign (resid  67 and name  HG#) (resid  67 and name   HN) 5.0 3.2 0.0 !    304:10  Unique
assign (resid  67 and name  HB#) (resid  67 and name   HN) 5.0 3.2 0.0 !    305:10  Unique
assign (resid  67 and name  HB#) (resid  67 and name   HN) 5.0 3.2 0.0 !    306:10  Unique
assign (resid  66 and name  HB#) (resid  67 and name   HN) 5.0 3.2 0.0 !    308:10  Unique
assign (resid  67 and name   HA) (resid  67 and name   HN) 5.0 3.2 0.0 !    309:10  Unique
assign (resid  66 and name   HA) (resid  67 and name   HN) 3.5 1.7 0.0 !    310:10  Unique
assign (resid  68 and name   HN) (resid  67 and name   HN) 7.0 5.2 0.0 !    312:10  Unique
assign (resid  55 and name  HZ3) (resid  34 and name   HN) 7.0 5.2 0.0 !    314:10  Unique
assign (resid  75 and name   HA) (resid  76 and name   HN) 5.0 3.2 0.0 !    316:10  Unique
assign (resid  75 and name  HB#) (resid  76 and name   HN) 5.0 3.2 0.0 !    318:10  Unique
assign (resid  47 and name  HA#) (resid  48 and name   HN) 5.0 3.2 0.0 !    321:10  Unique
assign (resid  47 and name  HA#) (resid  48 and name   HN) 7.0 5.2 0.0 !    322:10  Unique
assign (resid  34 and name   HB) (resid  38 and name   HN) 7.0 5.2 0.0 !    327:10  Unique
assign (resid  38 and name  HG#) (resid  38 and name   HN) 3.5 1.7 0.0 !    329:10  Unique
assign (resid  35 and name  HB#) (resid  38 and name   HN) 7.0 5.2 0.0 !    330:10  Unique
assign (resid  37 and name  HA#) (resid  38 and name   HN) 5.0 3.2 0.0 !    332:10  Unique
assign (resid  35 and name   HA) (resid  38 and name   HN) 5.0 3.2 0.0 !    334:10  Unique
assign (resid  45 and name   HA) (resid  46 and name   HN) 5.0 3.2 0.0 !    335:10  Unique
assign (resid  37 and name   HN) (resid  38 and name   HN) 3.5 1.7 0.0 !    337:10  Unique 10-8-16
assign (resid  39 and name   HN) (resid  38 and name   HN) 5.0 3.2 0.0 !    338:10  Unique
assign (resid  35 and name   HN) (resid  38 and name   HN) 5.0 3.2 0.0 !    339:10  Unique
assign (resid  38 and name   HA) (resid  38 and name   HN) 3.5 1.7 0.0 !    341:10  Unique
assign (resid  27 and name   HA) (resid  46 and name   HN) 7.0 5.2 0.0 !    342:10  Unique
assign (resid  34 and name HG2#) (resid  38 and name   HN) 3.5 1.7 0.0 !    344:10  Unique
assign (resid  69 and name HD##) (resid  69 and name   HN) 3.5 1.7 0.0 !    345:10  Unique
assign (resid  70 and name  HG#) (resid  69 and name   HN) 7.0 5.2 0.0 !    346:10  Unique
assign (resid  66 and name  HB#) (resid  69 and name   HN) 7.0 5.2 0.0 !    347:10  Unique
assign (resid  68 and name  HA#) (resid  69 and name   HN) 3.5 1.7 0.0 !    348:10  Unique
assign (resid  70 and name   HN) (resid  69 and name   HN) 5.0 3.2 0.0 !    353:10  Unique
assign (resid  68 and name   HN) (resid  69 and name   HN) 7.0 5.2 0.0 !    354:10  Unique
assign (resid   2 and name  HB#) (resid   2 and name   HN) 3.5 1.7 0.0 !    358:10  Unique
assign (resid   2 and name  HB#) (resid   2 and name   HN) 5.0 3.2 0.0 !    359:10  Unique
assign (resid   1 and name   HA) (resid   2 and name   HN) 3.0 1.2 0.0 !    361:10  Unique
assign (resid   2 and name   HA) (resid   2 and name   HN) 3.5 1.7 0.0 !    362:10  Unique
assign (resid  42 and name HD##) (resid  43 and name   HN) 5.0 3.2 0.0 !    364:10  Unique
assign (resid  43 and name HG##) (resid  43 and name   HN) 3.5 1.7 0.0 !    366:10  Unique
assign (resid  42 and name   HA) (resid  43 and name   HN) 5.0 3.2 0.0 !    370:10  Unique
assign (resid  55 and name   HA) (resid  43 and name   HN) 5.0 3.2 0.0 !    372:10  Unique
assign (resid  54 and name   HN) (resid  43 and name   HN) 7.0 5.2 0.0 !    374:10  Unique
assign (resid  56 and name   HN) (resid  43 and name   HN) 7.0 5.2 0.0 !    375:10  Unique
assign (resid  26 and name  HG#) (resid  26 and name   HN) 5.0 3.2 0.0 !    379:10  Unique
assign (resid  26 and name  HG#) (resid  26 and name   HN) 5.0 3.2 0.0 !    380:10  Unique
assign (resid  25 and name  HB#) (resid  26 and name   HN) 5.0 3.2 0.0 !    381:10  Unique
assign (resid  13 and name  HE#) (resid  26 and name   HN) 7.0 5.2 0.0 !    382:10  Unique
assign (resid  25 and name  HB#) (resid  26 and name   HN) 5.0 3.2 0.0 !    384:10  Unique
assign (resid  26 and name   HA) (resid  26 and name   HN) 5.0 3.2 0.0 !    385:10  Unique
assign (resid  45 and name  HD#) (resid  26 and name   HN) 7.0 5.2 0.0 !    387:10  Unique
assign (resid  25 and name  HD#) (resid  26 and name   HN) 5.0 3.2 0.0 !    388:10  Unique
assign (resid  25 and name   HA) (resid  26 and name   HN) 5.0 3.2 0.0 !    389:10  Unique
assign (resid  14 and name HG##) (resid  14 and name   HN) 5.0 3.2 0.0 !    390:10  Unique
assign (resid  14 and name HG##) (resid  14 and name   HN) 5.0 3.2 0.0 !    391:10  Unique
assign (resid  24 and name HG1#) (resid  14 and name   HN) 7.0 5.2 0.0 !    393:10  Unique
assign (resid  13 and name  HG#) (resid  14 and name   HN) 5.0 3.2 0.0 !    394:10  Unique
assign (resid  13 and name  HB#) (resid  14 and name   HN) 3.5 1.7 0.0 !    395:10  Unique
assign (resid  14 and name   HB) (resid  14 and name   HN) 5.0 3.2 0.0 !    396:10  Unique
assign (resid  26 and name  HB#) (resid  14 and name   HN) 7.0 5.2 0.0 !    397:10  Unique
assign (resid  26 and name  HG#) (resid  14 and name   HN) 7.0 5.2 0.0 !    398:10  Unique
assign (resid  26 and name   HA) (resid  14 and name   HN) 5.0 3.2 0.0 !    400:10  Unique
assign (resid  13 and name   HA) (resid  14 and name   HN) 5.0 3.2 0.0 !    402:10  Unique
assign (resid  45 and name  HE#) (resid  14 and name   HN) 7.0 5.2 0.0 !    403:10  Unique
assign (resid  53 and name  HB#) (resid  53 and name   HN) 7.0 5.2 0.0 !    405:10  Unique
assign (resid  53 and name  HB#) (resid  53 and name   HN) 5.0 3.2 0.0 !    406:10  Unique
assign (resid  52 and name  HB#) (resid  53 and name   HN) 5.0 3.2 0.0 !    407:10  Unique 10-8-17
assign (resid  52 and name   HA) (resid  53 and name   HN) 3.5 1.7 0.0 !    409:10  Unique 10-8-17
assign (resid  53 and name   HA) (resid  53 and name   HN) 5.0 3.2 0.0 !    411:10  Unique
assign (resid  52 and name  HD#) (resid  53 and name   HN) 5.0 3.2 0.0 !    412:10  Unique 10-8-17
assign (resid  52 and name   HN) (resid  53 and name   HN) 5.0 3.2 0.0 !    413:10  Unique
assign (resid  35 and name   HA) (resid  34 and name   HN) 5.0 3.2 0.0 !    414:10  Unique
assign (resid  69 and name HD##) (resid  70 and name   HN) 5.0 3.2 0.0 !    415:10  Unique
assign (resid  70 and name  HG#) (resid  70 and name   HN) 5.0 3.2 0.0 !    418:10  Unique
assign (resid  68 and name  HA#) (resid  70 and name   HN) 7.0 5.2 0.0 !    420:10  Unique
assign (resid  70 and name   HA) (resid  70 and name   HN) 3.5 1.7 0.0 !    421:10  Unique
assign (resid  69 and name   HA) (resid  70 and name   HN) 3.5 1.7 0.0 !    422:10  Unique
assign (resid  69 and name   HN) (resid  70 and name   HN) 5.0 3.2 0.0 !    424:10  Unique
assign (resid  57 and name  HG#) (resid  57 and name   HN) 5.0 3.2 0.0 !    427:10  Unique
assign (resid   3 and name  HG#) (resid   3 and name   HN) 5.0 3.2 0.0 !    432:10  Unique
assign (resid  60 and name  HD#) (resid  57 and name   HN) 7.0 5.2 0.0 !    433:10  Unique
assign (resid  23 and name   HA) (resid  24 and name   HN) 3.5 1.7 0.0 !    443:10  Unique
assign (resid  24 and name   HA) (resid  24 and name   HN) 5.0 3.2 0.0 !    444:10  Unique
assign (resid  24 and name HD1#) (resid  24 and name   HN) 3.5 1.7 0.0 !    445:10  Unique
assign (resid  24 and name HG1#) (resid  24 and name   HN) 5.0 3.2 0.0 !    448:10  Unique
assign (resid  75 and name  HB#) (resid  75 and name   HN) 5.0 3.2 0.0 !    453:10  Unique
assign (resid  40 and name HD##) (resid  58 and name   HN) 5.0 3.2 0.0 !    457:10  Unique
assign (resid  57 and name  HG#) (resid  58 and name   HN) 7.0 5.2 0.0 !    458:10  Unique
assign (resid  58 and name  HB#) (resid  58 and name   HN) 3.0 1.2 0.0 !    459:10  Unique
assign (resid  57 and name  HB#) (resid  58 and name   HN) 5.0 3.2 0.0 !    460:10  Unique
assign (resid  58 and name   HA) (resid  58 and name   HN) 5.0 3.2 0.0 !    461:10  Unique
assign (resid  57 and name   HA) (resid  58 and name   HN) 5.0 3.2 0.0 !    462:10  Unique
assign (resid  40 and name   HA) (resid  58 and name   HN) 7.0 5.2 0.0 !    463:10  Unique
assign (resid  41 and name  HE#) (resid  58 and name   HN) 5.0 3.2 0.0 !    464:10  Unique
assign (resid  41 and name  HD#) (resid  58 and name   HN) 7.0 5.2 0.0 !    465:10  Unique
assign (resid   5 and name   HA) (resid   6 and name   HN) 3.5 1.7 0.0 !    472:10  Unique
assign (resid  42 and name HD##) (resid  56 and name   HN) 5.0 3.2 0.0 !    476:10  Unique
assign (resid  61 and name HG1#) (resid  56 and name   HN) 7.0 5.2 0.0 !    478:10  Unique
assign (resid  40 and name  HB#) (resid  56 and name   HN) 7.0 5.2 0.0 !    480:10  Unique
assign (resid  55 and name  HB#) (resid  56 and name   HN) 7.0 5.2 0.0 !    481:10  Unique
assign (resid  55 and name  HB#) (resid  56 and name   HN) 7.0 5.2 0.0 !    482:10  Unique
assign (resid  42 and name   HA) (resid  56 and name   HN) 5.0 3.2 0.0 !    483:10  Unique
assign (resid  55 and name   HA) (resid  56 and name   HN) 5.0 3.2 0.0 !    485:10  Unique
assign (resid  56 and name   HA) (resid  56 and name   HN) 5.0 3.2 0.0 !    486:10  Unique
assign (resid  41 and name  HD#) (resid  56 and name   HN) 5.0 3.2 0.0 !    487:10  Unique
assign (resid  57 and name   HN) (resid  56 and name   HN) 7.0 5.2 0.0 !    488:10  Unique
assign (resid  55 and name   HN) (resid  56 and name   HN) 7.0 5.2 0.0 !    489:10  Unique
assign (resid  41 and name   HN) (resid  56 and name   HN) 7.0 5.2 0.0 !    490:10  Unique
assign (resid  42 and name HD##) (resid  54 and name   HN) 5.0 3.2 0.0 !    491:10  Unique
assign (resid  53 and name  HB#) (resid  54 and name   HN) 5.0 3.2 0.0 !    493:10  Unique
assign (resid  53 and name  HB#) (resid  54 and name   HN) 5.0 3.2 0.0 !    494:10  Unique
assign (resid  54 and name   HA) (resid  54 and name   HN) 5.0 3.2 0.0 !    497:10  Unique
assign (resid  53 and name   HA) (resid  54 and name   HN) 3.5 1.7 0.0 !    498:10  Unique
assign (resid  42 and name   HA) (resid  54 and name   HN) 7.0 5.2 0.0 !    499:10  Unique
assign (resid  45 and name  HE#) (resid  54 and name   HN) 5.0 3.2 0.0 !    500:10  Unique
assign (resid  43 and name   HN) (resid  54 and name   HN) 5.0 3.2 0.0 !    502:10  Unique
assign (resid  40 and name HD##) (resid  41 and name   HN) 3.5 1.7 0.0 !    504:10  Unique
assign (resid  40 and name  HB#) (resid  41 and name   HN) 3.5 1.7 0.0 !    506:10  Unique
assign (resid  41 and name  HB#) (resid  41 and name   HN) 5.0 3.2 0.0 !    507:10  Unique
assign (resid  41 and name  HB#) (resid  41 and name   HN) 5.0 3.2 0.0 !    508:10  Unique
assign (resid  56 and name   HA) (resid  41 and name   HN) 5.0 3.2 0.0 !    511:10  Unique
assign (resid  55 and name   HA) (resid  41 and name   HN) 5.0 3.2 0.0 !    513:10  Unique
assign (resid  32 and name   HA) (resid  41 and name   HN) 7.0 5.2 0.0 !    515:10  Unique
assign (resid  55 and name  HZ3) (resid  41 and name   HN) 7.0 5.2 0.0 !    516:10  Unique
assign (resid  41 and name  HE#) (resid  41 and name   HN) 5.0 3.2 0.0 !    517:10  Unique
assign (resid  41 and name  HD#) (resid  41 and name   HN) 5.0 3.2 0.0 !    518:10  Unique
assign (resid  42 and name   HN) (resid  41 and name   HN) 7.0 5.2 0.0 !    519:10  Unique
assign (resid  56 and name   HN) (resid  41 and name   HN) 5.0 3.2 0.0 !    522:10  Unique
assign (resid  51 and name   HA) (resid  52 and name   HN) 5.0 3.2 0.0 !    523:10  Unique
assign (resid  52 and name   HA) (resid  52 and name   HN) 5.0 3.2 0.0 !    524:10  Unique
assign (resid  52 and name  HB#) (resid  52 and name   HN) 7.0 5.2 0.0 !    526:10  Unique
assign (resid  51 and name  HG#) (resid  52 and name   HN) 7.0 5.2 0.0 !    527:10  Unique
assign (resid  52 and name  HD#) (resid  52 and name   HN) 7.0 5.2 0.0 !    528:10  Unique
assign (resid  61 and name HG2#) (resid  61 and name   HN) 5.0 3.2 0.0 !    529:10  Unique
assign (resid  61 and name HD1#) (resid  61 and name   HN) 5.0 3.2 0.0 !    530:10  Unique
assign (resid  12 and name HG##) (resid  61 and name   HN) 7.0 5.2 0.0 !    531:10  Unique
assign (resid  14 and name HG##) (resid  61 and name   HN) 5.0 3.2 0.0 !    532:10  Unique
assign (resid  61 and name   HB) (resid  61 and name   HN) 5.0 3.2 0.0 !    535:10  Unique
assign (resid  59 and name   HA) (resid  61 and name   HN) 5.0 3.2 0.0 !    538:10  Unique
assign (resid  60 and name   HA) (resid  61 and name   HN) 5.0 3.2 0.0 !    540:10  Unique
assign (resid  41 and name  HD#) (resid  61 and name   HN) 7.0 5.2 0.0 !    543:10  Unique
assign (resid  60 and name   HN) (resid  61 and name   HN) 5.0 3.2 0.0 !    544:10  Unique
assign (resid  59 and name   HN) (resid  61 and name   HN) 7.0 5.2 0.0 !    545:10  Unique
assign (resid  62 and name   HN) (resid  61 and name   HN) 5.0 3.2 0.0 !    546:10  Unique
assign (resid  63 and name  HE1) (resid  61 and name   HN) 5.0 3.2 0.0 !    547:10  Unique
assign (resid  61 and name HG2#) (resid  13 and name   HN) 5.0 3.2 0.0 !    548:10  Unique
assign (resid  12 and name HG##) (resid  13 and name   HN) 5.0 3.2 0.0 !    549:10  Unique
assign (resid  12 and name HG##) (resid  13 and name   HN) 5.0 3.2 0.0 !    550:10  Unique
assign (resid  13 and name  HB#) (resid  13 and name   HN) 3.5 1.7 0.0 !    554:10  Unique
assign (resid  12 and name   HB) (resid  13 and name   HN) 5.0 3.2 0.0 !    555:10  Unique
assign (resid  12 and name   HA) (resid  13 and name   HN) 5.0 3.2 0.0 !    557:10  Unique
assign (resid  13 and name   HA) (resid  13 and name   HN) 5.0 3.2 0.0 !    559:10  Unique
assign (resid  61 and name HG2#) (resid  60 and name   HN) 7.0 5.2 0.0 !    563:10  Unique
assign (resid  61 and name HD1#) (resid  60 and name   HN) 7.0 5.2 0.0 !    564:10  Unique
assign (resid  61 and name   HB) (resid  60 and name   HN) 5.0 3.2 0.0 !    568:10  Unique
assign (resid  57 and name  HG#) (resid  60 and name   HN) 5.0 3.2 0.0 !    569:10  Unique
assign (resid  60 and name  HG#) (resid  60 and name   HN) 5.0 3.2 0.0 !    570:10  Unique
assign (resid  60 and name  HB#) (resid  60 and name   HN) 3.5 1.7 0.0 !    571:10  Unique
assign (resid  57 and name  HB#) (resid  60 and name   HN) 5.0 3.2 0.0 !    572:10  Unique
assign (resid  60 and name  HB#) (resid  60 and name   HN) 5.0 3.2 0.0 !    573:10  Unique
assign (resid  59 and name  HB#) (resid  60 and name   HN) 7.0 5.2 0.0 !    574:10  Unique
assign (resid  59 and name  HB#) (resid  60 and name   HN) 5.0 3.2 0.0 !    575:10  Unique
assign (resid  60 and name  HD#) (resid  60 and name   HN) 5.0 3.2 0.0 !    576:10  Unique
assign (resid  60 and name   HA) (resid  60 and name   HN) 5.0 3.2 0.0 !    578:10  Unique
assign (resid  59 and name   HA) (resid  60 and name   HN) 5.0 3.2 0.0 !    579:10  Unique
assign (resid  41 and name  HD#) (resid  60 and name   HN) 7.0 5.2 0.0 !    582:10  Unique
assign (resid  61 and name   HN) (resid  60 and name   HN) 5.0 3.2 0.0 !    583:10  Unique
assign (resid  27 and name  HB#) (resid  44 and name   HN) 5.0 3.2 0.0 !    589:10  Unique
assign (resid  29 and name HG2#) (resid  44 and name   HN) 7.0 5.2 0.0 !    590:10  Unique
assign (resid  44 and name  HB#) (resid  44 and name   HN) 7.0 5.2 0.0 !    592:10  Unique
! 10-8-16 assign (resid  46 and name  HB#) (resid  44 and name   HN) 7.0 5.2 0.0 !    593:10  Unique
assign (resid  43 and name   HA) (resid  44 and name   HN) 3.5 1.7 0.0 !    595:10  Unique
assign (resid  28 and name   HN) (resid  44 and name   HN) 5.0 3.2 0.0 !    597:10  Unique
assign (resid  18 and name   HA) (resid  18 and name   HN) 7.0 5.2 0.0 !    599:10  Unique
assign (resid  17 and name  HA#) (resid  18 and name   HN) 5.0 3.2 0.0 !    600:10  Unique
assign (resid  17 and name  HA#) (resid  18 and name   HN) 7.0 5.2 0.0 !    601:10  Unique
assign (resid  18 and name  HB#) (resid  18 and name   HN) 7.0 5.2 0.0 !    603:10  Unique
assign (resid  18 and name  HG#) (resid  18 and name   HN) 7.0 5.2 0.0 !    604:10  Unique
assign (resid  61 and name HG2#) (resid  12 and name   HN) 7.0 5.2 0.0 !    605:10  Unique
assign (resid  12 and name HG##) (resid  12 and name   HN) 5.0 3.2 0.0 !    606:10  Unique
assign (resid  12 and name HG##) (resid  12 and name   HN) 5.0 3.2 0.0 !    607:10  Unique
assign (resid  11 and name  HB#) (resid  12 and name   HN) 5.0 3.2 0.0 !    612:10  Unique
assign (resid  11 and name  HB#) (resid  12 and name   HN) 3.5 1.7 0.0 !    613:10  Unique
assign (resid  28 and name  HB#) (resid  12 and name   HN) 7.0 5.2 0.0 !    614:10  Unique
assign (resid  13 and name   HA) (resid  12 and name   HN) 7.0 5.2 0.0 !    618:10  Unique
assign (resid  43 and name   HA) (resid  12 and name   HN) 7.0 5.2 0.0 !    619:10  Unique
assign (resid  28 and name   HA) (resid  12 and name   HN) 5.0 3.2 0.0 !    620:10  Unique
assign (resid  13 and name   HN) (resid  12 and name   HN) 7.0 5.2 0.0 !    621:10  Unique
assign (resid  29 and name HD1#) (resid  10 and name   HN) 7.0 5.2 0.0 !    624:10  Unique
assign (resid  29 and name HG2#) (resid  10 and name   HN) 5.0 3.2 0.0 !    625:10  Unique
assign (resid   8 and name HG2#) (resid   8 and name   HN) 7.0 5.2 0.0 !    627:10  Unique
assign (resid   7 and name  HB#) (resid   8 and name   HN) 7.0 5.2 0.0 !    628:10  Unique
assign (resid  10 and name HG2#) (resid  10 and name   HN) 5.0 3.2 0.0 !    629:10  Unique
assign (resid   9 and name  HA#) (resid  10 and name   HN) 5.0 3.2 0.0 !    632:10  Unique
assign (resid   8 and name   HA) (resid  10 and name   HN) 5.0 3.2 0.0 !    633:10  Unique
assign (resid   9 and name  HA#) (resid  10 and name   HN) 5.0 3.2 0.0 !    634:10  Unique
assign (resid   8 and name   HA) (resid   8 and name   HN) 7.0 5.2 0.0 !    636:10  Unique
assign (resid  11 and name   HN) (resid  10 and name   HN) 5.0 3.2 0.0 !    642:10  Unique
assign (resid   9 and name   HN) (resid  10 and name   HN) 7.0 5.2 0.0 !    644:10  Unique
assign (resid  17 and name  HA#) (resid  17 and name   HN) 5.0 3.2 0.0 !    645:10  Unique
assign (resid  17 and name  HA#) (resid  17 and name   HN) 7.0 5.2 0.0 !    646:10  Unique
assign (resid  22 and name   HA) (resid  17 and name   HN) 7.0 5.2 0.0 !    647:10  Unique
assign (resid  16 and name   HA) (resid  17 and name   HN) 5.0 3.2 0.0 !    648:10  Unique
assign (resid  10 and name   HN) (resid   9 and name   HN) 7.0 5.2 0.0 !    655:10  Unique
assign (resid   9 and name  HA#) (resid   9 and name   HN) 5.0 3.2 0.0 !    657:10  Unique
assign (resid   8 and name   HA) (resid   9 and name   HN) 5.0 3.2 0.0 !    659:10  Unique
assign (resid   9 and name  HA#) (resid   9 and name   HN) 5.0 3.2 0.0 !    660:10  Unique
assign (resid  32 and name HG2#) (resid  32 and name   HN) 5.0 3.2 0.0 !    664:10  Unique
assign (resid  59 and name  HB#) (resid  59 and name   HN) 5.0 3.2 0.0 !    668:10  Unique
assign (resid  59 and name  HB#) (resid  59 and name   HN) 3.5 1.7 0.0 !    669:10  Unique
assign (resid  31 and name  HB#) (resid  32 and name   HN) 5.0 3.2 0.0 !    670:10  Unique
assign (resid  31 and name  HB#) (resid  32 and name   HN) 5.0 3.2 0.0 !    671:10  Unique
assign (resid  32 and name   HB) (resid  32 and name   HN) 5.0 3.2 0.0 !    672:10  Unique
assign (resid  58 and name   HA) (resid  59 and name   HN) 5.0 3.2 0.0 !    673:10  Unique
assign (resid  59 and name   HA) (resid  59 and name   HN) 3.0 1.2 0.0 !    674:10  Unique
assign (resid  31 and name   HA) (resid  32 and name   HN) 3.5 1.7 0.0 !    676:10  Unique
assign (resid  32 and name   HA) (resid  32 and name   HN) 5.0 3.2 0.0 !    678:10  Unique
assign (resid  61 and name   HN) (resid  59 and name   HN) 5.0 3.2 0.0 !    680:10  Unique
assign (resid  43 and name   HB) (resid  28 and name   HN) 5.0 3.2 0.0 !    686:10  Unique
assign (resid  27 and name  HB#) (resid  28 and name   HN) 3.5 1.7 0.0 !    687:10  Unique
assign (resid  29 and name HD1#) (resid  28 and name   HN) 5.0 3.2 0.0 !    688:10  Unique
assign (resid  28 and name  HB#) (resid  28 and name   HN) 5.0 3.2 0.0 !    690:10  Unique
assign (resid  45 and name   HA) (resid  28 and name   HN) 5.0 3.2 0.0 !    691:10  Unique
assign (resid  28 and name   HA) (resid  28 and name   HN) 5.0 3.2 0.0 !    694:10  Unique
assign (resid  45 and name  HD#) (resid  28 and name   HN) 7.0 5.2 0.0 !    695:10  Unique
assign (resid  44 and name   HN) (resid  28 and name   HN) 5.0 3.2 0.0 !    699:10  Unique
!10-8-17 assign (resid  20 and name   HA) (resid  22 and name HE2#) 7.0 5.2 0.0 !    708:10  Unique
assign (resid  22 and name   HA) (resid  22 and name HE2#) 7.0 5.2 0.0 !    709:10  Unique
assign (resid  30 and name   HN) (resid  31 and name   HN) 5.0 3.2 0.0 !    719:10  Unique
assign (resid  42 and name   HN) (resid  31 and name   HN) 5.0 3.2 0.0 !    720:10  Unique
assign (resid  55 and name  HH2) (resid  31 and name   HN) 7.0 5.2 0.0 !    721:10  Unique
assign (resid  41 and name   HA) (resid  31 and name   HN) 7.0 5.2 0.0 !    723:10  Unique
assign (resid  31 and name   HA) (resid  31 and name   HN) 5.0 3.2 0.0 !    724:10  Unique
assign (resid  30 and name   HA) (resid  31 and name   HN) 7.0 5.2 0.0 !    725:10  Unique
assign (resid  31 and name  HB#) (resid  31 and name   HN) 5.0 3.2 0.0 !    728:10  Unique
assign (resid  31 and name  HB#) (resid  31 and name   HN) 7.0 5.2 0.0 !    729:10  Unique
assign (resid  30 and name  HB#) (resid  31 and name   HN) 5.0 3.2 0.0 !    730:10  Unique
assign (resid  29 and name   HB) (resid  31 and name   HN) 7.0 5.2 0.0 !    731:10  Unique
assign (resid  30 and name  HD#) (resid  31 and name   HN) 5.0 3.2 0.0 !    732:10  Unique
assign (resid  42 and name  HB#) (resid  31 and name   HN) 5.0 3.2 0.0 !    733:10  Unique
assign (resid  30 and name  HB#) (resid  31 and name   HN) 3.5 1.7 0.0 !    737:10  Unique
assign (resid  42 and name HD##) (resid  31 and name   HN) 5.0 3.2 0.0 !    739:10  Unique
assign (resid  67 and name   HN) (resid  68 and name   HN) 5.0 3.2 0.0 !    742:10  Unique
assign (resid  69 and name   HN) (resid  68 and name   HN) 5.0 3.2 0.0 !    743:10  Unique
assign (resid  67 and name   HA) (resid  68 and name   HN) 3.5 1.7 0.0 !    746:10  Unique
assign (resid  68 and name  HA#) (resid  68 and name   HN) 3.0 1.2 0.0 !    747:10  Unique
assign (resid  67 and name  HB#) (resid  68 and name   HN) 5.0 3.2 0.0 !    749:10  Unique
assign (resid  67 and name  HG#) (resid  68 and name   HN) 5.0 3.2 0.0 !    751:10  Unique
assign (resid  21 and name HG2#) (resid  21 and name   HN) 5.0 3.2 0.0 !    753:10  Unique
assign (resid  20 and name   HA) (resid  21 and name   HN) 7.0 5.2 0.0 !    754:10  Unique
assign (resid  21 and name   HA) (resid  21 and name   HN) 5.0 3.2 0.0 !    755:10  Unique
assign (resid  35 and name   HN) (resid  37 and name   HN) 5.0 3.2 0.0 !    757:10  Unique
assign (resid  36 and name   HN) (resid  37 and name   HN) 5.0 3.2 0.0 !    758:10  Unique
assign (resid  38 and name   HN) (resid  37 and name   HN) 5.0 3.2 0.0 !    760:10  Unique
assign (resid  35 and name   HA) (resid  37 and name   HN) 5.0 3.2 0.0 !    761:10  Unique
assign (resid  37 and name  HA#) (resid  37 and name   HN) 3.0 1.2 0.0 !    762:10  Unique
assign (resid  37 and name  HA#) (resid  37 and name   HN) 3.5 1.7 0.0 !    763:10  Unique
assign (resid  36 and name  HB#) (resid  37 and name   HN) 5.0 3.2 0.0 !    764:10  Unique
assign (resid  36 and name  HB#) (resid  37 and name   HN) 5.0 3.2 0.0 !    765:10  Unique
!10-8-16 assign (resid  38 and name  HB#) (resid  37 and name   HN) 7.0 5.2 0.0 !    767:10  Unique
!10-8-16 assign (resid  34 and name   HB) (resid  37 and name   HN) 7.0 5.2 0.0 !    768:10  Unique
assign (resid  34 and name HG2#) (resid  37 and name   HN) 3.5 1.7 0.0 !    769:10  Unique
assign (resid  11 and name  HE#) (resid  12 and name   HN) 7.0 5.2 0.0 !    785:10  Unique
assign (resid  36 and name   HA) (resid  37 and name   HN) 3.5 1.7 0.0 !    786:10  Unique
assign (resid  40 and name HD##) (resid  57 and name   HN) 5.0 3.2 0.0 !    792:10  Unique
assign (resid  60 and name  HG#) (resid  61 and name   HN) 7.0 5.2 0.0 !    795:10  Unique
assign (resid  60 and name  HB#) (resid  61 and name   HN) 7.0 5.2 0.0 !    797:10  Unique
assign (resid  12 and name HG##) (resid  62 and name   HN) 7.0 5.2 0.0 !    798:10  Unique
assign (resid  63 and name  HE1) (resid  59 and name   HN) 7.0 5.2 0.0 !    801:10  Unique
assign (resid  33 and name   HN) (resid  32 and name   HN) 5.0 3.2 0.0 !    802:10  Unique
assign (resid  41 and name   HN) (resid  41 and name  HD#) 7.0 5.2 0.0 !     11:25  Unique
assign (resid  40 and name   HN) (resid  41 and name  HD#) 7.0 5.2 0.0 !     12:25  Unique
assign (resid  41 and name  HE#) (resid  41 and name  HD#) 3.0 1.2 0.0 !     13:25  Unique
assign (resid  41 and name  HB#) (resid  41 and name  HD#) 5.0 3.2 0.0 !     15:25  Unique
assign (resid  41 and name  HB#) (resid  41 and name  HD#) 5.0 3.2 0.0 !     16:25  Unique
assign (resid  32 and name HG2#) (resid  41 and name  HD#) 5.0 3.2 0.0 !     17:25  Unique
assign (resid  61 and name HD1#) (resid  41 and name  HD#) 5.0 3.2 0.0 !     20:25  Unique
assign (resid  16 and name  HB#) (resid  16 and name  HD#) 5.0 3.2 0.0 !     22:25  Unique
assign (resid  16 and name  HB#) (resid  16 and name  HD#) 5.0 3.2 0.0 !     25:25  Unique
assign (resid  11 and name  HG#) (resid  46 and name  HD#) 7.0 5.2 0.0 !     26:25  Unique
assign (resid  16 and name   HA) (resid  16 and name  HD#) 5.0 3.2 0.0 !     27:25  Unique
assign (resid  25 and name  HE#) (resid  16 and name  HD#) 5.0 3.2 0.0 !     29:25  Unique
assign (resid  46 and name  HE#) (resid  46 and name  HD#) 3.0 1.2 0.0 !     30:25  Unique
assign (resid  52 and name  HE#) (resid  52 and name  HD#) 3.0 1.2 0.0 !     32:25  Unique
assign (resid  25 and name   HN) (resid  25 and name  HD#) 5.0 3.2 0.0 !     33:25  Unique
assign (resid  25 and name  HE#) (resid  25 and name  HD#) 3.0 1.2 0.0 !     34:25  Unique
assign (resid  25 and name   HA) (resid  25 and name  HD#) 5.0 3.2 0.0 !     35:25  Unique
assign (resid  25 and name  HB#) (resid  25 and name  HD#) 5.0 3.2 0.0 !     36:25  Unique
assign (resid  23 and name  HE#) (resid  25 and name  HD#) 5.0 3.2 0.0 !     37:25  Unique
assign (resid  27 and name  HB#) (resid  45 and name  HD#) 5.0 3.2 0.0 !     38:25  Unique
assign (resid  45 and name  HB#) (resid  45 and name  HD#) 5.0 3.2 0.0 !     39:25  Unique
assign (resid  25 and name  HB#) (resid  45 and name  HD#) 7.0 5.2 0.0 !     41:25  Unique
assign (resid  45 and name   HN) (resid  45 and name  HD#) 7.0 5.2 0.0 !     42:25  Unique
assign (resid  63 and name  HE1) (resid  63 and name  HD1) 3.5 1.7 0.0 !     43:25  Unique
assign (resid  63 and name   HN) (resid  63 and name  HD1) 5.0 3.2 0.0 !     44:25  Unique
assign (resid  63 and name  HB#) (resid  63 and name  HD1) 5.0 3.2 0.0 !     46:25  Unique
assign (resid  63 and name  HB#) (resid  63 and name  HD1) 7.0 5.2 0.0 !     47:25  Unique
assign (resid  63 and name  HZ3) (resid  63 and name  HH2) 3.5 1.7 0.0 !     52:25  Unique
assign (resid  63 and name  HZ2) (resid  63 and name  HH2) 3.5 1.7 0.0 !     53:25  Unique
assign (resid  29 and name   HN) (resid  63 and name  HH2) 5.0 3.2 1.0 !     54:25  Unique 10-8-16
assign (resid  29 and name HD1#) (resid  63 and name  HH2) 7.0 5.2 0.0 !     55:25  Unique
assign (resid  55 and name  HZ3) (resid  55 and name  HH2) 5.0 3.2 0.0 !     57:25  Unique
assign (resid  63 and name  HZ3) (resid  63 and name  HE3) 5.0 3.2 0.0 !     60:25  Unique
assign (resid  16 and name  HD#) (resid  25 and name  HE#) 3.5 1.7 0.0 !     70:25  Unique
assign (resid  23 and name  HG#) (resid  25 and name  HE#) 3.5 1.7 0.0 !     71:25  Unique
assign (resid  58 and name   HA) (resid  41 and name  HE#) 7.0 5.2 0.0 !     73:25  Unique
assign (resid  58 and name  HB#) (resid  41 and name  HE#) 3.5 1.7 0.0 !     74:25  Unique
assign (resid   7 and name HD##) (resid  41 and name  HE#) 3.5 1.7 0.0 !     75:25  Unique
assign (resid  39 and name HG##) (resid  41 and name  HE#) 7.0 5.2 0.0 !     76:25  Unique
assign (resid  55 and name  HB#) (resid  16 and name  HE#) 5.0 3.2 0.0 !     78:25  Unique
assign (resid  41 and name  HD#) (resid  41 and name  HE#) 3.0 1.2 0.0 !     79:25  Unique
assign (resid  23 and name  HE#) (resid  25 and name  HE#) 7.0 5.2 0.0 !     82:25  Unique
assign (resid  16 and name  HB#) (resid  25 and name  HE#) 7.0 5.2 0.0 !     83:25  Unique
assign (resid  25 and name  HD#) (resid  25 and name  HE#) 3.0 1.2 0.0 !     86:25  Unique
assign (resid  14 and name HG##) (resid  45 and name  HE#) 5.0 3.2 0.0 !     88:25  Unique
assign (resid  14 and name   HB) (resid  45 and name  HE#) 7.0 5.2 0.0 !     90:25  Unique
assign (resid  14 and name HG##) (resid  45 and name  HE#) 5.0 3.2 0.0 !     91:25  Unique
assign (resid  54 and name  HB#) (resid  45 and name  HE#) 7.0 5.2 0.0 !     92:25  Unique
assign (resid  55 and name  HE1) (resid  55 and name  HD1) 5.0 3.2 0.0 !     98:25  Unique
assign (resid  55 and name  HH2) (resid  55 and name  HZ2) 5.0 3.2 0.0 !    103:25  Unique
assign (resid  63 and name  HH2) (resid  63 and name  HZ2) 3.5 1.7 0.0 !    104:25  Unique
assign (resid  55 and name  HE1) (resid  55 and name  HZ2) 7.0 5.2 0.0 !    105:25  Unique
assign (resid  63 and name  HE1) (resid  63 and name  HZ2) 5.0 3.2 0.0 !    106:25  Unique
assign (resid  32 and name HG2#) (resid  41 and name  HE#) 7.0 5.2 0.0 !    108:25  Unique
assign (resid  42 and name HD##) (resid  55 and name  HZ2) 7.0 5.2 0.0 !    109:25  Unique
assign (resid  58 and name  HB#) (resid  63 and name  HZ2) 7.0 5.2 0.0 !    113:25  Unique
assign (resid  23 and name   HA) (resid  25 and name  HE#) 7.0 5.2 0.0 !    118:25  Unique
assign (resid  43 and name HG##) (resid  54 and name  HG#)  5.0 3.2 0.0 !   1183:20  Single
assign (resid  43 and name HG##) (resid  56 and name HG##) 3.0 1.2 0.0 !   1191:20
assign (resid  56 and name HG##) (resid  14 and name HG##) 3.0 1.6 0.0 !   1135:20
assign (resid  56 and name HG##) (resid  43 and name HG##) 3.0 1.2 0.0 !   1135:20-1
assign (resid  38 and name HG#)  (resid  40 and name HG##) 3.5 1.7 0.0 !   603:20
assign (resid  43 and name   HA) (resid  30 and name  HG#) 7.0 5.2 0.0 !   1337:20  Double

assign (resid  59 and name   HN) (resid  58 and name   HN) 2.7 0.9 0.0 !    466:10  Unique  3_10 helix
assign (resid  59 and name   HN) (resid  60 and name   HN) 2.7 0.9 0.0 !    585:10  Unique
assign (resid  60 and name   HN) (resid  59 and name   HN) 2.7 0.9 0.0 !    681:10  Unique
assign (resid  58 and name   HN) (resid  59 and name   HN) 2.7 0.9 0.0 !    682:10  Unique

assign (resid   7 and name   HN) (resid   6 and name   HA) 5.0 3.2 0.0 !    209:10
assign (resid   4 and name   HN) (resid   4 and name  HG#) 5.0 3.2 0.0 !    230:10
assign (resid  64 and name  HG#)    (resid  65 and name   HN) 5.0 3.2 0.0 !    295:10
assign (resid   2 and name   HN) (resid   2 and name  HB#)  3.5 1.7 0.0 !    358:10  Single
assign (resid  57 and name  HB#)  (resid  57 and name   HN) 5.0 3.2 0.0 !    428:10
assign (resid  61 and name   HA)  (resid  57 and name   HN)  7.0 5.2 0.0 !    435:10  Double
assign (resid   6 and name   HN) (resid   5 and name  HG#) 5.0 3.2 0.0 !    467:10  Single
assign (resid   6 and name   HN) (resid   5 and name  HB#) 5.0 3.2 0.0 !    469:10  Single
assign (resid   6 and name   HN) (resid   5 and name  HB#) 5.0 3.2 0.0 !    471:10  Single
assign (resid   6 and name   HN) (resid   6 and name   HA) 5.0 3.2 0.0 !    473:10  Single
assign (resid   8 and name   HN) (resid   7 and name   HA) 5.0 3.2 0.0 !    638:10  Single
assign (resid  58 and name  HB#) (resid  59 and name   HN)  3.0 1.2 0.0 !    666:10  Double
assign (resid  57 and name  HB#) (resid  59 and name   HN) 5.0 3.2 0.0 !    667:10  Double
!assign (resid  66 and name   HA) (resid  68 and name   HN) 7.0 5.2 0.0 !    748:10  Unique  10-8-9, for D66
assign (resid  70 and name  HG#) (resid  70 and name  HB#) 3.0 1.2 0.0 !   1504:20  Single for K67
assign (resid  69 and name HD##) (resid  69 and name   HA) 3.0 1.2 0.0 !   1466:20  Single for K67
assign (resid  61 and name HG2#) (resid  63 and name  HB#) 7.0 5.2 0.0 !   1254:20  Single for K67
assign (resid  70 and name   HN) (resid  70 and name  HB#) 3.5 1.7 0.0 !    417:10  Single for K67
assign (resid  60 and name   HA) (resid  59 and name  HB#) 5.0 3.2 0.0 !  194:20, for beta
assign (resid  12 and name HG##) (resid  29 and name HG1#) 3.5 1.7 0.0 !    973:20  Single, for beta
assign (resid  12 and name HG##) (resid  64 and name  HG#) 5.0 3.2 0.0 !    976:20  Single, for beta
assign (resid   5 and name   HA) (resid   5 and name  HG#) 3.0 1.2 0.0 !    100:20  Single
assign (resid  36 and name  HB#) (resid  36 and name   HA) 3.0 1.2 0.0 !    207:20  Double
assign (resid   4 and name  HB#) (resid   4 and name   HA) 3.0 1.2 0.0 !    295:20  Double
assign (resid   4 and name  HB#) (resid   4 and name   HA) 3.0 1.2 0.0 !    297:20  Double
assign (resid   4 and name   HA) (resid   4 and name  HG#) 3.0 1.2 0.0 !    299:20  Single
assign (resid  71 and name   HA) (resid  70 and name   HA) 5.0 3.2 0.0 !    315:20  Single
assign (resid   5 and name  HG#) (resid   5 and name  HD#) 3.0 1.2 0.0 !    334:20  Double
assign (resid   5 and name  HD#) (resid   5 and name  HG#) 3.0 1.2 0.0 !    335:20  Single
assign (resid   5 and name  HD#) (resid   5 and name  HB#) 3.5 1.7 0.0 !    336:20  Single
assign (resid   5 and name  HB#) (resid   5 and name  HD#) 3.5 1.7 0.0 !    337:20  Double
assign (resid  64 and name   HA) (resid  65 and name  HB#) 5.0 3.2 0.5 !    458:20  Double
assign (resid  64 and name   HA) (resid  65 and name  HB#) 5.0 3.2 0.5 !    461:20  Double
assign (resid   2 and name  HB#) (resid   2 and name   HA) 3.0 1.2 0.0 !    472:20  Single
assign (resid  65 and name   HA) (resid  66 and name  HB#) 3.5 1.7 0.5 !    480:20  Double, 10-8-5
assign (resid   3 and name  HG#) (resid   5 and name  HB#) 5.0 3.2 0.5 !    747:20  Unique
assign (resid   3 and name  HB#) (resid   3 and name  HG#) 3.0 1.2 0.0 !    754:20  Double
assign (resid   3 and name  HG#) (resid   3 and name  HB#) 3.5 1.7 0.0 !    755:20  Single
assign (resid   3 and name   HA) (resid   3 and name  HG#) 5.0 3.2 0.0 !    756:20  Double
assign (resid   5 and name  HB#) (resid   5 and name  HG#) 3.0 1.2 0.0 !    854:20  Double
assign (resid  32 and name HG2#) (resid  33 and name  HG#) 5.0 3.2 0.0 !   1015:20  Single
assign (resid   6 and name  HB#) (resid   8 and name HG2#) 5.0 3.2 0.5 !   1062:20  Unique
assign (resid   8 and name HG2#) (resid  30 and name   HA) 3.0 1.2 0.5 !   1063:20  Single 10-8-13, K30
!10-8-18 assign (resid   5 and name  HD#) (resid   8 and name HG2#) 5.0 3.2 0.0 !   1064:20
assign (resid  29 and name HG2#) (resid  29 and name   HN) 5.0 3.2 0.0 !   1170:20  Single
assign (resid  23 and name   HA) (resid  23 and name  HG#)  5.0 3.2 0.0 !   1341:20  Double
assign (resid   5 and name  HD#) (resid   4 and name  HG#) 3.5 1.7 0.3 !   1368:20  Double 10-8-16
assign (resid  69 and name HD##) (resid  67 and name  HE#) 3.5 1.7 0.7 !   1463:20  Single 10-8-16
assign (resid   5 and name   HA) (resid   6 and name  HB#) 7.0 5.2 0.0 !     89:20  Single
assign (resid   6 and name   HA) (resid   6 and name  HB#) 3.0 1.2 0.0 !    148:20  Single
assign (resid  67 and name   HA) (resid  67 and name  HG#) 3.5 1.7 0.0 !    191:20  Single
assign (resid  58 and name   HA) (resid  56 and name HG##) 7.0 5.2 0.0 !    222:20  Single
assign (resid   3 and name   HA) (resid   3 and name  HG#) 3.5 1.7 0.0 !    234:20  Single
assign (resid  30 and name   HA) (resid  30 and name  HD#) 3.0 1.2 0.0 !    242:20  Single
assign (resid  38 and name   HA) (resid  38 and name  HB#) 3.0 1.2 0.0 !    276:20  Single
assign (resid  33 and name   HA) (resid  33 and name  HG#) 3.5 1.7 0.0 !    277:20  Single
assign (resid  54 and name   HA) (resid  54 and name  HB#) 3.0 1.2 0.0 !    280:20  Single
assign (resid  23 and name   HA) (resid  23 and name  HD#) 3.5 1.7 0.5 !    298:20  Single  10-8-16
assign (resid  23 and name  HB#) (resid  23 and name  HD#) 3.0 1.2 0.0 !    594:20  Single
assign (resid  54 and name  HG#) (resid  56 and name HG##) 5.0 3.2 0.0 !    637:20  Single
assign (resid  54 and name  HG#) (resid  54 and name  HB#) 3.0 1.2 0.0 !    641:20  Single
assign (resid  54 and name  HB#) (resid  56 and name HG##) 5.0 3.2 0.0 !    708:20  Single
assign (resid  51 and name  HG#) (resid  51 and name  HD#) 5.0 3.2 0.0 !    890:20  Single
assign (resid  42 and name HD##) (resid  30 and name  HG#) 5.0 3.2 0.0 !    905:20  Single
assign (resid  40 and name HD##) (resid  38 and name  HB#) 5.0 3.2 0.0 !    960:20  Single
assign (resid  10 and name HG2#) (resid  64 and name  HG#) 5.0 3.2 0.0 !   1001:20  Single
assign (resid  14 and name HG##) (resid  15 and name  HB#) 5.0 3.2 0.0 !   1028:20  Single
assign (resid  15 and name   HA) (resid  24 and name HG2#) 5.0 3.2 0.0 !   1136:20  Single
assign (resid  24 and name   HA) (resid  24 and name HG2#) 3.0 1.2 0.0 !   1137:20  Single
assign (resid  25 and name   HN) (resid  24 and name HG2#) 3.0 1.2 0.0 !   1141:20  Single
assign (resid  24 and name   HN) (resid  24 and name HG2#) 5.0 3.2 0.0 !   1142:20  Single
assign (resid  14 and name   HN) (resid  24 and name HG2#) 3.5 1.7 0.0 !   1143:20  Single
assign (resid  43 and name HG##) (resid  54 and name  HB#) 5.0 3.2 0.0 !   1184:20  Single
assign (resid  62 and name HG2#) (resid  64 and name  HG#) 7.0 5.2 0.0 !   1228:20  Single
assign (resid  61 and name HD1#) (resid  56 and name HG##) 3.0 1.2 0.0 !   1289:20  Single
assign (resid  50 and name   HB) (resid  50 and name HG##) 3.0 1.2 0.0 !   1333:20  Single
assign (resid  30 and name   HN) (resid  30 and name  HG#) 5.0 3.2 0.0 !   1335:20  Single
assign (resid  34 and name HG2#) (resid  38 and name  HB#) 5.0 3.2 0.0 !   1366:20  Single
assign (resid  60 and name   HA) (resid  15 and name  HB#) 5.0 3.2 0.0 !   1415:20  Single
assign (resid  56 and name   HB) (resid  56 and name HG##) 5.0 3.2 0.0 !   1520:20  Single
assign (resid  65 and name HD##)    (resid  66 and name  HB#) 3.5 1.7 0.0 !    482:20  Double
assign (resid  30 and name  HG#)    (resid  30 and name  HE#) 3.0 1.2 0.0 !    483:20  Double
assign (resid  30 and name  HD#)    (resid  30 and name  HE#) 3.0 1.2 0.0 !    485:20  Double
assign (resid  54 and name  HB#)    (resid  54 and name  HG#) 3.0 1.2 0.0 !    633:20  Double
assign (resid  56 and name HG##)    (resid  54 and name  HG#) 3.5 1.7 0.0 !    634:20  Double 
assign (resid  33 and name  HG#) (resid  33 and name  HB#) 3.0 1.2 0.0 !    665:20  Double
assign (resid   3 and name  HG#) (resid   3 and name  HB#) 5.0 3.2 0.0 !    715:20  Double
assign (resid  15 and name  HB#)    (resid  24 and name HG1#) 3.0 1.2 0.0 !    833:20  Double
assign (resid  24 and name HG1#)    (resid  24 and name HG2#) 3.0 1.2 0.0 !   1139:20  Double
assign (resid  56 and name HG##)    (resid  60 and name  HG#) 5.0 3.2 0.0 !   1422:20  Double
assign (resid  25 and name   HN) (resid  24 and name HG2#) 5.0 3.2 0.0 !    148:10  Single
assign (resid  55 and name   HN) (resid  56 and name HG##) 7.0 5.2 0.0 !    214:10  Single
assign (resid  55 and name   HN) (resid  54 and name  HB#) 5.0 3.2 0.0 !    215:10  Single
assign (resid  55 and name   HN) (resid  54 and name  HG#) 5.0 3.2 0.0 !    216:10  Single
assign (resid  34 and name   HN) (resid  33 and name  HG#) 3.5 1.7 0.0 !    283:10  Single
assign (resid  38 and name   HN) (resid  38 and name  HB#) 3.0 1.2 0.0 !    328:10  Single
assign (resid  70 and name   HN) (resid  69 and name  HB#) 3.5 1.7 0.0 !    416:10  Single
assign (resid   6 and name   HN) (resid   6 and name  HB#) 5.0 3.2 0.0 !    470:10  Single
assign (resid  56 and name   HN) (resid  56 and name HG##) 5.0 3.2 0.0 !    479:10  Single
assign (resid  54 and name   HN) (resid  54 and name  HB#) 5.0 3.2 0.0 !    495:10  Single
assign (resid  41 and name   HN) (resid  56 and name HG##) 5.0 3.2 0.0 !    505:10  Single
assign (resid  60 and name   HN) (resid  56 and name HG##) 5.0 3.2 0.0 !    567:10  Single
assign (resid  22 and name HE2#) (resid  22 and name  HG#) 5.0 3.2 0.0 !    706:10  Single
!##:12-16,23-29,32-35,38-44,54-57  ss####

!12-17
assign (resid 11 and name c) (resid 12 and name n)
     (resid 12 and name ca) (resid 12 and name c) 1.0 -139 30.0 2
assign (resid 12 and name n) (resid 12 and name ca)
  (resid 12 and name c) (resid 13 and name n) 1.0 165.7 14.5 2  !10-8-19, 165.7 +- 7.2

assign (resid 12 and name c) (resid 13 and name n)
     (resid 13 and name ca) (resid 13 and name c) 1.0 -139 30.0 2
assign (resid 13 and name n) (resid 13 and name ca)
  (resid 13 and name c) (resid 14 and name n) 1.0 135 30.0 2

assign (resid 13 and name c) (resid 14 and name n)
     (resid 14 and name ca) (resid 14 and name c) 1.0 -139 30.0 2
assign (resid 14 and name n) (resid 14 and name ca)
  (resid 14 and name c) (resid 15 and name n) 1.0 135 30.0 2

assign (resid 14 and name c) (resid 15 and name n)
     (resid 15 and name ca) (resid 15 and name c) 1.0 -139 30.0 2
assign (resid 15 and name n) (resid 15 and name ca)
  (resid 15 and name c) (resid 16 and name n) 1.0 135 30.0 2

assign (resid 15 and name c) (resid 16 and name n)
     (resid 16 and name ca) (resid 16 and name c) 1.0 -139 30.0 2
assign (resid 16 and name n) (resid 16 and name ca)
  (resid 16 and name c) (resid 17 and name n) 1.0 135 30.0 2

assign (resid 16 and name c) (resid 17 and name n)
     (resid 17 and name ca) (resid 17 and name c) 1.0 -139 40.0 2
assign (resid 17 and name n) (resid 17 and name ca)
  (resid 17 and name c) (resid 18 and name n) 1.0 135 35.0 2

! 23-27
assign (resid 22 and name c) (resid 23 and name n)
     (resid 23 and name ca) (resid 23 and name c) 1.0 -134 30.0 2   !10-8-6; ori: -139 +- 30
assign (resid 23 and name n) (resid 23 and name ca)
  (resid 23 and name c) (resid 24 and name n) 1.0 135 30.0 2 

assign (resid 23 and name c) (resid 24 and name n)
     (resid 24 and name ca) (resid 24 and name c) 1.0 -139 30.0 2
assign (resid 24 and name n) (resid 24 and name ca)
  (resid 24 and name c) (resid 25 and name n) 1.0 135 30.0 2

assign (resid 24 and name c) (resid 25 and name n)
     (resid 25 and name ca) (resid 25 and name c) 1.0 -139 30.0 2
assign (resid 25 and name n) (resid 25 and name ca)
  (resid 25 and name c) (resid 26 and name n) 1.0 135 30.0 2

assign (resid 25 and name c) (resid 26 and name n)
     (resid 26 and name ca) (resid 26 and name c) 1.0 -139 30.0 2
assign (resid 26 and name n) (resid 26 and name ca)
  (resid 26 and name c) (resid 27 and name n) 1.0 135 30.0 2

assign (resid 26 and name c) (resid 27 and name n)
     (resid 27 and name ca) (resid 27 and name c) 1.0 -139 30.0 2
assign (resid 27 and name n) (resid 27 and name ca)
  (resid 27 and name c) (resid 28 and name n) 1.0 161 20.0 2   !10-8-19 A27

! 32-35
assign (resid 31 and name c) (resid 32 and name n)
     (resid 32 and name ca) (resid 32 and name c) 1.0 -139 30.0 2
assign (resid 32 and name n) (resid 32 and name ca)
  (resid 32 and name c) (resid 33 and name n) 1.0 135 30.0 2

assign (resid 32 and name c) (resid 33 and name n)
     (resid 33 and name ca) (resid 33 and name c) 1.0 -134 30.0 2     !10-8-6; ori: -139
assign (resid 33 and name n) (resid 33 and name ca)
  (resid 33 and name c) (resid 34 and name n) 1.0 135 30.0 2

assign (resid 33 and name c) (resid 34 and name n)
     (resid 34 and name ca) (resid 34 and name c) 1.0 -139 30.0 2
assign (resid 34 and name n) (resid 34 and name ca)
  (resid 34 and name c) (resid 35 and name n) 1.0 135 30.0 2

assign (resid 34 and name c) (resid 35 and name n)
     (resid 35 and name ca) (resid 35 and name c) 1.0 -139 30.0 2
assign (resid 35 and name n) (resid 35 and name ca)
  (resid 35 and name c) (resid 36 and name n) 1.0 135 30.0 2

!38-44
assign (resid 37 and name c) (resid 38 and name n)
     (resid 38 and name ca) (resid 38 and name c) 1.0 -139 30.0 2
assign (resid 38 and name n) (resid 38 and name ca)
  (resid 38 and name c) (resid 39 and name n) 1.0 135 30.0 2

assign (resid 38 and name c) (resid 39 and name n)
     (resid 39 and name ca) (resid 39 and name c) 1.0 -129 30.0 2
assign (resid 39 and name n) (resid 39 and name ca)
  (resid 39 and name c) (resid 40 and name n) 1.0 135 30.0 2

assign (resid 39 and name c) (resid 40 and name n)
     (resid 40 and name ca) (resid 40 and name c) 1.0 -139 30.0 2
assign (resid 40 and name n) (resid 40 and name ca)
  (resid 40 and name c) (resid 41 and name n) 1.0 135 30.0 2

assign (resid 40 and name c) (resid 41 and name n)
     (resid 41 and name ca) (resid 41 and name c) 1.0 -139 30.0 2
assign (resid 41 and name n) (resid 41 and name ca)
  (resid 41 and name c) (resid 42 and name n) 1.0 135 30.0 2

assign (resid 41 and name c) (resid 42 and name n)
     (resid 42 and name ca) (resid 42 and name c) 1.0 -139 30.0 2
assign (resid 42 and name n) (resid 42 and name ca)
  (resid 42 and name c) (resid 43 and name n) 1.0 135 30.0 2

assign (resid 42 and name c) (resid 43 and name n)
     (resid 43 and name ca) (resid 43 and name c) 1.0 -139 20.0 2
assign (resid 43 and name n) (resid 43 and name ca)
  (resid 43 and name c) (resid 44 and name n) 1.0 135 20.0 2

assign (resid 43 and name c) (resid 44 and name n)
     (resid 44 and name ca) (resid 44 and name c) 1.0 -139 20.0 2
assign (resid 44 and name n) (resid 44 and name ca)
  (resid 44 and name c) (resid 45 and name n) 1.0 135 20.0 2

assign (resid 53 and name c) (resid 54 and name n)
     (resid 54 and name ca) (resid 54 and name c) 1.0 -139 20.0 2
assign (resid 54 and name n) (resid 54 and name ca)
  (resid 54 and name c) (resid 55 and name n) 1.0 145 20.0 2 !10-8-20

assign (resid 54 and name c) (resid 55 and name n)
     (resid 55 and name ca) (resid 55 and name c) 1.0 -129 30.0 2 !10-8-20
assign (resid 55 and name n) (resid 55 and name ca)
  (resid 55 and name c) (resid 56 and name n) 1.0 135 30.0 2

assign (resid 55 and name c) (resid 56 and name n)
     (resid 56 and name ca) (resid 56 and name c) 1.0 -139 20.0 2   ! 10-8-6,ori: -139
assign (resid 56 and name n) (resid 56 and name ca)
  (resid 56 and name c) (resid 57 and name n) 1.0 135 30.0 2



!!added at 2010-7-31, according to talos
! THR 8
assign (resid 7 and name c) (resid 8 and name n)
     (resid 8 and name ca) (resid 8 and name c) 1.0 -62.2 20 2  !10-8-6, pre:-57.2
assign (resid 8 and name n) (resid 8 and name ca)
  (resid 8 and name c) (resid 9 and name n) 1.0 134.9 20 2

! THR 10
assign (resid 9 and name c) (resid 10 and name n)
     (resid 10 and name ca) (resid 10 and name c) 1.0 -72.2 20 2   !10-8-6, pre:-67.2
assign (resid 10 and name n) (resid 10 and name ca)
  (resid 10 and name c) (resid 11 and name n) 1.0 138 30 2

! ARG 18
assign (resid 17 and name c) (resid 18 and name n)
     (resid 18 and name ca) (resid 18 and name c) 1.0 -115.4 30   2
assign (resid 18 and name n) (resid 18 and name ca)
  (resid 18 and name c) (resid 19 and name n) 1.0 135.8 30 2

!GLY19  WARN !!
!assign (resid 18 and name c) (resid 19 and name n)
!     (resid 19 and name ca) (resid 19 and name c) 1.0 -72 96 2
!assign (resid 18 and name n) (resid 19 and name ca)
!  (resid 19 and name c) (resid 19 and name n) 1.0 160 58 2

! LYS 20
assign (resid 19 and name c) (resid 20 and name n)
     (resid 20 and name ca) (resid 20 and name c) 1.0 -66.1 28 2
assign (resid 20 and name n) (resid 20 and name ca)
  (resid 20 and name c) (resid 21 and name n) 1.0 -27 20 2

! THR 21
!assign (resid 20 and name c) (resid 21 and name n)
!     (resid 21 and name ca) (resid 21 and name c) 1.0 -97.6 15   2  !10-8-13, T21 10-8-18
!assign (resid 21 and name n) (resid 21 and name ca)
!  (resid 21 and name c) (resid 22 and name n) 1.0 -2.949 15      2  !10-8-13, T21 10-8-18

! GLN 22
assign (resid 21 and name c) (resid 22 and name n)
     (resid 22 and name ca) (resid 22 and name c) 1.0 -111 40 2  !10-8-19, ori:-111 70, -139 +- 30
assign (resid 22 and name n) (resid 22 and name ca)
  (resid 22 and name c) (resid 23 and name n) 1.0 130.6 30 2  !10-8-18, ori:130.6 24.4

! Ser28
assign (resid 27 and name c) (resid 28 and name n)
       (resid 28 and name ca) (resid 28 and name c) 1.0 -134.6 30   2  !10-8-19, S28
assign (resid 28 and name n) (resid 28 and name ca)
       (resid 28 and name c) (resid 29 and name n) 1.0 150 30  2  !10-8-19, S28

! ILE 29
assign (resid 28 and name c) (resid 29 and name n)
     (resid 29 and name ca) (resid 29 and name c) 1.0 -79.5 30   2  !10-8-19, I29
assign (resid 29 and name n) (resid 29 and name ca)
  (resid 29 and name c) (resid 30 and name n) 1.0 122.6 30  2  !10-8-19, I29

! LYS 30
assign (resid 29 and name c) (resid 30 and name n)
     (resid 30 and name ca) (resid 30 and name c) 1.0 -91.5 30   2  !10-8-19, K30
assign (resid 30 and name n) (resid 30 and name ca)
  (resid 30 and name c) (resid 31 and name n) 1.0 -33.75 30  2  !10-8-19, K30

! SER 31
assign (resid 30 and name c) (resid 31 and name n)
     (resid 31 and name ca) (resid 31 and name c) 1.0 -151.1 52 2
assign (resid 31 and name n) (resid 31 and name ca)
  (resid 31 and name c) (resid 32 and name n) 1.0 162.5 20 2

! ASP36  10-8-16
assign (resid 35 and name c) (resid 36 and name n)
     (resid 36 and name ca) (resid 36 and name c) 1.0 51.9 20 2
assign (resid 36 and name n) (resid 36 and name ca)
  (resid 36 and name c) (resid 37 and name n) 1.0  43.8 20 2

! GLY 37    WARN !! # added at 2010-8-16
assign (resid 36 and name c) (resid 37 and name n)
       (resid 37 and name ca) (resid 37 and name c) 1.0 73 30 2
assign (resid 37 and name n) (resid 37 and name ca)
      (resid 37 and name c) (resid 38 and name n) 1.0 4  30 2

! TYR 45  # added at 2010-8-2
assign (resid 44 and name c) (resid 45 and name n)
      (resid 45 and name ca) (resid 45 and name c) 1.0 -79.35 25.55 2
assign (resid 45 and name n) (resid 45 and name ca)
      (resid 45 and name c) (resid 46 and name n) 1.0 127.2 25 2   !10-8-23   130.2+-20

! ASN 49  # added at 2010-8-19
assign (resid 48 and name c) (resid 49 and name n)
      (resid 49 and name ca) (resid 49 and name c) 1.0 -86.2 92 2
assign (resid 49 and name n) (resid 49 and name ca)
      (resid 49 and name c) (resid 50 and name n) 1.0 142.9 50 2

! VAL 50  # added at 2010-8-19
assign (resid 49 and name c) (resid 50 and name n)
      (resid 50 and name ca) (resid 50 and name c) 1.0 -63.7 25 2   !10-8-23  18
assign (resid 50 and name n) (resid 50 and name ca)
      (resid 50 and name c) (resid 51 and name n) 1.0 -30.75 34.5 2

! ARG 51  10-8-19
assign (resid 50 and name c) (resid 51 and name n)
     (resid 51 and name ca) (resid 51 and name c) 1.0 -78.8 30 2 !10-8-23  20
assign (resid 51 and name n) (resid 51 and name ca)
  (resid 51 and name c) (resid 52 and name n) 1.0 -22.6 33 2 ! 10-8-23  -22.6+-25

! TYR 52,  WARN !!  10-8-24
!assign (resid 51 and name c) (resid 52 and name n)
!       (resid 52 and name ca) (resid 52 and name c) 1.0 -97.6 30 2   ! 10-8-23, ori: 33
!assign (resid 52 and name n) (resid 52 and name ca)
!       (resid 52 and name c) (resid 53 and name n) 1.0 -5.9 30 2   ! 10-8-23, ori: 30

! ASP 53  # add 2010-8-23
!assign (resid 52 and name c) (resid 53 and name n)
!      (resid 53 and name ca) (resid 53 and name c) 1.0 -80.7 40 2  !10-8-23, -75.7+-40
!assign (resid 53 and name n) (resid 53 and name ca)
!      (resid 53 and name c) (resid 54 and name n) 1.0 132.1 54 2   !D:27.278

! LYS 57
assign (resid 56 and name c) (resid 57 and name n)
     (resid 57 and name ca) (resid 57 and name c) 1.0 -87 30 2  !10-8-6, ori: -77 +- 20
assign (resid 57 and name n) (resid 57 and name ca)
  (resid 57 and name c) (resid 58 and name n) 1.0 164.5 20 2

! ALA 58
assign (resid 57 and name c) (resid 58 and name n)
       (resid 58 and name ca) (resid 58 and name c) 1.0 -57.4 20 2
assign (resid 58 and name n) (resid 58 and name ca)
       (resid 58 and name c) (resid 59 and name n) 1.0 -33.6 20 2

! ASP 59
assign (resid 58 and name c) (resid 59 and name n)
     (resid 59 and name ca) (resid 59 and name c) 1.0 -65.6 20 2
assign (resid 59 and name n) (resid 59 and name ca)
  (resid 59 and name c) (resid 60 and name n) 1.0 -22.75 20 2

! ARG 60
assign (resid 59 and name c) (resid 60 and name n)
       (resid 60 and name ca) (resid 60 and name c) 1.0 -95.15 20 2
assign (resid 60 and name n) (resid 60 and name ca)
       (resid 60 and name c) (resid 61 and name n) 1.0 -8.4 20 2

! ILE 61
assign (resid 60 and name c) (resid 61 and name n)
     (resid 61 and name ca) (resid 61 and name c) 1.0 -139 30 2   !10-8-6, ori:-76.1 70
assign (resid 61 and name n) (resid 61 and name ca)
  (resid 61 and name c) (resid 62 and name n) 1.0 135 30 2  !10-8-6, ori: 126.15 22.05

! ILE 62
assign (resid 61 and name c) (resid 62 and name n)
     (resid 62 and name ca) (resid 62 and name c) 1.0 -139 30 2  !10-8-6, ori:-102.9 34.4
assign (resid 62 and name n) (resid 62 and name ca)
  (resid 62 and name c) (resid 63 and name n) 1.0 135 30 2  !10-8-6, ori:122.75 21.85

! TRP 63  del 10-8-13
assign (resid 62 and name c) (resid 63 and name n)
       (resid 63 and name ca) (resid 63 and name c) 1.0 -81.5 30 2  !10-8-6, ori:81.55 19.44
assign (resid 63 and name n) (resid 63 and name ca)
       (resid 63 and name c) (resid 64 and name n) 1.0 129 30 2  !10-8-6, ori:129.15 24.37

! PRO 64
assign (resid 63 and name c) (resid 64 and name n)
       (resid 64 and name ca) (resid 64 and name c) 1.0 -66.5 30 2
assign (resid 64 and name n) (resid 64 and name ca)
       (resid 64 and name c) (resid 65 and name n) 1.0 150.2 30 2 ! 10-8-20

! LEU 65  , 10-8-10  WARN !!
!assign (resid 64 and name c) (resid 65 and name n)
! (resid 65 and name ca) (resid 65 and name c) 1.0 -98.5 30 2
!assign (resid 65 and name n) (resid 65 and name ca)
! (resid 65 and name c) (resid 66 and name n) 1.0 135.6 30 2

! ASP 66, 10-8-10  WARN !!
!assign (resid 65 and name c) (resid 66 and name n)
!       (resid 66 and name ca) (resid 66 and name c) 1.0 -98 70 2
!assign (resid 66 and name n) (resid 66 and name ca)
!       (resid 66 and name c) (resid 67 and name n) 1.0 132.5 30 2

! GLU 70, 10-8-20  WARN !!
!assign (resid 69 and name c) (resid 70 and name n)
!       (resid 70 and name ca) (resid 70 and name c) 1.0 -105.6 30 2
!assign (resid 70 and name n) (resid 70 and name ca)
!       (resid 70 and name c) (resid 71 and name n) 1.0 3.5 30 2

! HIS 71
assign (resid 70 and name c) (resid 71 and name n)
       (resid 71 and name ca) (resid 71 and name c) 1.0 -109.1 70 2
assign (resid 71 and name n) (resid 71 and name ca)
       (resid 71 and name c) (resid 72 and name n) 1.0 100.8 61.3 2

! HIS 72
assign (resid 71 and name c) (resid 72 and name n)
       (resid 72 and name ca) (resid 72 and name c) 1.0 -69.65 32.65 2
assign (resid 72 and name n) (resid 72 and name ca)
       (resid 72 and name c) (resid 73 and name n) 1.0 -23.5 30 2
assign (resid 12 and name O ) (resid 27 and name HN ) 2.3 0.5 0.0
assign (resid 12 and name O ) (resid 27 and name N ) 3.3 0.8 0.0
assign (resid 12 and name HN ) (resid 27 and name O ) 2.3 0.5 0.0
assign (resid 12 and name N ) (resid 27 and name O ) 3.3 0.8 0.0
assign (resid 14 and name HN ) (resid 25 and name O ) 2.3 0.7 0.0
assign (resid 14 and name N ) (resid 25 and name O ) 3.3 0.8 0.0
assign (resid 14 and name O ) (resid 25 and name HN ) 2.3 0.5 0.0
assign (resid 14 and name O ) (resid 25 and name N ) 3.3 0.8 0.0
assign (resid 16 and name HN ) (resid 23 and name O ) 2.3 0.5 0.0
assign (resid 16 and name N ) (resid 23 and name O ) 3.3 0.8 0.0
assign (resid 16 and name O ) (resid 23 and name HN ) 2.3 0.5 0.0
assign (resid 16 and name O ) (resid 23 and name N ) 3.3 0.8 0.0

assign (resid 33 and name HN ) (resid 40 and name O ) 2.3 0.5 0.0
assign (resid 33 and name N ) (resid 40 and name O ) 3.3 0.8 0.0
assign (resid 33 and name O ) (resid 40 and name HN ) 2.3 0.5 0.0
assign (resid 33 and name O ) (resid 40 and name N ) 3.3 0.8 0.0

assign (resid 41 and name HN ) (resid 56 and name O ) 2.3 0.5 0.0
assign (resid 41 and name N ) (resid 56 and name O ) 3.3 0.8 0.0
assign (resid 41 and name O ) (resid 56 and name HN ) 2.3 0.5 0.0
assign (resid 41 and name O ) (resid 56 and name N ) 3.3 0.8 0.0
assign (resid 43 and name HN ) (resid 54 and name O ) 2.3 0.5 0.0
assign (resid 43 and name N ) (resid 54 and name O ) 3.3 0.8 0.0
assign (resid 43 and name O ) (resid 54 and name HN ) 2.3 0.5 0.0
assign (resid 43 and name O ) (resid 54 and name N ) 3.3 0.8 0.0

assign (resid 44 and name HN ) (resid 28 and name O ) 2.3 0.5 0.0
assign (resid 44 and name N ) (resid 28 and name O ) 3.3 0.8 0.0
assign (resid 44 and name O ) (resid 28 and name HN ) 2.3 0.5 0.0
assign (resid 44 and name O ) (resid 28 and name N ) 3.3 0.8 0.0

assign (resid 35 and name HN ) (resid 38 and name O ) 2.3 0.5 0.0
assign (resid 35 and name N ) (resid 38 and name O ) 3.3 0.8 0.0
!assign (resid 35 and name O ) (resid 38 and name HN ) 2.3 0.5 0.0
!assign (resid 35 and name O ) (resid 38 and name N ) 3.3 0.8 0.0

!3_10 helix
assign (resid 60 and name HN ) (resid 57 and name O ) 2.3 0.5 0.0
assign (resid 60 and name N ) (resid 57 and name O ) 3.3 0.8 0.0

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   GLU   1           HT1      GLU   1   6.862 -15.235 -19.377
    2    H2   GLU   1           HT2      GLU   1   8.438 -14.737 -19.122
    3    H3   GLU   1           HT3      GLU   1   8.021 -15.488 -20.585
    4    HA   GLU   1           HA       GLU   1   8.286 -13.102 -20.797
    5    HB2  GLU   1           HB2      GLU   1   5.419 -14.042 -21.062
    6    HB3  GLU   1           HB1      GLU   1   6.109 -12.647 -21.872
    7    HG2  GLU   1           HG2      GLU   1   6.799 -15.539 -22.309
    8    HG3  GLU   1           HG1      GLU   1   6.015 -14.434 -23.436
    9    H    ASP   2           HN       ASP   2   8.257 -11.256 -19.728
   10    HA   ASP   2           HA       ASP   2   6.249 -10.755 -17.660
   11    HB2  ASP   2           HB2      ASP   2   9.237 -10.823 -17.186
   12    HB3  ASP   2           HB1      ASP   2   8.129  -9.969 -16.136
   13    H    MET   3           HN       MET   3   6.764  -8.562 -16.724
   14    HA   MET   3           HA       MET   3   8.343  -6.768 -18.276
   15    HB2  MET   3           HB2      MET   3   6.638  -5.172 -18.789
   16    HB3  MET   3           HB1      MET   3   5.899  -6.690 -19.242
   17    HG2  MET   3           HG2      MET   3   5.394  -5.194 -16.670
   18    HG3  MET   3           HG1      MET   3   4.361  -5.146 -18.089
   19    HE1  MET   3           HE1      MET   3   2.948  -7.201 -18.948
   20    HE2  MET   3           HE2      MET   3   2.955  -8.791 -18.185
   21    HE3  MET   3           HE3      MET   3   4.393  -8.214 -19.021
   22    H    GLU   4           HN       GLU   4   8.515  -4.716 -16.905
   23    HA   GLU   4           HA       GLU   4   8.711  -5.549 -14.202
   24    HB2  GLU   4           HB2      GLU   4   9.221  -2.867 -15.482
   25    HB3  GLU   4           HB1      GLU   4   9.523  -3.224 -13.788
   26    HG2  GLU   4           HG2      GLU   4  11.049  -5.079 -14.604
   27    HG3  GLU   4           HG1      GLU   4  10.902  -4.349 -16.205
   28    HA   PRO   5           HA       PRO   5   4.513  -4.259 -13.340
   29    HB2  PRO   5           HB2      PRO   5   5.163  -4.983 -10.561
   30    HB3  PRO   5           HB1      PRO   5   3.937  -5.667 -11.634
   31    HG2  PRO   5           HG2      PRO   5   6.114  -7.060 -10.970
   32    HG3  PRO   5           HG1      PRO   5   5.409  -7.145 -12.599
   33    HD2  PRO   5           HD2      PRO   5   7.779  -5.560 -11.661
   34    HD3  PRO   5           HD1      PRO   5   7.581  -6.594 -13.105
   35    H    CYS   6           HN       CYS   6   3.542  -2.938 -11.424
   36    HA   CYS   6           HA       CYS   6   5.046  -0.496 -11.389
   37    HB2  CYS   6           HB2      CYS   6   2.354  -1.061 -10.158
   38    HB3  CYS   6           HB1      CYS   6   3.056   0.506 -10.512
   39    HG   CYS   6           HG       CYS   6   2.436  -1.709 -13.033
   40    H    LEU   7           HN       LEU   7   6.733  -0.909 -10.080
   41    HA   LEU   7           HA       LEU   7   7.908  -1.425  -8.330
   42    HB2  LEU   7           HB2      LEU   7   7.700   0.230  -6.378
   43    HB3  LEU   7           HB1      LEU   7   8.051   0.838  -7.964
   44    HG   LEU   7           HG       LEU   7   6.623   2.350  -6.722
   45   HD11  LEU   7          HD11      LEU   7   5.142   1.142  -9.017
   46   HD12  LEU   7          HD12      LEU   7   6.292   2.481  -9.063
   47   HD13  LEU   7          HD13      LEU   7   4.731   2.674  -8.258
   48   HD21  LEU   7          HD21      LEU   7   5.495   0.877  -5.224
   49   HD22  LEU   7          HD22      LEU   7   4.688   0.081  -6.569
   50   HD23  LEU   7          HD23      LEU   7   4.280   1.753  -6.166
   51    H    THR   8           HN       THR   8   6.825  -3.537  -8.368
   52    HA   THR   8           HA       THR   8   5.400  -4.283  -6.067
   53    HB   THR   8           HB       THR   8   6.262  -6.579  -7.114
   54    HG1  THR   8           HG1      THR   8   7.527  -6.019  -8.773
   55   HG21  THR   8          HG21      THR   8   4.196  -4.763  -8.386
   56   HG22  THR   8          HG22      THR   8   3.913  -5.822  -7.006
   57   HG23  THR   8          HG23      THR   8   4.283  -6.512  -8.587
   58    H    GLY   9           HN       GLY   9   6.158  -5.707  -4.408
   59    HA2  GLY   9           HA2      GLY   9   7.832  -6.757  -3.144
   60    HA3  GLY   9           HA1      GLY   9   9.046  -5.874  -4.069
   61    H    THR  10           HN       THR  10   6.893  -3.609  -3.556
   62    HA   THR  10           HA       THR  10   8.316  -2.538  -1.275
   63    HB   THR  10           HB       THR  10   6.085  -1.249  -2.757
   64    HG1  THR  10           HG1      THR  10   7.297  -1.349  -4.501
   65   HG21  THR  10          HG21      THR  10   6.930  -0.101  -0.784
   66   HG22  THR  10          HG22      THR  10   7.353   0.818  -2.227
   67   HG23  THR  10          HG23      THR  10   8.575  -0.166  -1.422
   68    H    LYS  11           HN       LYS  11   7.431  -3.019   0.673
   69    HA   LYS  11           HA       LYS  11   4.537  -3.129   0.761
   70    HB2  LYS  11           HB2      LYS  11   4.573  -4.152   2.907
   71    HB3  LYS  11           HB1      LYS  11   5.802  -4.988   1.988
   72    HG2  LYS  11           HG2      LYS  11   7.548  -3.952   3.207
   73    HG3  LYS  11           HG1      LYS  11   6.447  -2.746   3.886
   74    HD2  LYS  11           HD2      LYS  11   5.231  -4.567   5.045
   75    HD3  LYS  11           HD1      LYS  11   6.424  -5.711   4.437
   76    HE2  LYS  11           HE2      LYS  11   8.172  -4.614   5.678
   77    HE3  LYS  11           HE1      LYS  11   7.059  -3.331   6.168
   78    HZ1  LYS  11           HZ1      LYS  11   5.812  -4.880   7.464
   79    HZ2  LYS  11           HZ2      LYS  11   7.452  -5.076   7.878
   80    HZ3  LYS  11           HZ3      LYS  11   6.708  -6.181   6.868
   81    H    VAL  12           HN       VAL  12   3.419  -1.703   1.758
   82    HA   VAL  12           HA       VAL  12   4.797   0.664   2.771
   83    HB   VAL  12           HB       VAL  12   3.093   2.033   1.636
   84   HG11  VAL  12          HG11      VAL  12   4.489   0.156  -0.264
   85   HG12  VAL  12          HG12      VAL  12   5.208   1.581   0.466
   86   HG13  VAL  12          HG13      VAL  12   3.867   1.755  -0.666
   87   HG21  VAL  12          HG21      VAL  12   1.322   0.343   1.600
   88   HG22  VAL  12          HG22      VAL  12   2.189  -0.538   0.338
   89   HG23  VAL  12          HG23      VAL  12   1.561   1.084   0.019
   90    H    LYS  13           HN       LYS  13   2.995   2.066   3.750
   91    HA   LYS  13           HA       LYS  13   1.373   0.365   5.503
   92    HB2  LYS  13           HB2      LYS  13   3.251   2.439   5.952
   93    HB3  LYS  13           HB1      LYS  13   1.656   3.109   6.259
   94    HG2  LYS  13           HG2      LYS  13   2.682   0.615   7.552
   95    HG3  LYS  13           HG1      LYS  13   2.812   2.234   8.268
   96    HD2  LYS  13           HD2      LYS  13   0.315   2.366   7.948
   97    HD3  LYS  13           HD1      LYS  13   0.363   0.629   7.638
   98    HE2  LYS  13           HE2      LYS  13   1.353   2.017  10.108
   99    HE3  LYS  13           HE1      LYS  13  -0.168   1.151   9.972
  100    HZ1  LYS  13           HZ1      LYS  13   2.525  -0.088   9.685
  101    HZ2  LYS  13           HZ2      LYS  13   1.029  -0.892   9.621
  102    HZ3  LYS  13           HZ3      LYS  13   1.528  -0.180  11.037
  103    H    VAL  14           HN       VAL  14  -0.846   0.685   5.293
  104    HA   VAL  14           HA       VAL  14  -1.704   2.862   3.486
  105    HB   VAL  14           HB       VAL  14  -2.720   0.003   3.547
  106   HG11  VAL  14          HG11      VAL  14  -3.670   2.321   1.879
  107   HG12  VAL  14          HG12      VAL  14  -4.576   1.517   3.160
  108   HG13  VAL  14          HG13      VAL  14  -4.173   0.642   1.680
  109   HG21  VAL  14          HG21      VAL  14  -1.925  -0.081   1.228
  110   HG22  VAL  14          HG22      VAL  14  -0.636   0.215   2.391
  111   HG23  VAL  14          HG23      VAL  14  -1.257   1.545   1.408
  112    H    LYS  15           HN       LYS  15  -3.429   4.023   4.117
  113    HA   LYS  15           HA       LYS  15  -4.864   3.167   6.533
  114    HB2  LYS  15           HB2      LYS  15  -3.683   5.340   6.697
  115    HB3  LYS  15           HB1      LYS  15  -4.584   5.909   5.289
  116    HG2  LYS  15           HG2      LYS  15  -6.668   5.732   6.545
  117    HG3  LYS  15           HG1      LYS  15  -5.786   5.143   7.952
  118    HD2  LYS  15           HD2      LYS  15  -5.377   7.840   6.653
  119    HD3  LYS  15           HD1      LYS  15  -6.360   7.553   8.090
  120    HE2  LYS  15           HE2      LYS  15  -4.383   6.734   9.273
  121    HE3  LYS  15           HE1      LYS  15  -3.398   7.008   7.839
  122    HZ1  LYS  15           HZ1      LYS  15  -4.851   9.117   9.325
  123    HZ2  LYS  15           HZ2      LYS  15  -3.809   9.345   8.006
  124    HZ3  LYS  15           HZ3      LYS  15  -3.204   8.777   9.478
  125    H    TYR  16           HN       TYR  16  -7.113   3.184   6.458
  126    HA   TYR  16           HA       TYR  16  -8.526   3.935   4.033
  127    HB2  TYR  16           HB2      TYR  16  -7.616   1.508   3.831
  128    HB3  TYR  16           HB1      TYR  16  -8.720   1.163   5.156
  129    HD1  TYR  16           HD1      TYR  16  -8.523   2.156   1.616
  130    HD2  TYR  16           HD2      TYR  16 -11.030   0.822   4.767
  131    HE1  TYR  16           HE1      TYR  16 -10.276   1.621  -0.035
  132    HE2  TYR  16           HE2      TYR  16 -12.808   0.290   3.135
  133    HH   TYR  16           HH       TYR  16 -12.205   0.044  -0.140
  134    H    GLY  17           HN       GLY  17 -10.179   5.101   4.973
  135    HA2  GLY  17           HA2      GLY  17 -11.410   3.946   7.358
  136    HA3  GLY  17           HA1      GLY  17 -10.864   5.612   7.392
  137    H    ARG  18           HN       ARG  18 -13.364   3.565   6.884
  138    HA   ARG  18           HA       ARG  18 -15.057   5.783   6.235
  139    HB2  ARG  18           HB2      ARG  18 -16.369   4.401   4.570
  140    HB3  ARG  18           HB1      ARG  18 -14.814   4.985   4.014
  141    HG2  ARG  18           HG2      ARG  18 -13.849   2.760   4.415
  142    HG3  ARG  18           HG1      ARG  18 -15.419   2.186   4.963
  143    HD2  ARG  18           HD2      ARG  18 -14.978   1.598   2.627
  144    HD3  ARG  18           HD1      ARG  18 -16.387   2.640   2.795
  145    HE   ARG  18           HE       ARG  18 -14.303   4.350   2.319
  146   HH11  ARG  18          HH11      ARG  18 -15.650   1.581   0.601
  147   HH12  ARG  18          HH12      ARG  18 -15.270   2.186  -0.952
  148   HH21  ARG  18          HH21      ARG  18 -13.793   5.176   0.168
  149   HH22  ARG  18          HH22      ARG  18 -14.219   4.241  -1.182
  150    H    GLY  19           HN       GLY  19 -16.211   5.852   7.979
  151    HA2  GLY  19           HA2      GLY  19 -17.847   5.279   9.467
  152    HA3  GLY  19           HA1      GLY  19 -18.043   3.758   8.607
  153    H    LYS  20           HN       LYS  20 -17.665   2.086   9.799
  154    HA   LYS  20           HA       LYS  20 -16.011   2.246  12.181
  155    HB2  LYS  20           HB2      LYS  20 -17.476  -0.091  10.967
  156    HB3  LYS  20           HB1      LYS  20 -16.730  -0.077  12.550
  157    HG2  LYS  20           HG2      LYS  20 -18.336   1.648  13.265
  158    HG3  LYS  20           HG1      LYS  20 -19.102   1.565  11.677
  159    HD2  LYS  20           HD2      LYS  20 -18.869  -0.701  13.667
  160    HD3  LYS  20           HD1      LYS  20 -20.336   0.206  13.306
  161    HE2  LYS  20           HE2      LYS  20 -20.207  -0.608  10.962
  162    HE3  LYS  20           HE1      LYS  20 -18.780  -1.536  11.403
  163    HZ1  LYS  20           HZ1      LYS  20 -20.727  -2.898  11.387
  164    HZ2  LYS  20           HZ2      LYS  20 -21.494  -1.926  12.522
  165    HZ3  LYS  20           HZ3      LYS  20 -20.113  -2.798  12.943
  166    H    THR  21           HN       THR  21 -15.831   1.332   8.908
  167    HA   THR  21           HA       THR  21 -13.633  -0.481   9.242
  168    HB   THR  21           HB       THR  21 -14.831   0.704   6.715
  169    HG1  THR  21           HG1      THR  21 -16.143  -0.647   8.136
  170   HG21  THR  21          HG21      THR  21 -12.547  -0.146   6.352
  171   HG22  THR  21          HG22      THR  21 -13.736  -1.183   5.563
  172   HG23  THR  21          HG23      THR  21 -12.992  -1.692   7.082
  173    H    GLN  22           HN       GLN  22 -12.395   1.010  10.429
  174    HA   GLN  22           HA       GLN  22 -10.735   2.757   8.740
  175    HB2  GLN  22           HB2      GLN  22 -12.062   4.189  10.157
  176    HB3  GLN  22           HB1      GLN  22 -11.694   3.217  11.568
  177    HG2  GLN  22           HG2      GLN  22 -10.389   5.226  11.684
  178    HG3  GLN  22           HG1      GLN  22  -9.325   3.861  11.330
  179   HE21  GLN  22          HE21      GLN  22  -8.212   3.806   9.393
  180   HE22  GLN  22          HE22      GLN  22  -8.239   5.144   8.299
  181    H    LYS  23           HN       LYS  23  -8.943   1.665   8.496
  182    HA   LYS  23           HA       LYS  23  -7.570   0.778  10.896
  183    HB2  LYS  23           HB2      LYS  23  -7.773  -0.877   8.375
  184    HB3  LYS  23           HB1      LYS  23  -6.664  -1.189   9.692
  185    HG2  LYS  23           HG2      LYS  23  -8.338  -2.712  10.052
  186    HG3  LYS  23           HG1      LYS  23  -8.789  -1.333  11.071
  187    HD2  LYS  23           HD2      LYS  23 -10.465  -0.630   9.596
  188    HD3  LYS  23           HD1      LYS  23  -9.879  -1.686   8.307
  189    HE2  LYS  23           HE2      LYS  23 -11.862  -2.606   9.343
  190    HE3  LYS  23           HE1      LYS  23 -10.418  -3.601   9.586
  191    HZ1  LYS  23           HZ1      LYS  23 -11.740  -3.412  11.615
  192    HZ2  LYS  23           HZ2      LYS  23 -11.535  -1.753  11.673
  193    HZ3  LYS  23           HZ3      LYS  23 -10.214  -2.779  11.819
  194    H    ILE  24           HN       ILE  24  -5.323   0.472  10.501
  195    HA   ILE  24           HA       ILE  24  -4.327   1.695   8.074
  196    HB   ILE  24           HB       ILE  24  -2.893   1.961  10.774
  197   HG12  ILE  24          HG12      ILE  24  -3.460   4.493  10.496
  198   HG13  ILE  24          HG11      ILE  24  -4.724   3.947   9.409
  199   HG21  ILE  24          HG21      ILE  24  -1.502   3.575   9.588
  200   HG22  ILE  24          HG22      ILE  24  -2.516   3.394   8.157
  201   HG23  ILE  24          HG23      ILE  24  -1.553   2.035   8.720
  202   HD11  ILE  24          HD11      ILE  24  -4.489   3.243  12.336
  203   HD12  ILE  24          HD12      ILE  24  -5.770   2.715  11.246
  204   HD13  ILE  24          HD13      ILE  24  -5.598   4.423  11.635
  205    H    TYR  25           HN       TYR  25  -3.403   0.162   6.995
  206    HA   TYR  25           HA       TYR  25  -2.711  -2.408   8.317
  207    HB2  TYR  25           HB2      TYR  25  -3.252  -2.090   5.379
  208    HB3  TYR  25           HB1      TYR  25  -3.318  -3.534   6.353
  209    HD1  TYR  25           HD2      TYR  25  -5.072  -0.494   5.326
  210    HD2  TYR  25           HD1      TYR  25  -5.479  -4.187   7.439
  211    HE1  TYR  25           HE2      TYR  25  -7.509  -0.302   5.212
  212    HE2  TYR  25           HE1      TYR  25  -7.905  -3.989   7.304
  213    HH   TYR  25           HH       TYR  25  -9.410  -1.712   5.261
  214    H    GLU  26           HN       GLU  26  -0.987  -3.641   7.166
  215    HA   GLU  26           HA       GLU  26   0.934  -1.950   5.745
  216    HB2  GLU  26           HB2      GLU  26   1.228  -4.592   7.207
  217    HB3  GLU  26           HB1      GLU  26   2.461  -3.985   6.117
  218    HG2  GLU  26           HG2      GLU  26   2.816  -2.064   7.537
  219    HG3  GLU  26           HG1      GLU  26   1.505  -2.565   8.599
  220    H    ALA  27           HN       ALA  27   1.157  -2.360   3.605
  221    HA   ALA  27           HA       ALA  27  -0.096  -4.773   2.519
  222    HB1  ALA  27           HB1      ALA  27  -1.788  -2.995   2.508
  223    HB2  ALA  27           HB2      ALA  27  -1.317  -3.476   0.878
  224    HB3  ALA  27           HB3      ALA  27  -0.697  -1.976   1.569
  225    H    SER  28           HN       SER  28   0.538  -5.158   0.322
  226    HA   SER  28           HA       SER  28   3.125  -3.930  -0.355
  227    HB2  SER  28           HB2      SER  28   1.945  -6.560  -1.268
  228    HB3  SER  28           HB1      SER  28   3.581  -5.965  -1.576
  229    HG   SER  28           HG       SER  28   2.998  -5.906   1.043
  230    H    ILE  29           HN       ILE  29   3.378  -3.084  -2.454
  231    HA   ILE  29           HA       ILE  29   0.925  -2.354  -3.737
  232    HB   ILE  29           HB       ILE  29   3.773  -1.887  -4.661
  233   HG12  ILE  29          HG12      ILE  29   3.379  -0.824  -2.504
  234   HG13  ILE  29          HG11      ILE  29   3.476   0.397  -3.765
  235   HG21  ILE  29          HG21      ILE  29   1.172  -0.660  -5.579
  236   HG22  ILE  29          HG22      ILE  29   2.264  -1.697  -6.511
  237   HG23  ILE  29          HG23      ILE  29   2.774  -0.080  -6.029
  238   HD11  ILE  29          HD11      ILE  29   0.990   0.491  -3.776
  239   HD12  ILE  29          HD12      ILE  29   1.726   0.979  -2.260
  240   HD13  ILE  29          HD13      ILE  29   0.985  -0.618  -2.397
  241    H    LYS  30           HN       LYS  30  -0.033  -3.240  -5.413
  242    HA   LYS  30           HA       LYS  30   1.127  -5.650  -6.622
  243    HB2  LYS  30           HB2      LYS  30  -1.640  -4.503  -6.811
  244    HB3  LYS  30           HB1      LYS  30  -1.104  -6.054  -7.446
  245    HG2  LYS  30           HG2      LYS  30  -0.406  -6.019  -4.745
  246    HG3  LYS  30           HG1      LYS  30  -2.054  -5.394  -4.845
  247    HD2  LYS  30           HD2      LYS  30  -1.050  -7.872  -6.135
  248    HD3  LYS  30           HD1      LYS  30  -1.941  -7.888  -4.611
  249    HE2  LYS  30           HE2      LYS  30  -3.783  -6.655  -5.953
  250    HE3  LYS  30           HE1      LYS  30  -2.902  -7.193  -7.379
  251    HZ1  LYS  30           HZ1      LYS  30  -4.107  -8.821  -5.264
  252    HZ2  LYS  30           HZ2      LYS  30  -3.102  -9.497  -6.440
  253    HZ3  LYS  30           HZ3      LYS  30  -4.588  -8.796  -6.883
  254    H    SER  31           HN       SER  31  -0.613  -2.702  -7.499
  255    HA   SER  31           HA       SER  31   0.895  -2.383  -9.926
  256    HB2  SER  31           HB2      SER  31  -2.104  -2.817 -10.000
  257    HB3  SER  31           HB1      SER  31  -1.077  -2.406 -11.376
  258    HG   SER  31           HG       SER  31  -0.009  -4.486 -10.216
  259    H    THR  32           HN       THR  32   0.174  -0.274 -10.996
  260    HA   THR  32           HA       THR  32  -1.300   1.501  -9.202
  261    HB   THR  32           HB       THR  32   1.000   2.546 -10.785
  262    HG1  THR  32           HG1      THR  32   1.083   0.980  -8.421
  263   HG21  THR  32          HG21      THR  32  -0.488   4.072  -9.707
  264   HG22  THR  32          HG22      THR  32   1.116   4.098  -8.932
  265   HG23  THR  32          HG23      THR  32  -0.220   3.257  -8.157
  266    H    GLU  33           HN       GLU  33  -2.516   2.939 -10.356
  267    HA   GLU  33           HA       GLU  33  -2.239   3.061 -13.245
  268    HB2  GLU  33           HB2      GLU  33  -4.790   2.125 -11.937
  269    HB3  GLU  33           HB1      GLU  33  -4.719   2.849 -13.536
  270    HG2  GLU  33           HG2      GLU  33  -3.209   1.058 -14.258
  271    HG3  GLU  33           HG1      GLU  33  -3.367   0.302 -12.672
  272    H    ILE  34           HN       ILE  34  -3.546   4.686 -14.185
  273    HA   ILE  34           HA       ILE  34  -4.087   6.846 -12.313
  274    HB   ILE  34           HB       ILE  34  -3.464   6.913 -15.261
  275   HG12  ILE  34          HG12      ILE  34  -1.535   8.407 -14.582
  276   HG13  ILE  34          HG11      ILE  34  -1.979   8.094 -12.916
  277   HG21  ILE  34          HG21      ILE  34  -3.651   9.389 -15.152
  278   HG22  ILE  34          HG22      ILE  34  -4.231   9.240 -13.492
  279   HG23  ILE  34          HG23      ILE  34  -5.176   8.567 -14.819
  280   HD11  ILE  34          HD11      ILE  34  -1.457   5.763 -13.197
  281   HD12  ILE  34          HD12      ILE  34  -0.057   6.769 -13.585
  282   HD13  ILE  34          HD13      ILE  34  -1.012   6.027 -14.884
  283    H    ASP  35           HN       ASP  35  -6.067   7.059 -11.979
  284    HA   ASP  35           HA       ASP  35  -8.016   6.200 -13.998
  285    HB2  ASP  35           HB2      ASP  35  -7.884   4.493 -12.230
  286    HB3  ASP  35           HB1      ASP  35  -8.208   5.720 -11.016
  287    H    ASP  36           HN       ASP  36  -8.764   7.950 -14.711
  288    HA   ASP  36           HA       ASP  36  -9.602   9.967 -14.972
  289    HB2  ASP  36           HB2      ASP  36 -11.553   8.914 -13.876
  290    HB3  ASP  36           HB1      ASP  36 -10.978   9.496 -12.318
  291    H    GLY  37           HN       GLY  37  -7.312  10.493 -14.635
  292    HA2  GLY  37           HA2      GLY  37  -6.117  12.471 -14.358
  293    HA3  GLY  37           HA1      GLY  37  -7.343  13.026 -13.240
  294    H    GLU  38           HN       GLU  38  -6.924  10.469 -11.601
  295    HA   GLU  38           HA       GLU  38  -4.443  11.416 -10.392
  296    HB2  GLU  38           HB2      GLU  38  -5.395  10.750  -8.206
  297    HB3  GLU  38           HB1      GLU  38  -6.167  12.125  -8.989
  298    HG2  GLU  38           HG2      GLU  38  -7.996  10.621  -9.703
  299    HG3  GLU  38           HG1      GLU  38  -7.228   9.310  -8.799
  300    H    VAL  39           HN       VAL  39  -3.343   9.873  -8.937
  301    HA   VAL  39           HA       VAL  39  -3.218   7.328 -10.370
  302    HB   VAL  39           HB       VAL  39  -1.149   8.298  -8.418
  303   HG11  VAL  39          HG11      VAL  39  -0.981   5.967  -9.014
  304   HG12  VAL  39          HG12      VAL  39   0.363   6.820  -9.754
  305   HG13  VAL  39          HG13      VAL  39  -1.018   6.346 -10.721
  306   HG21  VAL  39          HG21      VAL  39  -1.206   8.930 -11.374
  307   HG22  VAL  39          HG22      VAL  39   0.162   9.213 -10.304
  308   HG23  VAL  39          HG23      VAL  39  -1.348  10.088 -10.055
  309    H    LEU  40           HN       LEU  40  -3.947   5.632  -9.530
  310    HA   LEU  40           HA       LEU  40  -4.349   5.519  -6.633
  311    HB2  LEU  40           HB2      LEU  40  -5.931   4.127  -8.793
  312    HB3  LEU  40           HB1      LEU  40  -6.219   4.023  -7.069
  313    HG   LEU  40           HG       LEU  40  -6.610   6.457  -8.814
  314   HD11  LEU  40          HD11      LEU  40  -8.316   4.766  -9.081
  315   HD12  LEU  40          HD12      LEU  40  -8.959   6.185  -8.253
  316   HD13  LEU  40          HD13      LEU  40  -8.572   4.724  -7.337
  317   HD21  LEU  40          HD21      LEU  40  -7.034   6.134  -5.841
  318   HD22  LEU  40          HD22      LEU  40  -7.504   7.539  -6.801
  319   HD23  LEU  40          HD23      LEU  40  -5.801   7.122  -6.622
  320    H    TYR  41           HN       TYR  41  -3.772   3.662  -5.647
  321    HA   TYR  41           HA       TYR  41  -2.066   1.881  -7.218
  322    HB2  TYR  41           HB2      TYR  41  -2.017   2.638  -4.300
  323    HB3  TYR  41           HB1      TYR  41  -1.082   1.315  -4.972
  324    HD1  TYR  41           HD1      TYR  41  -1.557   4.988  -5.097
  325    HD2  TYR  41           HD2      TYR  41   0.972   1.709  -6.001
  326    HE1  TYR  41           HE1      TYR  41   0.286   6.554  -5.561
  327    HE2  TYR  41           HE2      TYR  41   2.829   3.256  -6.484
  328    HH   TYR  41           HH       TYR  41   3.107   5.606  -7.161
  329    H    LEU  42           HN       LEU  42  -2.254  -0.271  -6.864
  330    HA   LEU  42           HA       LEU  42  -4.716  -1.149  -5.527
  331    HB2  LEU  42           HB2      LEU  42  -4.003  -1.645  -8.060
  332    HB3  LEU  42           HB1      LEU  42  -2.985  -2.842  -7.306
  333    HG   LEU  42           HG       LEU  42  -5.971  -2.716  -7.435
  334   HD11  LEU  42          HD11      LEU  42  -4.896  -3.690  -9.316
  335   HD12  LEU  42          HD12      LEU  42  -5.755  -4.934  -8.414
  336   HD13  LEU  42          HD13      LEU  42  -4.003  -4.802  -8.281
  337   HD21  LEU  42          HD21      LEU  42  -4.360  -4.535  -5.625
  338   HD22  LEU  42          HD22      LEU  42  -6.058  -4.778  -6.037
  339   HD23  LEU  42          HD23      LEU  42  -5.583  -3.358  -5.130
  340    H    VAL  43           HN       VAL  43  -4.239  -1.996  -3.587
  341    HA   VAL  43           HA       VAL  43  -1.464  -2.797  -3.144
  342    HB   VAL  43           HB       VAL  43  -1.553  -1.922  -0.902
  343   HG11  VAL  43          HG11      VAL  43  -2.654   0.122  -2.784
  344   HG12  VAL  43          HG12      VAL  43  -0.969  -0.346  -2.624
  345   HG13  VAL  43          HG13      VAL  43  -1.792   0.454  -1.279
  346   HG21  VAL  43          HG21      VAL  43  -4.436  -1.171  -1.447
  347   HG22  VAL  43          HG22      VAL  43  -3.532  -0.738   0.001
  348   HG23  VAL  43          HG23      VAL  43  -3.891  -2.432  -0.342
  349    H    HIS  44           HN       HIS  44  -1.169  -4.384  -1.604
  350    HA   HIS  44           HA       HIS  44  -3.390  -6.309  -1.488
  351    HB2  HIS  44           HB2      HIS  44  -1.583  -6.898  -3.021
  352    HB3  HIS  44           HB1      HIS  44  -0.415  -6.700  -1.739
  353    HD1  HIS  44           HD1      HIS  44  -3.334  -8.936  -2.634
  354    HD2  HIS  44           HD2      HIS  44   0.089  -8.945  -0.305
  355    HE1  HIS  44           HE1      HIS  44  -3.001 -11.308  -1.968
  356    HE2  HIS  44           HE2      HIS  44  -0.698 -11.287  -0.948
  357    H    TYR  45           HN       TYR  45  -4.048  -6.494   0.498
  358    HA   TYR  45           HA       TYR  45  -2.502  -5.494   2.687
  359    HB2  TYR  45           HB2      TYR  45  -5.125  -6.972   2.669
  360    HB3  TYR  45           HB1      TYR  45  -4.401  -6.235   4.098
  361    HD1  TYR  45           HD2      TYR  45  -3.566  -3.664   3.400
  362    HD2  TYR  45           HD1      TYR  45  -6.917  -5.789   1.905
  363    HE1  TYR  45           HE2      TYR  45  -4.659  -1.533   2.858
  364    HE2  TYR  45           HE1      TYR  45  -8.024  -3.669   1.354
  365    HH   TYR  45           HH       TYR  45  -7.939  -1.361   2.073
  366    H    TYR  46           HN       TYR  46  -1.180  -6.526   3.977
  367    HA   TYR  46           HA       TYR  46  -0.595  -9.271   3.318
  368    HB2  TYR  46           HB2      TYR  46   1.118  -7.404   3.583
  369    HB3  TYR  46           HB1      TYR  46   0.782  -7.449   5.303
  370    HD1  TYR  46           HD2      TYR  46   1.207  -9.693   6.506
  371    HD2  TYR  46           HD1      TYR  46   2.707  -8.793   2.637
  372    HE1  TYR  46           HE2      TYR  46   2.902 -11.448   6.759
  373    HE2  TYR  46           HE1      TYR  46   4.414 -10.545   2.886
  374    HH   TYR  46           HH       TYR  46   4.239 -12.881   5.258
  375    H    GLY  47           HN       GLY  47  -2.160 -10.539   4.231
  376    HA2  GLY  47           HA2      GLY  47  -2.460 -11.878   6.270
  377    HA3  GLY  47           HA1      GLY  47  -2.463 -10.360   7.162
  378    H    TRP  48           HN       TRP  48  -4.055  -9.677   4.444
  379    HA   TRP  48           HA       TRP  48  -6.669 -10.442   5.539
  380    HB2  TRP  48           HB2      TRP  48  -5.821  -7.761   4.411
  381    HB3  TRP  48           HB1      TRP  48  -7.503  -8.194   4.657
  382    HD1  TRP  48           HD1      TRP  48  -8.385  -8.286   7.177
  383    HE1  TRP  48           HE1      TRP  48  -7.499  -7.236   9.353
  384    HE3  TRP  48           HE3      TRP  48  -3.618  -7.129   5.670
  385    HZ2  TRP  48           HZ2      TRP  48  -5.119  -6.071  10.304
  386    HZ3  TRP  48           HZ3      TRP  48  -2.116  -6.041   7.278
  387    HH2  TRP  48           HH2      TRP  48  -2.847  -5.528   9.545
  388    H    ASN  49           HN       ASN  49  -8.215  -9.360   3.485
  389    HA   ASN  49           HA       ASN  49  -8.632 -11.241   1.676
  390    HB2  ASN  49           HB2      ASN  49  -9.472  -9.414   0.079
  391    HB3  ASN  49           HB1      ASN  49 -10.201  -9.518   1.675
  392   HD21  ASN  49          HD21      ASN  49  -7.920  -7.734  -0.292
  393   HD22  ASN  49          HD22      ASN  49  -8.036  -6.248   0.575
  394    H    VAL  50           HN       VAL  50  -7.259 -12.346   0.628
  395    HA   VAL  50           HA       VAL  50  -4.944 -11.130  -0.586
  396    HB   VAL  50           HB       VAL  50  -4.808 -13.077   0.917
  397   HG11  VAL  50          HG11      VAL  50  -6.767 -14.277   0.266
  398   HG12  VAL  50          HG12      VAL  50  -5.334 -15.296   0.222
  399   HG13  VAL  50          HG13      VAL  50  -6.023 -14.685  -1.282
  400   HG21  VAL  50          HG21      VAL  50  -3.679 -13.546  -1.836
  401   HG22  VAL  50          HG22      VAL  50  -3.198 -14.430  -0.387
  402   HG23  VAL  50          HG23      VAL  50  -2.919 -12.695  -0.483
  403    H    ARG  51           HN       ARG  51  -8.009 -11.893  -1.762
  404    HA   ARG  51           HA       ARG  51  -6.955 -12.536  -4.438
  405    HB2  ARG  51           HB2      ARG  51  -9.555 -13.126  -3.192
  406    HB3  ARG  51           HB1      ARG  51  -9.594 -12.732  -4.898
  407    HG2  ARG  51           HG2      ARG  51  -9.477 -15.109  -4.616
  408    HG3  ARG  51           HG1      ARG  51  -7.980 -14.531  -5.328
  409    HD2  ARG  51           HD2      ARG  51  -7.552 -16.211  -3.633
  410    HD3  ARG  51           HD1      ARG  51  -6.907 -14.641  -3.155
  411    HE   ARG  51           HE       ARG  51  -8.897 -14.392  -1.748
  412   HH11  ARG  51          HH11      ARG  51  -8.013 -17.676  -2.749
  413   HH12  ARG  51          HH12      ARG  51  -8.613 -18.411  -1.344
  414   HH21  ARG  51          HH21      ARG  51  -9.728 -15.429   0.209
  415   HH22  ARG  51          HH22      ARG  51  -9.589 -17.118   0.351
  416    H    TYR  52           HN       TYR  52  -9.441 -10.346  -3.167
  417    HA   TYR  52           HA       TYR  52  -9.372  -9.025  -5.750
  418    HB2  TYR  52           HB2      TYR  52 -11.578  -9.424  -4.698
  419    HB3  TYR  52           HB1      TYR  52 -11.130  -8.343  -3.385
  420    HD1  TYR  52           HD2      TYR  52 -11.686  -8.448  -7.068
  421    HD2  TYR  52           HD1      TYR  52 -11.496  -6.009  -3.581
  422    HE1  TYR  52           HE2      TYR  52 -12.524  -6.534  -8.367
  423    HE2  TYR  52           HE1      TYR  52 -12.332  -4.090  -4.870
  424    HH   TYR  52           HH       TYR  52 -12.382  -3.352  -7.237
  425    H    ASP  53           HN       ASP  53  -8.362  -8.369  -2.515
  426    HA   ASP  53           HA       ASP  53  -7.155  -6.718  -1.579
  427    HB2  ASP  53           HB2      ASP  53  -6.128  -6.582  -4.408
  428    HB3  ASP  53           HB1      ASP  53  -5.476  -5.535  -3.153
  429    H    GLU  54           HN       GLU  54  -6.390  -4.064  -2.624
  430    HA   GLU  54           HA       GLU  54  -8.956  -2.870  -3.203
  431    HB2  GLU  54           HB2      GLU  54  -9.081  -3.215  -0.785
  432    HB3  GLU  54           HB1      GLU  54  -7.542  -2.411  -0.568
  433    HG2  GLU  54           HG2      GLU  54  -9.351  -0.970   0.114
  434    HG3  GLU  54           HG1      GLU  54  -8.563  -0.305  -1.312
  435    H    TRP  55           HN       TRP  55  -8.887  -0.624  -3.505
  436    HA   TRP  55           HA       TRP  55  -6.339   0.263  -4.619
  437    HB2  TRP  55           HB2      TRP  55  -9.186   0.935  -5.239
  438    HB3  TRP  55           HB1      TRP  55  -7.819   1.818  -5.910
  439    HD1  TRP  55           HD1      TRP  55  -9.389  -1.721  -5.993
  440    HE1  TRP  55           HE1      TRP  55  -8.712  -2.835  -8.223
  441    HE3  TRP  55           HE3      TRP  55  -6.164   1.837  -7.738
  442    HZ2  TRP  55           HZ2      TRP  55  -7.017  -2.279 -10.413
  443    HZ3  TRP  55           HZ3      TRP  55  -5.047   1.468  -9.892
  444    HH2  TRP  55           HH2      TRP  55  -5.466  -0.547 -11.200
  445    H    VAL  56           HN       VAL  56  -5.414   1.913  -3.708
  446    HA   VAL  56           HA       VAL  56  -6.996   3.857  -2.228
  447    HB   VAL  56           HB       VAL  56  -5.252   4.067  -0.484
  448   HG11  VAL  56          HG11      VAL  56  -5.681   2.002   0.760
  449   HG12  VAL  56          HG12      VAL  56  -6.325   1.261  -0.704
  450   HG13  VAL  56          HG13      VAL  56  -7.146   2.640   0.020
  451   HG21  VAL  56          HG21      VAL  56  -3.346   3.271  -1.758
  452   HG22  VAL  56          HG22      VAL  56  -4.004   1.635  -1.761
  453   HG23  VAL  56          HG23      VAL  56  -3.482   2.375  -0.250
  454    H    LYS  57           HN       LYS  57  -5.946   5.918  -2.111
  455    HA   LYS  57           HA       LYS  57  -4.375   6.384  -4.513
  456    HB2  LYS  57           HB2      LYS  57  -6.460   7.695  -3.950
  457    HB3  LYS  57           HB1      LYS  57  -5.594   8.360  -2.578
  458    HG2  LYS  57           HG2      LYS  57  -3.980   9.396  -4.126
  459    HG3  LYS  57           HG1      LYS  57  -4.879   8.756  -5.495
  460    HD2  LYS  57           HD2      LYS  57  -6.886   9.961  -4.728
  461    HD3  LYS  57           HD1      LYS  57  -5.963  10.626  -3.384
  462    HE2  LYS  57           HE2      LYS  57  -4.491  11.769  -4.954
  463    HE3  LYS  57           HE1      LYS  57  -5.368  11.046  -6.294
  464    HZ1  LYS  57           HZ1      LYS  57  -7.341  12.227  -5.640
  465    HZ2  LYS  57           HZ2      LYS  57  -6.084  13.314  -5.861
  466    HZ3  LYS  57           HZ3      LYS  57  -6.563  12.905  -4.304
  467    H    ALA  58           HN       ALA  58  -2.531   7.877  -4.305
  468    HA   ALA  58           HA       ALA  58  -0.521   6.967  -2.664
  469    HB1  ALA  58           HB1      ALA  58  -0.728   9.717  -3.857
  470    HB2  ALA  58           HB2      ALA  58  -0.274   8.278  -4.741
  471    HB3  ALA  58           HB3      ALA  58   0.758   8.866  -3.426
  472    H    ASP  59           HN       ASP  59  -2.845   9.428  -2.096
  473    HA   ASP  59           HA       ASP  59  -1.737  10.910   0.010
  474    HB2  ASP  59           HB2      ASP  59  -3.714  11.634  -1.221
  475    HB3  ASP  59           HB1      ASP  59  -4.631  10.284  -0.564
  476    H    ARG  60           HN       ARG  60  -3.610   7.936   0.040
  477    HA   ARG  60           HA       ARG  60  -3.771   7.902   2.946
  478    HB2  ARG  60           HB2      ARG  60  -5.048   6.322   0.783
  479    HB3  ARG  60           HB1      ARG  60  -4.849   5.552   2.348
  480    HG2  ARG  60           HG2      ARG  60  -6.097   7.458   3.364
  481    HG3  ARG  60           HG1      ARG  60  -6.393   8.063   1.731
  482    HD2  ARG  60           HD2      ARG  60  -7.603   6.076   1.138
  483    HD3  ARG  60           HD1      ARG  60  -7.095   5.291   2.632
  484    HE   ARG  60           HE       ARG  60  -8.422   7.198   3.697
  485   HH11  ARG  60          HH11      ARG  60  -9.357   5.459   0.766
  486   HH12  ARG  60          HH12      ARG  60 -11.011   5.722   0.927
  487   HH21  ARG  60          HH21      ARG  60 -10.754   7.496   3.999
  488   HH22  ARG  60          HH22      ARG  60 -11.837   6.870   2.844
  489    H    ILE  61           HN       ILE  61  -1.302   7.243   1.073
  490    HA   ILE  61           HA       ILE  61  -0.694   4.709   2.388
  491    HB   ILE  61           HB       ILE  61   0.613   5.910  -0.080
  492   HG12  ILE  61          HG12      ILE  61  -1.431   3.686   0.156
  493   HG13  ILE  61          HG11      ILE  61  -1.686   5.266  -0.569
  494   HG21  ILE  61          HG21      ILE  61   0.862   3.165   1.139
  495   HG22  ILE  61          HG22      ILE  61   2.090   4.433   1.199
  496   HG23  ILE  61          HG23      ILE  61   1.643   3.708  -0.349
  497   HD11  ILE  61          HD11      ILE  61  -0.028   4.708  -2.307
  498   HD12  ILE  61          HD12      ILE  61  -1.395   3.588  -2.277
  499   HD13  ILE  61          HD13      ILE  61   0.146   3.112  -1.570
  500    H    ILE  62           HN       ILE  62   1.176   4.558   3.551
  501    HA   ILE  62           HA       ILE  62   2.776   6.990   3.879
  502    HB   ILE  62           HB       ILE  62   2.754   4.517   5.644
  503   HG12  ILE  62          HG12      ILE  62   1.891   6.276   7.423
  504   HG13  ILE  62          HG11      ILE  62   1.330   7.151   6.007
  505   HG21  ILE  62          HG21      ILE  62   4.158   5.801   7.184
  506   HG22  ILE  62          HG22      ILE  62   4.176   7.127   6.016
  507   HG23  ILE  62          HG23      ILE  62   4.888   5.575   5.589
  508   HD11  ILE  62          HD11      ILE  62  -0.008   5.084   5.402
  509   HD12  ILE  62          HD12      ILE  62  -0.495   5.909   6.871
  510   HD13  ILE  62          HD13      ILE  62   0.436   4.430   6.989
  511    H    TRP  63           HN       TRP  63   4.481   6.903   2.614
  512    HA   TRP  63           HA       TRP  63   5.276   4.379   1.549
  513    HB2  TRP  63           HB2      TRP  63   6.040   7.210   0.877
  514    HB3  TRP  63           HB1      TRP  63   6.826   5.816   0.139
  515    HD1  TRP  63           HD1      TRP  63   3.613   7.827   0.025
  516    HE1  TRP  63           HE1      TRP  63   2.142   6.919  -1.873
  517    HE3  TRP  63           HE3      TRP  63   6.300   3.655  -1.141
  518    HZ2  TRP  63           HZ2      TRP  63   2.134   4.710  -3.622
  519    HZ3  TRP  63           HZ3      TRP  63   5.496   2.192  -2.936
  520    HH2  TRP  63           HH2      TRP  63   3.463   2.699  -4.146
  521    HA   PRO  64           HA       PRO  64   8.817   3.946   4.142
  522    HB2  PRO  64           HB2      PRO  64  10.139   2.643   1.835
  523    HB3  PRO  64           HB1      PRO  64   9.816   1.985   3.440
  524    HG2  PRO  64           HG2      PRO  64   8.433   1.165   1.292
  525    HG3  PRO  64           HG1      PRO  64   7.687   1.320   2.892
  526    HD2  PRO  64           HD2      PRO  64   7.497   3.154   0.538
  527    HD3  PRO  64           HD1      PRO  64   6.253   2.663   1.717
  528    H    LEU  65           HN       LEU  65  10.002   5.611   4.422
  529    HA   LEU  65           HA       LEU  65  11.966   6.680   2.718
  530    HB2  LEU  65           HB2      LEU  65   9.524   7.576   1.959
  531    HB3  LEU  65           HB1      LEU  65   9.664   8.512   3.421
  532    HG   LEU  65           HG       LEU  65  10.203   9.824   1.427
  533   HD11  LEU  65          HD11      LEU  65  12.646   9.403   3.120
  534   HD12  LEU  65          HD12      LEU  65  11.303  10.499   3.461
  535   HD13  LEU  65          HD13      LEU  65  12.333  10.774   2.061
  536   HD21  LEU  65          HD21      LEU  65  12.198   9.366   0.100
  537   HD22  LEU  65          HD22      LEU  65  11.022   8.051   0.003
  538   HD23  LEU  65          HD23      LEU  65  12.458   7.878   1.010
  539    H    ASP  66           HN       ASP  66  13.164   7.979   4.120
  540    HA   ASP  66           HA       ASP  66  12.846   7.141   6.772
  541    HB2  ASP  66           HB2      ASP  66  15.003   7.496   5.871
  542    HB3  ASP  66           HB1      ASP  66  14.683   9.222   5.688
  543    H    LYS  67           HN       LYS  67  11.362   7.779   7.993
  544    HA   LYS  67           HA       LYS  67  11.147  10.636   8.525
  545    HB2  LYS  67           HB2      LYS  67   8.818  10.301   9.343
  546    HB3  LYS  67           HB1      LYS  67   8.943   9.806   7.672
  547    HG2  LYS  67           HG2      LYS  67   9.095   7.862   9.948
  548    HG3  LYS  67           HG1      LYS  67   7.559   8.371   9.245
  549    HD2  LYS  67           HD2      LYS  67   9.700   7.368   7.475
  550    HD3  LYS  67           HD1      LYS  67   8.825   6.167   8.428
  551    HE2  LYS  67           HE2      LYS  67   7.811   6.336   6.226
  552    HE3  LYS  67           HE1      LYS  67   6.701   7.020   7.398
  553    HZ1  LYS  67           HZ1      LYS  67   6.895   8.304   5.328
  554    HZ2  LYS  67           HZ2      LYS  67   8.510   8.641   5.671
  555    HZ3  LYS  67           HZ3      LYS  67   7.292   9.214   6.672
  556    H    GLY  68           HN       GLY  68  13.046   8.718   9.386
  557    HA2  GLY  68           HA2      GLY  68  14.092   8.370  11.459
  558    HA3  GLY  68           HA1      GLY  68  12.513   8.486  12.257
  559    H    LEU  69           HN       LEU  69  13.724   6.658   9.464
  560    HA   LEU  69           HA       LEU  69  12.177   4.411  10.408
  561    HB2  LEU  69           HB2      LEU  69  11.741   5.448   8.205
  562    HB3  LEU  69           HB1      LEU  69  13.366   5.013   7.722
  563    HG   LEU  69           HG       LEU  69  12.787   2.640   7.930
  564   HD11  LEU  69          HD11      LEU  69  10.426   2.020   8.271
  565   HD12  LEU  69          HD12      LEU  69  10.065   3.730   8.600
  566   HD13  LEU  69          HD13      LEU  69  11.129   2.833   9.675
  567   HD21  LEU  69          HD21      LEU  69  12.531   3.800   5.822
  568   HD22  LEU  69          HD22      LEU  69  10.897   4.276   6.268
  569   HD23  LEU  69          HD23      LEU  69  11.274   2.567   6.001
  570    H    GLU  70           HN       GLU  70  13.080   2.495  10.638
  571    HA   GLU  70           HA       GLU  70  15.840   2.248  11.302
  572    HB2  GLU  70           HB2      GLU  70  13.617   1.086  12.165
  573    HB3  GLU  70           HB1      GLU  70  13.924  -0.026  10.855
  574    HG2  GLU  70           HG2      GLU  70  15.751   0.522  13.182
  575    HG3  GLU  70           HG1      GLU  70  14.719  -0.887  12.979
  576    H    HIS  71           HN       HIS  71  17.468   1.547   9.889
  577    HA   HIS  71           HA       HIS  71  16.748   0.053   7.451
  578    HB2  HIS  71           HB2      HIS  71  18.264   2.657   7.466
  579    HB3  HIS  71           HB1      HIS  71  18.480   1.481   6.180
  580    HD1  HIS  71           HD1      HIS  71  16.778   4.465   6.735
  581    HD2  HIS  71           HD2      HIS  71  15.622   0.805   5.167
  582    HE1  HIS  71           HE1      HIS  71  14.770   4.946   5.329
  583    HE2  HIS  71           HE2      HIS  71  14.366   2.800   4.117
  584    H    HIS  72           HN       HIS  72  18.024  -0.860   9.864
  585    HA   HIS  72           HA       HIS  72  20.803  -1.106   9.036
  586    HB2  HIS  72           HB2      HIS  72  19.437  -1.996  11.560
  587    HB3  HIS  72           HB1      HIS  72  21.095  -2.423  11.168
  588    HD1  HIS  72           HD1      HIS  72  18.957   0.422  12.194
  589    HD2  HIS  72           HD2      HIS  72  22.954  -0.369  11.508
  590    HE1  HIS  72           HE1      HIS  72  20.224   2.366  13.234
  591    HE2  HIS  72           HE2      HIS  72  22.640   1.880  12.750
  592    H    HIS  73           HN       HIS  73  18.154  -3.421   9.878
  593    HA   HIS  73           HA       HIS  73  19.276  -5.163   7.845
  594    HB2  HIS  73           HB2      HIS  73  20.642  -5.556   9.940
  595    HB3  HIS  73           HB1      HIS  73  19.188  -6.235  10.671
  596    HD1  HIS  73           HD1      HIS  73  19.386  -8.715  10.650
  597    HD2  HIS  73           HD2      HIS  73  20.969  -7.017   7.213
  598    HE1  HIS  73           HE1      HIS  73  20.156 -10.634   9.246
  599    HE2  HIS  73           HE2      HIS  73  20.749  -9.556   7.051
  600    H    HIS  74           HN       HIS  74  16.652  -3.897   8.711
  601    HA   HIS  74           HA       HIS  74  15.026  -6.339   8.533
  602    HB2  HIS  74           HB2      HIS  74  14.140  -3.454   9.030
  603    HB3  HIS  74           HB1      HIS  74  13.045  -4.806   8.822
  604    HD1  HIS  74           HD1      HIS  74  15.236  -3.135  11.360
  605    HD2  HIS  74           HD2      HIS  74  12.933  -6.594  11.030
  606    HE1  HIS  74           HE1      HIS  74  14.949  -3.982  13.683
  607    HE2  HIS  74           HE2      HIS  74  13.814  -6.203  13.417
  608    H    HIS  75           HN       HIS  75  15.582  -3.234   7.022
  609    HA   HIS  75           HA       HIS  75  15.622  -4.318   4.403
  610    HB2  HIS  75           HB2      HIS  75  13.121  -3.878   4.817
  611    HB3  HIS  75           HB1      HIS  75  13.537  -2.182   5.015
  612    HD1  HIS  75           HD1      HIS  75  14.282  -0.875   2.803
  613    HD2  HIS  75           HD2      HIS  75  13.048  -4.808   2.202
  614    HE1  HIS  75           HE1      HIS  75  13.900  -1.099   0.352
  615    HE2  HIS  75           HE2      HIS  75  13.088  -3.451   0.006
  616    H    HIS  76           HN       HIS  76  17.588  -3.485   4.185
  617    HA   HIS  76           HA       HIS  76  18.373  -1.004   5.353
  618    HB2  HIS  76           HB2      HIS  76  19.942  -2.845   5.283
  619    HB3  HIS  76           HB1      HIS  76  19.816  -2.938   3.536
  620    HD1  HIS  76           HD1      HIS  76  21.046  -0.527   6.185
  621    HD2  HIS  76           HD2      HIS  76  21.681  -1.498   2.204
  622    HE1  HIS  76           HE1      HIS  76  23.116   0.735   5.491
  623    HE2  HIS  76           HE2      HIS  76  23.566  -0.041   3.145
  Start of MODEL    2
    1    H1   GLU   1           HT1      GLU   1  13.307 -15.376 -15.279
    2    H2   GLU   1           HT2      GLU   1  13.992 -14.746 -16.686
    3    H3   GLU   1           HT3      GLU   1  12.387 -14.490 -16.382
    4    HA   GLU   1           HA       GLU   1  12.934 -13.121 -14.465
    5    HB2  GLU   1           HB2      GLU   1  15.783 -13.608 -15.402
    6    HB3  GLU   1           HB1      GLU   1  15.320 -12.443 -14.173
    7    HG2  GLU   1           HG2      GLU   1  14.552 -14.257 -12.733
    8    HG3  GLU   1           HG1      GLU   1  14.966 -15.429 -13.983
    9    H    ASP   2           HN       ASP   2  11.858 -11.576 -15.557
   10    HA   ASP   2           HA       ASP   2  13.361  -9.982 -17.479
   11    HB2  ASP   2           HB2      ASP   2  11.746 -10.059 -19.252
   12    HB3  ASP   2           HB1      ASP   2  12.149 -11.714 -18.834
   13    H    MET   3           HN       MET   3  10.504 -10.405 -15.501
   14    HA   MET   3           HA       MET   3   9.766  -7.641 -15.816
   15    HB2  MET   3           HB2      MET   3   7.974  -9.279 -15.730
   16    HB3  MET   3           HB1      MET   3   8.537  -9.855 -14.169
   17    HG2  MET   3           HG2      MET   3   6.568  -8.422 -13.954
   18    HG3  MET   3           HG1      MET   3   7.975  -7.736 -13.144
   19    HE1  MET   3           HE1      MET   3   5.360  -6.057 -13.779
   20    HE2  MET   3           HE2      MET   3   6.077  -4.549 -14.346
   21    HE3  MET   3           HE3      MET   3   6.787  -5.402 -12.978
   22    H    GLU   4           HN       GLU   4  11.138  -6.361 -14.863
   23    HA   GLU   4           HA       GLU   4  12.215  -6.876 -12.269
   24    HB2  GLU   4           HB2      GLU   4  12.249  -4.405 -14.012
   25    HB3  GLU   4           HB1      GLU   4  13.154  -4.584 -12.516
   26    HG2  GLU   4           HG2      GLU   4  14.435  -6.407 -13.485
   27    HG3  GLU   4           HG1      GLU   4  13.500  -6.290 -14.975
   28    HA   PRO   5           HA       PRO   5   8.755  -5.198 -10.007
   29    HB2  PRO   5           HB2      PRO   5  10.778  -4.151  -8.107
   30    HB3  PRO   5           HB1      PRO   5   9.409  -5.227  -7.799
   31    HG2  PRO   5           HG2      PRO   5  11.895  -6.175  -7.804
   32    HG3  PRO   5           HG1      PRO   5  10.565  -7.108  -8.515
   33    HD2  PRO   5           HD2      PRO   5  12.668  -5.474  -9.887
   34    HD3  PRO   5           HD1      PRO   5  12.002  -7.066 -10.316
   35    H    CYS   6           HN       CYS   6   7.838  -3.460 -10.889
   36    HA   CYS   6           HA       CYS   6   9.223  -0.872 -10.686
   37    HB2  CYS   6           HB2      CYS   6   8.590  -1.606 -13.017
   38    HB3  CYS   6           HB1      CYS   6   6.916  -1.655 -12.489
   39    HG   CYS   6           HG       CYS   6   8.861   1.142 -12.711
   40    H    LEU   7           HN       LEU   7   8.619  -0.311  -8.661
   41    HA   LEU   7           HA       LEU   7   7.419   0.426  -6.940
   42    HB2  LEU   7           HB2      LEU   7   5.096   0.440  -8.880
   43    HB3  LEU   7           HB1      LEU   7   4.916   0.918  -7.209
   44    HG   LEU   7           HG       LEU   7   6.574   2.766  -7.659
   45   HD11  LEU   7          HD11      LEU   7   7.645   1.875  -9.647
   46   HD12  LEU   7          HD12      LEU   7   6.926   3.454  -9.980
   47   HD13  LEU   7          HD13      LEU   7   6.128   1.983 -10.534
   48   HD21  LEU   7          HD21      LEU   7   4.193   3.154  -7.545
   49   HD22  LEU   7          HD22      LEU   7   4.022   2.755  -9.253
   50   HD23  LEU   7          HD23      LEU   7   4.928   4.190  -8.767
   51    H    THR   8           HN       THR   8   5.702  -2.062  -8.669
   52    HA   THR   8           HA       THR   8   4.329  -3.378  -6.692
   53    HB   THR   8           HB       THR   8   5.824  -4.600  -9.007
   54    HG1  THR   8           HG1      THR   8   3.776  -2.792  -8.902
   55   HG21  THR   8          HG21      THR   8   3.957  -6.215  -9.030
   56   HG22  THR   8          HG22      THR   8   3.254  -5.412  -7.624
   57   HG23  THR   8          HG23      THR   8   4.800  -6.245  -7.480
   58    H    GLY   9           HN       GLY   9   4.901  -4.773  -5.078
   59    HA2  GLY   9           HA2      GLY   9   6.320  -6.454  -4.132
   60    HA3  GLY   9           HA1      GLY   9   7.674  -5.732  -4.987
   61    H    THR  10           HN       THR  10   6.705  -3.032  -4.139
   62    HA   THR  10           HA       THR  10   8.223  -2.838  -1.729
   63    HB   THR  10           HB       THR  10   6.332  -0.804  -2.891
   64    HG1  THR  10           HG1      THR  10   7.620  -1.117  -4.573
   65   HG21  THR  10          HG21      THR  10   8.877  -0.481  -1.280
   66   HG22  THR  10          HG22      THR  10   7.233  -0.260  -0.681
   67   HG23  THR  10          HG23      THR  10   7.878   0.836  -1.902
   68    H    LYS  11           HN       LYS  11   7.416  -3.015   0.331
   69    HA   LYS  11           HA       LYS  11   4.544  -3.204   0.577
   70    HB2  LYS  11           HB2      LYS  11   4.761  -4.034   2.783
   71    HB3  LYS  11           HB1      LYS  11   6.086  -4.792   1.928
   72    HG2  LYS  11           HG2      LYS  11   7.686  -3.520   3.045
   73    HG3  LYS  11           HG1      LYS  11   6.524  -2.265   3.477
   74    HD2  LYS  11           HD2      LYS  11   5.362  -3.941   4.928
   75    HD3  LYS  11           HD1      LYS  11   6.681  -5.060   4.602
   76    HE2  LYS  11           HE2      LYS  11   8.258  -3.562   5.646
   77    HE3  LYS  11           HE1      LYS  11   7.015  -2.332   5.842
   78    HZ1  LYS  11           HZ1      LYS  11   6.983  -4.996   7.156
   79    HZ2  LYS  11           HZ2      LYS  11   5.839  -3.786   7.366
   80    HZ3  LYS  11           HZ3      LYS  11   7.423  -3.539   7.889
   81    H    VAL  12           HN       VAL  12   3.333  -1.736   1.523
   82    HA   VAL  12           HA       VAL  12   4.675   0.721   2.363
   83    HB   VAL  12           HB       VAL  12   2.844   2.037   1.331
   84   HG11  VAL  12          HG11      VAL  12   3.625   1.869  -0.977
   85   HG12  VAL  12          HG12      VAL  12   4.365   0.307  -0.615
   86   HG13  VAL  12          HG13      VAL  12   4.965   1.769   0.164
   87   HG21  VAL  12          HG21      VAL  12   1.366   1.002  -0.327
   88   HG22  VAL  12          HG22      VAL  12   1.150   0.266   1.264
   89   HG23  VAL  12          HG23      VAL  12   2.073  -0.577   0.024
   90    H    LYS  13           HN       LYS  13   2.978   2.153   3.412
   91    HA   LYS  13           HA       LYS  13   1.470   0.516   5.308
   92    HB2  LYS  13           HB2      LYS  13   3.333   2.657   5.523
   93    HB3  LYS  13           HB1      LYS  13   1.756   3.251   6.010
   94    HG2  LYS  13           HG2      LYS  13   2.925   0.752   7.116
   95    HG3  LYS  13           HG1      LYS  13   3.240   2.360   7.832
   96    HD2  LYS  13           HD2      LYS  13   0.743   2.576   7.988
   97    HD3  LYS  13           HD1      LYS  13   0.646   0.869   7.547
   98    HE2  LYS  13           HE2      LYS  13   2.157   2.003   9.871
   99    HE3  LYS  13           HE1      LYS  13   0.570   1.248   9.971
  100    HZ1  LYS  13           HZ1      LYS  13   2.403  -0.264  10.584
  101    HZ2  LYS  13           HZ2      LYS  13   3.018  -0.182   9.022
  102    HZ3  LYS  13           HZ3      LYS  13   1.475  -0.828   9.318
  103    H    VAL  14           HN       VAL  14  -0.719   0.941   5.412
  104    HA   VAL  14           HA       VAL  14  -1.719   3.013   3.588
  105    HB   VAL  14           HB       VAL  14  -2.738   0.165   3.909
  106   HG11  VAL  14          HG11      VAL  14  -4.630   1.756   3.768
  107   HG12  VAL  14          HG12      VAL  14  -4.511   0.672   2.389
  108   HG13  VAL  14          HG13      VAL  14  -3.977   2.352   2.235
  109   HG21  VAL  14          HG21      VAL  14  -0.852   0.397   2.409
  110   HG22  VAL  14          HG22      VAL  14  -1.695   1.644   1.489
  111   HG23  VAL  14          HG23      VAL  14  -2.313  -0.007   1.515
  112    H    LYS  15           HN       LYS  15  -3.494   4.112   4.277
  113    HA   LYS  15           HA       LYS  15  -4.768   3.350   6.801
  114    HB2  LYS  15           HB2      LYS  15  -2.899   5.012   7.161
  115    HB3  LYS  15           HB1      LYS  15  -3.769   6.104   6.099
  116    HG2  LYS  15           HG2      LYS  15  -5.534   6.335   7.647
  117    HG3  LYS  15           HG1      LYS  15  -4.880   5.058   8.693
  118    HD2  LYS  15           HD2      LYS  15  -2.851   6.400   8.998
  119    HD3  LYS  15           HD1      LYS  15  -3.561   7.682   8.016
  120    HE2  LYS  15           HE2      LYS  15  -5.336   7.939   9.679
  121    HE3  LYS  15           HE1      LYS  15  -4.621   6.640  10.638
  122    HZ1  LYS  15           HZ1      LYS  15  -2.635   7.976  10.949
  123    HZ2  LYS  15           HZ2      LYS  15  -3.987   8.895  11.401
  124    HZ3  LYS  15           HZ3      LYS  15  -3.240   9.163   9.933
  125    H    TYR  16           HN       TYR  16  -6.818   3.051   6.075
  126    HA   TYR  16           HA       TYR  16  -7.885   4.876   4.044
  127    HB2  TYR  16           HB2      TYR  16  -7.000   2.852   2.944
  128    HB3  TYR  16           HB1      TYR  16  -8.016   1.853   3.972
  129    HD1  TYR  16           HD2      TYR  16 -10.445   1.829   3.629
  130    HD2  TYR  16           HD1      TYR  16  -7.870   3.968   1.035
  131    HE1  TYR  16           HE2      TYR  16 -12.261   1.968   1.957
  132    HE2  TYR  16           HE1      TYR  16  -9.673   4.099  -0.665
  133    HH   TYR  16           HH       TYR  16 -11.738   2.812  -1.214
  134    H    GLY  17           HN       GLY  17  -9.558   5.830   5.111
  135    HA2  GLY  17           HA2      GLY  17 -11.906   4.485   5.300
  136    HA3  GLY  17           HA1      GLY  17 -11.374   4.607   6.952
  137    H    ARG  18           HN       ARG  18 -13.578   5.885   6.453
  138    HA   ARG  18           HA       ARG  18 -12.802   8.688   6.063
  139    HB2  ARG  18           HB2      ARG  18 -15.202   9.180   5.728
  140    HB3  ARG  18           HB1      ARG  18 -14.626   8.021   4.552
  141    HG2  ARG  18           HG2      ARG  18 -15.702   6.204   5.793
  142    HG3  ARG  18           HG1      ARG  18 -16.226   7.334   7.027
  143    HD2  ARG  18           HD2      ARG  18 -17.027   7.363   4.121
  144    HD3  ARG  18           HD1      ARG  18 -18.044   6.873   5.476
  145    HE   ARG  18           HE       ARG  18 -17.193   9.424   6.026
  146   HH11  ARG  18          HH11      ARG  18 -19.234   7.844   3.615
  147   HH12  ARG  18          HH12      ARG  18 -20.064   9.266   3.174
  148   HH21  ARG  18          HH21      ARG  18 -18.351  11.392   5.392
  149   HH22  ARG  18          HH22      ARG  18 -19.561  11.299   4.195
  150    H    GLY  19           HN       GLY  19 -12.641   9.909   7.853
  151    HA2  GLY  19           HA2      GLY  19 -12.817  10.620  10.001
  152    HA3  GLY  19           HA1      GLY  19 -14.449   9.978   9.958
  153    H    LYS  20           HN       LYS  20 -14.905   8.290  11.145
  154    HA   LYS  20           HA       LYS  20 -13.010   7.374  13.105
  155    HB2  LYS  20           HB2      LYS  20 -15.793   6.373  12.518
  156    HB3  LYS  20           HB1      LYS  20 -14.841   5.995  13.943
  157    HG2  LYS  20           HG2      LYS  20 -14.935   8.344  14.620
  158    HG3  LYS  20           HG1      LYS  20 -15.885   8.713  13.177
  159    HD2  LYS  20           HD2      LYS  20 -17.614   7.132  13.921
  160    HD3  LYS  20           HD1      LYS  20 -16.673   6.800  15.371
  161    HE2  LYS  20           HE2      LYS  20 -17.746   9.514  14.619
  162    HE3  LYS  20           HE1      LYS  20 -18.540   8.390  15.720
  163    HZ1  LYS  20           HZ1      LYS  20 -15.849   9.585  16.122
  164    HZ2  LYS  20           HZ2      LYS  20 -16.624   8.530  17.183
  165    HZ3  LYS  20           HZ3      LYS  20 -17.267  10.059  16.901
  166    H    THR  21           HN       THR  21 -14.139   6.255  10.050
  167    HA   THR  21           HA       THR  21 -13.532   3.486  10.616
  168    HB   THR  21           HB       THR  21 -14.343   3.021   8.325
  169    HG1  THR  21           HG1      THR  21 -14.819   5.823   8.179
  170   HG21  THR  21          HG21      THR  21 -16.662   3.764   8.615
  171   HG22  THR  21          HG22      THR  21 -16.141   4.900   9.849
  172   HG23  THR  21          HG23      THR  21 -15.995   3.158  10.136
  173    H    GLN  22           HN       GLN  22 -11.481   5.861  10.194
  174    HA   GLN  22           HA       GLN  22  -9.908   4.803   7.983
  175    HB2  GLN  22           HB2      GLN  22 -10.150   7.274   8.512
  176    HB3  GLN  22           HB1      GLN  22  -9.147   6.978   9.924
  177    HG2  GLN  22           HG2      GLN  22  -7.323   6.279   8.541
  178    HG3  GLN  22           HG1      GLN  22  -8.310   6.417   7.085
  179   HE21  GLN  22          HE21      GLN  22  -6.988   7.941   6.123
  180   HE22  GLN  22          HE22      GLN  22  -6.893   9.574   6.673
  181    H    LYS  23           HN       LYS  23  -9.134   2.897   8.341
  182    HA   LYS  23           HA       LYS  23  -7.575   2.603  10.789
  183    HB2  LYS  23           HB2      LYS  23  -7.804   0.072  10.559
  184    HB3  LYS  23           HB1      LYS  23  -9.320   0.931  10.802
  185    HG2  LYS  23           HG2      LYS  23  -8.549   0.281   8.063
  186    HG3  LYS  23           HG1      LYS  23  -9.116  -1.003   9.137
  187    HD2  LYS  23           HD2      LYS  23 -11.081   0.290   9.683
  188    HD3  LYS  23           HD1      LYS  23 -10.519   1.604   8.652
  189    HE2  LYS  23           HE2      LYS  23 -12.126   0.389   7.488
  190    HE3  LYS  23           HE1      LYS  23 -10.495   0.088   6.831
  191    HZ1  LYS  23           HZ1      LYS  23 -10.433  -2.054   7.737
  192    HZ2  LYS  23           HZ2      LYS  23 -11.989  -1.955   7.082
  193    HZ3  LYS  23           HZ3      LYS  23 -11.759  -1.780   8.743
  194    H    ILE  24           HN       ILE  24  -5.711   1.122  10.622
  195    HA   ILE  24           HA       ILE  24  -4.170   1.994   8.296
  196    HB   ILE  24           HB       ILE  24  -3.239   1.163  11.061
  197   HG12  ILE  24          HG12      ILE  24  -3.537   3.975  10.001
  198   HG13  ILE  24          HG11      ILE  24  -4.729   3.198  11.033
  199   HG21  ILE  24          HG21      ILE  24  -1.861   2.652   8.827
  200   HG22  ILE  24          HG22      ILE  24  -1.538   0.988   9.312
  201   HG23  ILE  24          HG23      ILE  24  -1.178   2.319  10.416
  202   HD11  ILE  24          HD11      ILE  24  -3.256   4.663  12.297
  203   HD12  ILE  24          HD12      ILE  24  -1.856   3.722  11.757
  204   HD13  ILE  24          HD13      ILE  24  -3.095   2.974  12.777
  205    H    TYR  25           HN       TYR  25  -2.916   0.482   7.226
  206    HA   TYR  25           HA       TYR  25  -2.987  -2.365   8.021
  207    HB2  TYR  25           HB2      TYR  25  -3.348  -1.376   5.196
  208    HB3  TYR  25           HB1      TYR  25  -3.385  -3.027   5.748
  209    HD1  TYR  25           HD2      TYR  25  -5.422  -3.901   6.837
  210    HD2  TYR  25           HD1      TYR  25  -5.253   0.057   5.278
  211    HE1  TYR  25           HE2      TYR  25  -7.877  -3.814   6.776
  212    HE2  TYR  25           HE1      TYR  25  -7.700   0.142   5.199
  213    HH   TYR  25           HH       TYR  25  -9.522  -1.520   5.011
  214    H    GLU  26           HN       GLU  26  -1.224  -3.534   6.990
  215    HA   GLU  26           HA       GLU  26   0.871  -1.900   5.727
  216    HB2  GLU  26           HB2      GLU  26   0.992  -4.644   7.007
  217    HB3  GLU  26           HB1      GLU  26   2.297  -3.972   6.045
  218    HG2  GLU  26           HG2      GLU  26   2.478  -2.119   7.652
  219    HG3  GLU  26           HG1      GLU  26   1.226  -2.877   8.626
  220    H    ALA  27           HN       ALA  27   1.143  -2.207   3.556
  221    HA   ALA  27           HA       ALA  27  -0.241  -4.498   2.353
  222    HB1  ALA  27           HB1      ALA  27  -1.143  -3.111   0.638
  223    HB2  ALA  27           HB2      ALA  27  -0.261  -1.717   1.248
  224    HB3  ALA  27           HB3      ALA  27  -1.583  -2.388   2.191
  225    H    SER  28           HN       SER  28   0.370  -4.632  -0.014
  226    HA   SER  28           HA       SER  28   3.078  -3.684  -0.527
  227    HB2  SER  28           HB2      SER  28   2.069  -6.478  -1.118
  228    HB3  SER  28           HB1      SER  28   3.686  -5.833  -1.443
  229    HG   SER  28           HG       SER  28   3.148  -5.376   1.083
  230    H    ILE  29           HN       ILE  29   3.346  -2.912  -2.500
  231    HA   ILE  29           HA       ILE  29   1.052  -2.268  -4.039
  232    HB   ILE  29           HB       ILE  29   3.953  -2.073  -4.935
  233   HG12  ILE  29          HG12      ILE  29   3.698  -0.885  -2.817
  234   HG13  ILE  29          HG11      ILE  29   3.870   0.264  -4.133
  235   HG21  ILE  29          HG21      ILE  29   2.349  -1.833  -6.747
  236   HG22  ILE  29          HG22      ILE  29   3.142  -0.295  -6.409
  237   HG23  ILE  29          HG23      ILE  29   1.496  -0.582  -5.846
  238   HD11  ILE  29          HD11      ILE  29   2.191   1.043  -2.607
  239   HD12  ILE  29          HD12      ILE  29   1.339  -0.492  -2.696
  240   HD13  ILE  29          HD13      ILE  29   1.395   0.560  -4.110
  241    H    LYS  30           HN       LYS  30   0.072  -3.371  -5.556
  242    HA   LYS  30           HA       LYS  30   1.369  -5.784  -6.606
  243    HB2  LYS  30           HB2      LYS  30  -0.810  -5.752  -5.119
  244    HB3  LYS  30           HB1      LYS  30  -1.597  -5.247  -6.594
  245    HG2  LYS  30           HG2      LYS  30  -0.041  -7.823  -6.290
  246    HG3  LYS  30           HG1      LYS  30  -1.776  -7.666  -6.074
  247    HD2  LYS  30           HD2      LYS  30  -0.332  -6.982  -8.623
  248    HD3  LYS  30           HD1      LYS  30  -1.066  -8.550  -8.294
  249    HE2  LYS  30           HE2      LYS  30  -2.537  -5.915  -8.303
  250    HE3  LYS  30           HE1      LYS  30  -2.518  -7.051  -9.635
  251    HZ1  LYS  30           HZ1      LYS  30  -3.504  -8.706  -8.066
  252    HZ2  LYS  30           HZ2      LYS  30  -4.486  -7.411  -8.424
  253    HZ3  LYS  30           HZ3      LYS  30  -3.712  -7.461  -6.935
  254    H    SER  31           HN       SER  31  -0.379  -2.810  -7.384
  255    HA   SER  31           HA       SER  31   0.759  -2.651  -9.968
  256    HB2  SER  31           HB2      SER  31  -1.124  -4.255 -10.438
  257    HB3  SER  31           HB1      SER  31  -2.261  -3.084  -9.789
  258    HG   SER  31           HG       SER  31  -2.366  -2.582 -11.821
  259    H    THR  32           HN       THR  32  -0.082  -0.532 -10.993
  260    HA   THR  32           HA       THR  32  -1.390   1.246  -9.099
  261    HB   THR  32           HB       THR  32   0.988   2.235 -10.580
  262    HG1  THR  32           HG1      THR  32   0.842   0.682  -8.226
  263   HG21  THR  32          HG21      THR  32  -0.512   3.801  -9.581
  264   HG22  THR  32          HG22      THR  32   1.052   3.848  -8.760
  265   HG23  THR  32          HG23      THR  32  -0.316   3.032  -8.006
  266    H    GLU  33           HN       GLU  33  -2.557   2.756 -10.141
  267    HA   GLU  33           HA       GLU  33  -2.294   3.114 -12.981
  268    HB2  GLU  33           HB2      GLU  33  -4.822   1.980 -11.809
  269    HB3  GLU  33           HB1      GLU  33  -4.759   2.820 -13.346
  270    HG2  GLU  33           HG2      GLU  33  -3.134   1.175 -14.148
  271    HG3  GLU  33           HG1      GLU  33  -3.332   0.264 -12.648
  272    H    ILE  34           HN       ILE  34  -3.580   4.797 -13.776
  273    HA   ILE  34           HA       ILE  34  -4.000   6.790 -11.689
  274    HB   ILE  34           HB       ILE  34  -3.239   7.179 -14.594
  275   HG12  ILE  34          HG12      ILE  34  -1.196   8.340 -13.655
  276   HG13  ILE  34          HG11      ILE  34  -1.687   7.796 -12.062
  277   HG21  ILE  34          HG21      ILE  34  -3.152   9.592 -14.167
  278   HG22  ILE  34          HG22      ILE  34  -3.728   9.308 -12.524
  279   HG23  ILE  34          HG23      ILE  34  -4.774   8.938 -13.893
  280   HD11  ILE  34          HD11      ILE  34   0.089   6.407 -12.958
  281   HD12  ILE  34          HD12      ILE  34  -0.899   6.031 -14.378
  282   HD13  ILE  34          HD13      ILE  34  -1.405   5.485 -12.783
  283    H    ASP  35           HN       ASP  35  -5.964   7.619 -11.504
  284    HA   ASP  35           HA       ASP  35  -7.901   7.162 -13.653
  285    HB2  ASP  35           HB2      ASP  35  -8.458   5.559 -11.899
  286    HB3  ASP  35           HB1      ASP  35  -8.419   6.842 -10.691
  287    H    ASP  36           HN       ASP  36  -8.093   9.024 -14.458
  288    HA   ASP  36           HA       ASP  36  -8.421  11.161 -14.847
  289    HB2  ASP  36           HB2      ASP  36 -10.675  10.516 -13.785
  290    HB3  ASP  36           HB1      ASP  36 -10.106  11.371 -12.352
  291    H    GLY  37           HN       GLY  37  -6.145  11.147 -14.219
  292    HA2  GLY  37           HA2      GLY  37  -4.544  12.782 -13.774
  293    HA3  GLY  37           HA1      GLY  37  -5.728  13.660 -12.835
  294    H    GLU  38           HN       GLU  38  -6.188  11.130 -11.183
  295    HA   GLU  38           HA       GLU  38  -3.734  11.455  -9.609
  296    HB2  GLU  38           HB2      GLU  38  -5.057  10.943  -7.588
  297    HB3  GLU  38           HB1      GLU  38  -5.555  12.412  -8.397
  298    HG2  GLU  38           HG2      GLU  38  -7.419  10.979  -9.438
  299    HG3  GLU  38           HG1      GLU  38  -6.958   9.785  -8.210
  300    H    VAL  39           HN       VAL  39  -2.830   9.821  -8.542
  301    HA   VAL  39           HA       VAL  39  -3.204   7.364 -10.036
  302    HB   VAL  39           HB       VAL  39  -0.983   8.424 -10.180
  303   HG11  VAL  39          HG11      VAL  39  -0.876   9.506  -8.082
  304   HG12  VAL  39          HG12      VAL  39   0.542   8.469  -8.287
  305   HG13  VAL  39          HG13      VAL  39  -0.782   7.966  -7.229
  306   HG21  VAL  39          HG21      VAL  39  -0.921   5.768  -8.729
  307   HG22  VAL  39          HG22      VAL  39   0.374   6.400  -9.731
  308   HG23  VAL  39          HG23      VAL  39  -1.177   5.993 -10.444
  309    H    LEU  40           HN       LEU  40  -3.895   5.622  -9.160
  310    HA   LEU  40           HA       LEU  40  -3.995   5.507  -6.270
  311    HB2  LEU  40           HB2      LEU  40  -5.966   4.332  -8.211
  312    HB3  LEU  40           HB1      LEU  40  -5.952   4.027  -6.489
  313    HG   LEU  40           HG       LEU  40  -6.189   6.706  -6.417
  314   HD11  LEU  40          HD11      LEU  40  -7.627   7.500  -8.144
  315   HD12  LEU  40          HD12      LEU  40  -7.346   5.998  -9.050
  316   HD13  LEU  40          HD13      LEU  40  -6.003   7.089  -8.694
  317   HD21  LEU  40          HD21      LEU  40  -8.558   6.346  -6.144
  318   HD22  LEU  40          HD22      LEU  40  -7.606   5.029  -5.422
  319   HD23  LEU  40          HD23      LEU  40  -8.423   4.777  -6.965
  320    H    TYR  41           HN       TYR  41  -3.945   3.363  -5.459
  321    HA   TYR  41           HA       TYR  41  -2.103   1.815  -7.120
  322    HB2  TYR  41           HB2      TYR  41  -1.989   2.313  -4.144
  323    HB3  TYR  41           HB1      TYR  41  -0.959   1.183  -5.007
  324    HD1  TYR  41           HD1      TYR  41  -1.913   4.799  -5.019
  325    HD2  TYR  41           HD2      TYR  41   1.117   1.917  -5.753
  326    HE1  TYR  41           HE1      TYR  41  -0.306   6.606  -5.426
  327    HE2  TYR  41           HE2      TYR  41   2.732   3.729  -6.161
  328    HH   TYR  41           HH       TYR  41   2.677   6.146  -6.857
  329    H    LEU  42           HN       LEU  42  -2.253  -0.328  -7.008
  330    HA   LEU  42           HA       LEU  42  -4.604  -1.379  -5.654
  331    HB2  LEU  42           HB2      LEU  42  -4.618  -1.688  -8.099
  332    HB3  LEU  42           HB1      LEU  42  -3.020  -2.400  -8.021
  333    HG   LEU  42           HG       LEU  42  -3.896  -4.348  -6.866
  334   HD11  LEU  42          HD11      LEU  42  -5.659  -3.274  -5.583
  335   HD12  LEU  42          HD12      LEU  42  -6.284  -4.635  -6.508
  336   HD13  LEU  42          HD13      LEU  42  -6.578  -2.985  -7.062
  337   HD21  LEU  42          HD21      LEU  42  -3.915  -4.349  -9.291
  338   HD22  LEU  42          HD22      LEU  42  -5.525  -3.622  -9.292
  339   HD23  LEU  42          HD23      LEU  42  -5.289  -5.248  -8.654
  340    H    VAL  43           HN       VAL  43  -3.980  -2.123  -3.826
  341    HA   VAL  43           HA       VAL  43  -1.297  -3.293  -3.579
  342    HB   VAL  43           HB       VAL  43  -1.066  -2.295  -1.414
  343   HG11  VAL  43          HG11      VAL  43  -0.539  -0.836  -3.245
  344   HG12  VAL  43          HG12      VAL  43  -1.101   0.051  -1.827
  345   HG13  VAL  43          HG13      VAL  43  -2.175  -0.183  -3.202
  346   HG21  VAL  43          HG21      VAL  43  -3.912  -1.289  -1.675
  347   HG22  VAL  43          HG22      VAL  43  -2.811  -0.912  -0.354
  348   HG23  VAL  43          HG23      VAL  43  -3.373  -2.570  -0.589
  349    H    HIS  44           HN       HIS  44  -1.191  -5.040  -2.193
  350    HA   HIS  44           HA       HIS  44  -3.803  -5.971  -1.268
  351    HB2  HIS  44           HB2      HIS  44  -3.220  -8.286  -1.595
  352    HB3  HIS  44           HB1      HIS  44  -2.831  -7.461  -3.094
  353    HD1  HIS  44           HD1      HIS  44  -1.316  -9.275  -0.221
  354    HD2  HIS  44           HD2      HIS  44  -0.077  -7.443  -3.738
  355    HE1  HIS  44           HE1      HIS  44   1.081  -9.965  -0.530
  356    HE2  HIS  44           HE2      HIS  44   1.640  -9.152  -2.842
  357    H    TYR  45           HN       TYR  45  -3.907  -6.651   0.763
  358    HA   TYR  45           HA       TYR  45  -1.798  -5.650   2.435
  359    HB2  TYR  45           HB2      TYR  45  -4.347  -7.093   3.237
  360    HB3  TYR  45           HB1      TYR  45  -3.295  -6.169   4.301
  361    HD1  TYR  45           HD2      TYR  45  -2.798  -3.706   2.947
  362    HD2  TYR  45           HD1      TYR  45  -6.364  -5.986   2.990
  363    HE1  TYR  45           HE2      TYR  45  -4.099  -1.669   2.405
  364    HE2  TYR  45           HE1      TYR  45  -7.668  -3.974   2.448
  365    HH   TYR  45           HH       TYR  45  -6.277  -1.091   1.390
  366    H    TYR  46           HN       TYR  46  -0.647  -6.983   3.986
  367    HA   TYR  46           HA       TYR  46  -0.729  -9.789   3.212
  368    HB2  TYR  46           HB2      TYR  46   1.639 -10.039   3.387
  369    HB3  TYR  46           HB1      TYR  46   1.375  -8.614   2.409
  370    HD1  TYR  46           HD2      TYR  46   2.013  -6.368   3.310
  371    HD2  TYR  46           HD1      TYR  46   2.664  -9.934   5.537
  372    HE1  TYR  46           HE2      TYR  46   3.601  -5.171   4.774
  373    HE2  TYR  46           HE1      TYR  46   4.232  -8.762   6.992
  374    HH   TYR  46           HH       TYR  46   4.492  -5.473   7.197
  375    H    GLY  47           HN       GLY  47   0.034 -11.243   4.937
  376    HA2  GLY  47           HA2      GLY  47   0.496 -11.180   7.406
  377    HA3  GLY  47           HA1      GLY  47  -1.008 -10.255   7.493
  378    H    TRP  48           HN       TRP  48  -2.770 -11.376   7.793
  379    HA   TRP  48           HA       TRP  48  -2.694 -14.191   7.065
  380    HB2  TRP  48           HB2      TRP  48  -3.467 -13.699   9.379
  381    HB3  TRP  48           HB1      TRP  48  -4.817 -12.774   8.706
  382    HD1  TRP  48           HD1      TRP  48  -6.964 -14.117   8.195
  383    HE1  TRP  48           HE1      TRP  48  -7.546 -16.617   7.973
  384    HE3  TRP  48           HE3      TRP  48  -2.269 -16.111   8.644
  385    HZ2  TRP  48           HZ2      TRP  48  -6.217 -19.078   8.004
  386    HZ3  TRP  48           HZ3      TRP  48  -2.014 -18.555   8.532
  387    HH2  TRP  48           HH2      TRP  48  -3.948 -20.010   8.218
  388    H    ASN  49           HN       ASN  49  -4.515 -11.207   6.549
  389    HA   ASN  49           HA       ASN  49  -5.809 -12.570   4.332
  390    HB2  ASN  49           HB2      ASN  49  -6.971 -10.269   3.970
  391    HB3  ASN  49           HB1      ASN  49  -7.455 -11.213   5.364
  392   HD21  ASN  49          HD21      ASN  49  -5.637  -8.403   4.304
  393   HD22  ASN  49          HD22      ASN  49  -5.599  -7.619   5.848
  394    H    VAL  50           HN       VAL  50  -4.231 -12.957   3.041
  395    HA   VAL  50           HA       VAL  50  -2.451 -10.842   2.123
  396    HB   VAL  50           HB       VAL  50  -2.509 -13.766   1.320
  397   HG11  VAL  50          HG11      VAL  50  -0.349 -11.690   0.974
  398   HG12  VAL  50          HG12      VAL  50  -1.357 -12.363  -0.305
  399   HG13  VAL  50          HG13      VAL  50  -0.213 -13.397   0.552
  400   HG21  VAL  50          HG21      VAL  50  -0.651 -14.074   2.890
  401   HG22  VAL  50          HG22      VAL  50  -2.112 -13.531   3.716
  402   HG23  VAL  50          HG23      VAL  50  -0.805 -12.392   3.398
  403    H    ARG  51           HN       ARG  51  -5.157 -12.704   1.117
  404    HA   ARG  51           HA       ARG  51  -4.944 -11.963  -1.666
  405    HB2  ARG  51           HB2      ARG  51  -7.044 -13.511  -0.159
  406    HB3  ARG  51           HB1      ARG  51  -7.044 -13.249  -1.894
  407    HG2  ARG  51           HG2      ARG  51  -5.056 -14.546  -2.160
  408    HG3  ARG  51           HG1      ARG  51  -4.836 -14.665  -0.414
  409    HD2  ARG  51           HD2      ARG  51  -7.140 -15.788  -2.003
  410    HD3  ARG  51           HD1      ARG  51  -5.804 -16.715  -1.314
  411    HE   ARG  51           HE       ARG  51  -6.705 -15.525   0.843
  412   HH11  ARG  51          HH11      ARG  51  -8.534 -17.227  -1.681
  413   HH12  ARG  51          HH12      ARG  51  -9.832 -17.619  -0.666
  414   HH21  ARG  51          HH21      ARG  51  -8.489 -16.092   2.245
  415   HH22  ARG  51          HH22      ARG  51  -9.800 -16.976   1.627
  416    H    TYR  52           HN       TYR  52  -5.764 -10.178   0.857
  417    HA   TYR  52           HA       TYR  52  -8.156  -9.102  -0.361
  418    HB2  TYR  52           HB2      TYR  52  -7.852  -9.234   2.189
  419    HB3  TYR  52           HB1      TYR  52  -6.741  -7.875   2.009
  420    HD1  TYR  52           HD2      TYR  52  -7.628  -5.750   0.979
  421    HD2  TYR  52           HD1      TYR  52 -10.174  -8.893   2.204
  422    HE1  TYR  52           HE2      TYR  52  -9.516  -4.193   0.972
  423    HE2  TYR  52           HE1      TYR  52 -12.105  -7.335   2.203
  424    HH   TYR  52           HH       TYR  52 -11.865  -4.234   0.762
  425    H    ASP  53           HN       ASP  53  -7.488  -8.458  -2.196
  426    HA   ASP  53           HA       ASP  53  -5.298  -6.538  -2.584
  427    HB2  ASP  53           HB2      ASP  53  -5.413  -8.672  -3.872
  428    HB3  ASP  53           HB1      ASP  53  -6.990  -8.210  -4.464
  429    H    GLU  54           HN       GLU  54  -5.951  -4.370  -2.656
  430    HA   GLU  54           HA       GLU  54  -8.497  -3.671  -3.871
  431    HB2  GLU  54           HB2      GLU  54  -9.004  -4.328  -1.475
  432    HB3  GLU  54           HB1      GLU  54  -7.985  -2.994  -0.965
  433    HG2  GLU  54           HG2      GLU  54  -9.476  -1.395  -1.854
  434    HG3  GLU  54           HG1      GLU  54 -10.376  -2.629  -2.729
  435    H    TRP  55           HN       TRP  55  -8.843  -1.277  -3.785
  436    HA   TRP  55           HA       TRP  55  -6.343  -0.080  -4.666
  437    HB2  TRP  55           HB2      TRP  55  -9.211   0.631  -5.147
  438    HB3  TRP  55           HB1      TRP  55  -7.851   1.567  -5.727
  439    HD1  TRP  55           HD1      TRP  55  -9.442  -1.926  -6.211
  440    HE1  TRP  55           HE1      TRP  55  -8.736  -2.802  -8.531
  441    HE3  TRP  55           HE3      TRP  55  -6.189   1.790  -7.500
  442    HZ2  TRP  55           HZ2      TRP  55  -7.004  -2.004 -10.625
  443    HZ3  TRP  55           HZ3      TRP  55  -5.039   1.656  -9.659
  444    HH2  TRP  55           HH2      TRP  55  -5.440  -0.198 -11.186
  445    H    VAL  56           HN       VAL  56  -5.429   1.411  -3.564
  446    HA   VAL  56           HA       VAL  56  -7.023   3.204  -1.936
  447    HB   VAL  56           HB       VAL  56  -5.288   3.289  -0.185
  448   HG11  VAL  56          HG11      VAL  56  -7.117   1.747   0.156
  449   HG12  VAL  56          HG12      VAL  56  -5.637   1.092   0.850
  450   HG13  VAL  56          HG13      VAL  56  -6.239   0.472  -0.686
  451   HG21  VAL  56          HG21      VAL  56  -3.918   1.056  -1.704
  452   HG22  VAL  56          HG22      VAL  56  -3.446   1.648  -0.109
  453   HG23  VAL  56          HG23      VAL  56  -3.333   2.707  -1.504
  454    H    LYS  57           HN       LYS  57  -6.229   5.329  -1.976
  455    HA   LYS  57           HA       LYS  57  -4.683   5.798  -4.352
  456    HB2  LYS  57           HB2      LYS  57  -6.859   6.865  -3.914
  457    HB3  LYS  57           HB1      LYS  57  -6.162   7.654  -2.517
  458    HG2  LYS  57           HG2      LYS  57  -4.882   9.081  -3.812
  459    HG3  LYS  57           HG1      LYS  57  -5.047   8.071  -5.257
  460    HD2  LYS  57           HD2      LYS  57  -6.485   9.992  -5.470
  461    HD3  LYS  57           HD1      LYS  57  -7.437   8.522  -5.270
  462    HE2  LYS  57           HE2      LYS  57  -7.716   9.060  -2.877
  463    HE3  LYS  57           HE1      LYS  57  -6.870  10.585  -3.143
  464    HZ1  LYS  57           HZ1      LYS  57  -8.582  11.023  -4.884
  465    HZ2  LYS  57           HZ2      LYS  57  -9.164  11.054  -3.288
  466    HZ3  LYS  57           HZ3      LYS  57  -9.452   9.715  -4.281
  467    H    ALA  58           HN       ALA  58  -3.056   7.593  -4.288
  468    HA   ALA  58           HA       ALA  58  -0.865   7.057  -2.710
  469    HB1  ALA  58           HB1      ALA  58   0.072   9.099  -3.580
  470    HB2  ALA  58           HB2      ALA  58  -1.544   9.712  -3.936
  471    HB3  ALA  58           HB3      ALA  58  -0.916   8.348  -4.844
  472    H    ASP  59           HN       ASP  59  -3.507   9.138  -2.099
  473    HA   ASP  59           HA       ASP  59  -2.453  10.655   0.059
  474    HB2  ASP  59           HB2      ASP  59  -4.329  11.544  -1.107
  475    HB3  ASP  59           HB1      ASP  59  -5.272  10.087  -0.845
  476    H    ARG  60           HN       ARG  60  -3.690   7.465  -0.129
  477    HA   ARG  60           HA       ARG  60  -4.205   7.377   2.743
  478    HB2  ARG  60           HB2      ARG  60  -4.971   5.516   0.504
  479    HB3  ARG  60           HB1      ARG  60  -5.239   5.151   2.198
  480    HG2  ARG  60           HG2      ARG  60  -6.494   7.340   0.555
  481    HG3  ARG  60           HG1      ARG  60  -7.288   5.944   1.281
  482    HD2  ARG  60           HD2      ARG  60  -6.288   6.965   3.502
  483    HD3  ARG  60           HD1      ARG  60  -6.308   8.447   2.553
  484    HE   ARG  60           HE       ARG  60  -8.649   6.776   3.095
  485   HH11  ARG  60          HH11      ARG  60  -7.253  10.000   2.427
  486   HH12  ARG  60          HH12      ARG  60  -8.651  10.827   2.869
  487   HH21  ARG  60          HH21      ARG  60 -10.598   7.999   3.663
  488   HH22  ARG  60          HH22      ARG  60 -10.588   9.692   3.543
  489    H    ILE  61           HN       ILE  61  -1.517   7.136   1.070
  490    HA   ILE  61           HA       ILE  61  -0.713   4.613   2.291
  491    HB   ILE  61           HB       ILE  61   0.278   5.867  -0.280
  492   HG12  ILE  61          HG12      ILE  61  -1.370   3.383   0.211
  493   HG13  ILE  61          HG11      ILE  61  -1.950   4.886  -0.496
  494   HG21  ILE  61          HG21      ILE  61   1.584   3.830  -0.555
  495   HG22  ILE  61          HG22      ILE  61   0.972   3.245   0.994
  496   HG23  ILE  61          HG23      ILE  61   2.028   4.670   0.945
  497   HD11  ILE  61          HD11      ILE  61  -0.457   4.563  -2.391
  498   HD12  ILE  61          HD12      ILE  61  -1.561   3.195  -2.175
  499   HD13  ILE  61          HD13      ILE  61   0.119   3.059  -1.660
  500    H    ILE  62           HN       ILE  62   1.121   4.632   3.459
  501    HA   ILE  62           HA       ILE  62   2.638   7.139   3.654
  502    HB   ILE  62           HB       ILE  62   2.814   4.784   5.570
  503   HG12  ILE  62          HG12      ILE  62   1.755   6.554   7.220
  504   HG13  ILE  62          HG11      ILE  62   1.052   7.211   5.739
  505   HG21  ILE  62          HG21      ILE  62   4.031   6.267   7.026
  506   HG22  ILE  62          HG22      ILE  62   3.877   7.568   5.841
  507   HG23  ILE  62          HG23      ILE  62   4.805   6.120   5.445
  508   HD11  ILE  62          HD11      ILE  62  -0.543   5.773   6.786
  509   HD12  ILE  62          HD12      ILE  62   0.643   4.503   6.979
  510   HD13  ILE  62          HD13      ILE  62   0.060   4.918   5.357
  511    H    TRP  63           HN       TRP  63   4.364   7.048   2.438
  512    HA   TRP  63           HA       TRP  63   5.491   4.531   1.641
  513    HB2  TRP  63           HB2      TRP  63   6.079   7.375   0.825
  514    HB3  TRP  63           HB1      TRP  63   6.984   5.993   0.221
  515    HD1  TRP  63           HD1      TRP  63   3.576   7.696  -0.082
  516    HE1  TRP  63           HE1      TRP  63   2.347   6.679  -2.092
  517    HE3  TRP  63           HE3      TRP  63   6.804   3.908  -1.139
  518    HZ2  TRP  63           HZ2      TRP  63   2.713   4.542  -3.891
  519    HZ3  TRP  63           HZ3      TRP  63   6.302   2.407  -3.030
  520    HH2  TRP  63           HH2      TRP  63   4.294   2.721  -4.376
  521    HA   PRO  64           HA       PRO  64   8.828   4.887   4.588
  522    HB2  PRO  64           HB2      PRO  64  10.455   3.234   2.792
  523    HB3  PRO  64           HB1      PRO  64   9.862   2.843   4.409
  524    HG2  PRO  64           HG2      PRO  64   8.860   1.609   2.245
  525    HG3  PRO  64           HG1      PRO  64   7.844   2.056   3.634
  526    HD2  PRO  64           HD2      PRO  64   8.173   3.480   1.016
  527    HD3  PRO  64           HD1      PRO  64   6.683   3.052   1.895
  528    H    LEU  65           HN       LEU  65   9.931   6.546   4.773
  529    HA   LEU  65           HA       LEU  65  12.134   7.459   3.342
  530    HB2  LEU  65           HB2      LEU  65  10.144   7.835   1.681
  531    HB3  LEU  65           HB1      LEU  65   9.590   9.017   2.832
  532    HG   LEU  65           HG       LEU  65  12.142   9.155   1.227
  533   HD11  LEU  65          HD11      LEU  65   9.536  10.626   1.031
  534   HD12  LEU  65          HD12      LEU  65  10.138   9.404  -0.084
  535   HD13  LEU  65          HD13      LEU  65  10.969  10.963   0.054
  536   HD21  LEU  65          HD21      LEU  65  12.357  10.291   3.391
  537   HD22  LEU  65          HD22      LEU  65  10.879  11.187   3.066
  538   HD23  LEU  65          HD23      LEU  65  12.317  11.458   2.060
  539    H    ASP  66           HN       ASP  66  12.689   7.548   5.533
  540    HA   ASP  66           HA       ASP  66  12.742   8.258   7.726
  541    HB2  ASP  66           HB2      ASP  66  13.134  10.451   6.457
  542    HB3  ASP  66           HB1      ASP  66  11.411  10.747   6.547
  543    H    LYS  67           HN       LYS  67  10.478  10.130   8.685
  544    HA   LYS  67           HA       LYS  67   8.160   8.695   7.885
  545    HB2  LYS  67           HB2      LYS  67   9.225   7.738  10.164
  546    HB3  LYS  67           HB1      LYS  67   8.339   9.108  10.830
  547    HG2  LYS  67           HG2      LYS  67   7.113   7.023   9.058
  548    HG3  LYS  67           HG1      LYS  67   7.050   6.963  10.831
  549    HD2  LYS  67           HD2      LYS  67   5.742   8.969  10.853
  550    HD3  LYS  67           HD1      LYS  67   5.991   9.211   9.126
  551    HE2  LYS  67           HE2      LYS  67   4.748   7.268   8.613
  552    HE3  LYS  67           HE1      LYS  67   4.536   6.849  10.325
  553    HZ1  LYS  67           HZ1      LYS  67   3.428   9.211   8.883
  554    HZ2  LYS  67           HZ2      LYS  67   3.322   8.995  10.538
  555    HZ3  LYS  67           HZ3      LYS  67   2.538   7.946   9.511
  556    H    GLY  68           HN       GLY  68   8.741  10.887   6.940
  557    HA2  GLY  68           HA2      GLY  68   7.588  12.923   8.630
  558    HA3  GLY  68           HA1      GLY  68   8.484  13.225   7.123
  559    H    LEU  69           HN       LEU  69   6.514  10.705   6.635
  560    HA   LEU  69           HA       LEU  69   4.628  12.369   5.232
  561    HB2  LEU  69           HB2      LEU  69   4.901   9.365   5.242
  562    HB3  LEU  69           HB1      LEU  69   3.739  10.259   4.285
  563    HG   LEU  69           HG       LEU  69   5.788  11.375   3.202
  564   HD11  LEU  69          HD11      LEU  69   7.457  10.679   4.791
  565   HD12  LEU  69          HD12      LEU  69   7.820  10.010   3.194
  566   HD13  LEU  69          HD13      LEU  69   7.106   8.986   4.453
  567   HD21  LEU  69          HD21      LEU  69   6.020   9.550   1.613
  568   HD22  LEU  69          HD22      LEU  69   4.328   9.779   2.079
  569   HD23  LEU  69          HD23      LEU  69   5.275   8.456   2.774
  570    H    GLU  70           HN       GLU  70   3.108  13.117   6.334
  571    HA   GLU  70           HA       GLU  70   1.308  11.342   7.653
  572    HB2  GLU  70           HB2      GLU  70   2.806  13.445   9.091
  573    HB3  GLU  70           HB1      GLU  70   1.072  13.386   9.391
  574    HG2  GLU  70           HG2      GLU  70   3.049  11.156   9.777
  575    HG3  GLU  70           HG1      GLU  70   2.207  12.067  11.038
  576    H    HIS  71           HN       HIS  71  -0.539  11.695   6.866
  577    HA   HIS  71           HA       HIS  71  -1.053  14.167   5.526
  578    HB2  HIS  71           HB2      HIS  71  -2.715  11.654   5.860
  579    HB3  HIS  71           HB1      HIS  71  -3.382  13.118   5.133
  580    HD1  HIS  71           HD1      HIS  71  -3.250  13.021   2.599
  581    HD2  HIS  71           HD2      HIS  71  -0.097  10.990   4.403
  582    HE1  HIS  71           HE1      HIS  71  -1.774  12.347   0.775
  583    HE2  HIS  71           HE2      HIS  71   0.247  11.413   1.887
  584    H    HIS  72           HN       HIS  72  -2.220  15.794   6.248
  585    HA   HIS  72           HA       HIS  72  -2.168  16.052   9.068
  586    HB2  HIS  72           HB2      HIS  72  -1.692  17.850   7.304
  587    HB3  HIS  72           HB1      HIS  72  -3.438  18.013   7.180
  588    HD1  HIS  72           HD1      HIS  72  -3.771  20.268   8.219
  589    HD2  HIS  72           HD2      HIS  72  -1.439  17.758  10.561
  590    HE1  HIS  72           HE1      HIS  72  -3.359  21.518  10.356
  591    HE2  HIS  72           HE2      HIS  72  -2.239  19.810  11.842
  592    H    HIS  73           HN       HIS  73  -4.568  15.115   6.871
  593    HA   HIS  73           HA       HIS  73  -6.590  14.241   7.113
  594    HB2  HIS  73           HB2      HIS  73  -5.695  12.982   8.995
  595    HB3  HIS  73           HB1      HIS  73  -5.981  14.329  10.078
  596    HD1  HIS  73           HD1      HIS  73  -7.763  11.540   8.287
  597    HD2  HIS  73           HD2      HIS  73  -8.582  14.486  11.098
  598    HE1  HIS  73           HE1      HIS  73  -9.980  10.939   9.271
  599    HE2  HIS  73           HE2      HIS  73 -10.275  12.554  11.163
  600    H    HIS  74           HN       HIS  74  -7.092  16.283   6.188
  601    HA   HIS  74           HA       HIS  74  -9.409  17.221   7.506
  602    HB2  HIS  74           HB2      HIS  74  -7.109  18.737   7.978
  603    HB3  HIS  74           HB1      HIS  74  -8.013  19.631   6.751
  604    HD1  HIS  74           HD1      HIS  74  -8.361  18.255  10.232
  605    HD2  HIS  74           HD2      HIS  74 -10.301  20.858   7.658
  606    HE1  HIS  74           HE1      HIS  74 -10.125  19.398  11.626
  607    HE2  HIS  74           HE2      HIS  74 -11.430  20.761   9.957
  608    H    HIS  75           HN       HIS  75  -9.797  15.923   5.608
  609    HA   HIS  75           HA       HIS  75 -10.266  17.710   3.368
  610    HB2  HIS  75           HB2      HIS  75  -8.272  16.234   2.876
  611    HB3  HIS  75           HB1      HIS  75  -9.330  14.847   3.064
  612    HD1  HIS  75           HD1      HIS  75  -8.272  17.401   0.639
  613    HD2  HIS  75           HD2      HIS  75 -11.330  14.612   0.986
  614    HE1  HIS  75           HE1      HIS  75  -9.220  17.147  -1.669
  615    HE2  HIS  75           HE2      HIS  75 -10.834  15.241  -1.460
  616    H    HIS  76           HN       HIS  76 -12.411  17.817   3.472
  617    HA   HIS  76           HA       HIS  76 -13.874  15.434   4.313
  618    HB2  HIS  76           HB2      HIS  76 -14.175  17.626   5.553
  619    HB3  HIS  76           HB1      HIS  76 -14.890  18.274   4.079
  620    HD1  HIS  76           HD1      HIS  76 -17.128  17.004   3.290
  621    HD2  HIS  76           HD2      HIS  76 -15.878  16.312   7.178
  622    HE1  HIS  76           HE1      HIS  76 -19.128  16.049   4.484
  623    HE2  HIS  76           HE2      HIS  76 -18.306  15.549   6.822
  Start of MODEL    3
    1    H1   GLU   1           HT1      GLU   1  26.509  -5.652 -10.328
    2    H2   GLU   1           HT2      GLU   1  26.101  -4.019 -10.071
    3    H3   GLU   1           HT3      GLU   1  25.309  -4.909 -11.261
    4    HA   GLU   1           HA       GLU   1  24.274  -6.282  -9.722
    5    HB2  GLU   1           HB2      GLU   1  25.876  -4.758  -7.659
    6    HB3  GLU   1           HB1      GLU   1  24.465  -5.712  -7.252
    7    HG2  GLU   1           HG2      GLU   1  26.403  -6.989  -6.754
    8    HG3  GLU   1           HG1      GLU   1  25.641  -7.713  -8.166
    9    H    ASP   2           HN       ASP   2  22.414  -5.500 -10.351
   10    HA   ASP   2           HA       ASP   2  21.409  -3.150  -9.023
   11    HB2  ASP   2           HB2      ASP   2  20.693  -2.032 -11.067
   12    HB3  ASP   2           HB1      ASP   2  22.443  -2.215 -11.078
   13    H    MET   3           HN       MET   3  19.102  -2.839  -9.769
   14    HA   MET   3           HA       MET   3  17.727  -5.107 -10.780
   15    HB2  MET   3           HB2      MET   3  18.022  -5.787  -8.441
   16    HB3  MET   3           HB1      MET   3  17.452  -4.224  -7.894
   17    HG2  MET   3           HG2      MET   3  15.233  -4.712  -8.742
   18    HG3  MET   3           HG1      MET   3  15.791  -6.273  -9.352
   19    HE1  MET   3           HE1      MET   3  13.749  -7.374  -8.012
   20    HE2  MET   3           HE2      MET   3  13.286  -5.809  -7.342
   21    HE3  MET   3           HE3      MET   3  13.511  -7.191  -6.274
   22    H    GLU   4           HN       GLU   4  15.742  -4.381 -11.533
   23    HA   GLU   4           HA       GLU   4  15.439  -1.610 -11.945
   24    HB2  GLU   4           HB2      GLU   4  13.394  -3.813 -12.208
   25    HB3  GLU   4           HB1      GLU   4  13.276  -2.209 -12.897
   26    HG2  GLU   4           HG2      GLU   4  15.114  -2.629 -14.368
   27    HG3  GLU   4           HG1      GLU   4  15.422  -4.189 -13.603
   28    HA   PRO   5           HA       PRO   5  13.570  -0.963  -7.910
   29    HB2  PRO   5           HB2      PRO   5  13.193   1.816  -8.792
   30    HB3  PRO   5           HB1      PRO   5  14.143   1.186  -7.440
   31    HG2  PRO   5           HG2      PRO   5  15.333   2.194  -9.627
   32    HG3  PRO   5           HG1      PRO   5  15.998   0.816  -8.725
   33    HD2  PRO   5           HD2      PRO   5  14.412   0.800 -11.274
   34    HD3  PRO   5           HD1      PRO   5  15.893  -0.089 -10.843
   35    H    CYS   6           HN       CYS   6  11.779  -2.181  -8.556
   36    HA   CYS   6           HA       CYS   6   9.598  -0.810  -9.826
   37    HB2  CYS   6           HB2      CYS   6   9.836  -3.633  -8.773
   38    HB3  CYS   6           HB1      CYS   6   8.421  -2.999  -9.612
   39    HG   CYS   6           HG       CYS   6   9.749  -2.530 -12.005
   40    H    LEU   7           HN       LEU   7   7.647  -0.341  -8.826
   41    HA   LEU   7           HA       LEU   7   7.929   0.127  -5.996
   42    HB2  LEU   7           HB2      LEU   7   5.991   1.491  -6.082
   43    HB3  LEU   7           HB1      LEU   7   6.907   1.843  -7.521
   44    HG   LEU   7           HG       LEU   7   4.384   0.177  -7.394
   45   HD11  LEU   7          HD11      LEU   7   4.863   2.956  -8.433
   46   HD12  LEU   7          HD12      LEU   7   4.031   2.526  -6.946
   47   HD13  LEU   7          HD13      LEU   7   3.337   2.069  -8.504
   48   HD21  LEU   7          HD21      LEU   7   5.799  -0.543  -9.251
   49   HD22  LEU   7          HD22      LEU   7   5.959   1.126  -9.796
   50   HD23  LEU   7          HD23      LEU   7   4.387   0.326  -9.852
   51    H    THR   8           HN       THR   8   6.530  -2.205  -8.022
   52    HA   THR   8           HA       THR   8   4.567  -3.171  -6.260
   53    HB   THR   8           HB       THR   8   4.817  -5.195  -7.855
   54    HG1  THR   8           HG1      THR   8   6.728  -4.924  -8.823
   55   HG21  THR   8          HG21      THR   8   3.627  -3.988  -9.635
   56   HG22  THR   8          HG22      THR   8   4.149  -2.453  -8.942
   57   HG23  THR   8          HG23      THR   8   3.046  -3.498  -8.044
   58    H    GLY   9           HN       GLY   9   4.685  -4.809  -4.809
   59    HA2  GLY   9           HA2      GLY   9   5.694  -6.600  -3.653
   60    HA3  GLY   9           HA1      GLY   9   7.229  -6.194  -4.411
   61    H    THR  10           HN       THR  10   6.557  -3.299  -3.662
   62    HA   THR  10           HA       THR  10   8.114  -3.164  -1.313
   63    HB   THR  10           HB       THR  10   6.269  -1.086  -2.437
   64    HG1  THR  10           HG1      THR  10   7.536  -1.279  -4.103
   65   HG21  THR  10          HG21      THR  10   7.855   0.535  -1.475
   66   HG22  THR  10          HG22      THR  10   8.823  -0.792  -0.831
   67   HG23  THR  10          HG23      THR  10   7.180  -0.521  -0.236
   68    H    LYS  11           HN       LYS  11   7.477  -3.385   0.697
   69    HA   LYS  11           HA       LYS  11   4.654  -3.610   1.278
   70    HB2  LYS  11           HB2      LYS  11   7.037  -4.178   3.068
   71    HB3  LYS  11           HB1      LYS  11   5.346  -4.500   3.456
   72    HG2  LYS  11           HG2      LYS  11   5.195  -6.069   1.601
   73    HG3  LYS  11           HG1      LYS  11   6.875  -5.752   1.185
   74    HD2  LYS  11           HD2      LYS  11   7.574  -6.652   3.355
   75    HD3  LYS  11           HD1      LYS  11   5.883  -6.953   3.767
   76    HE2  LYS  11           HE2      LYS  11   5.679  -8.482   1.880
   77    HE3  LYS  11           HE1      LYS  11   7.347  -8.163   1.418
   78    HZ1  LYS  11           HZ1      LYS  11   6.474  -9.443   3.959
   79    HZ2  LYS  11           HZ2      LYS  11   8.060  -9.187   3.512
   80    HZ3  LYS  11           HZ3      LYS  11   7.087 -10.242   2.629
   81    H    VAL  12           HN       VAL  12   3.601  -1.956   1.782
   82    HA   VAL  12           HA       VAL  12   4.933   0.350   3.017
   83    HB   VAL  12           HB       VAL  12   3.295   1.768   1.848
   84   HG11  VAL  12          HG11      VAL  12   4.133   1.513  -0.434
   85   HG12  VAL  12          HG12      VAL  12   4.725  -0.096  -0.039
   86   HG13  VAL  12          HG13      VAL  12   5.437   1.315   0.737
   87   HG21  VAL  12          HG21      VAL  12   1.464   0.137   1.722
   88   HG22  VAL  12          HG22      VAL  12   2.360  -0.779   0.508
   89   HG23  VAL  12          HG23      VAL  12   1.803   0.858   0.150
   90    H    LYS  13           HN       LYS  13   3.057   1.830   3.883
   91    HA   LYS  13           HA       LYS  13   1.306   0.210   5.571
   92    HB2  LYS  13           HB2      LYS  13   3.200   2.294   6.056
   93    HB3  LYS  13           HB1      LYS  13   1.594   2.923   6.369
   94    HG2  LYS  13           HG2      LYS  13   2.754   0.463   7.625
   95    HG3  LYS  13           HG1      LYS  13   2.692   2.072   8.375
   96    HD2  LYS  13           HD2      LYS  13   0.179   1.903   7.858
   97    HD3  LYS  13           HD1      LYS  13   0.490   0.178   7.709
   98    HE2  LYS  13           HE2      LYS  13   1.065   1.918  10.060
   99    HE3  LYS  13           HE1      LYS  13  -0.283   0.807   9.915
  100    HZ1  LYS  13           HZ1      LYS  13   1.409  -0.241  11.243
  101    HZ2  LYS  13           HZ2      LYS  13   2.612   0.100  10.140
  102    HZ3  LYS  13           HZ3      LYS  13   1.420  -1.038   9.770
  103    H    VAL  14           HN       VAL  14  -0.939   0.797   5.438
  104    HA   VAL  14           HA       VAL  14  -1.617   2.943   3.520
  105    HB   VAL  14           HB       VAL  14  -2.904   0.188   3.650
  106   HG11  VAL  14          HG11      VAL  14  -4.539   1.887   3.092
  107   HG12  VAL  14          HG12      VAL  14  -4.185   0.886   1.681
  108   HG13  VAL  14          HG13      VAL  14  -3.489   2.501   1.816
  109   HG21  VAL  14          HG21      VAL  14  -0.726   0.096   2.573
  110   HG22  VAL  14          HG22      VAL  14  -1.187   1.412   1.489
  111   HG23  VAL  14          HG23      VAL  14  -2.009  -0.146   1.388
  112    H    LYS  15           HN       LYS  15  -3.364   4.205   4.113
  113    HA   LYS  15           HA       LYS  15  -4.671   3.535   6.680
  114    HB2  LYS  15           HB2      LYS  15  -4.352   6.190   5.282
  115    HB3  LYS  15           HB1      LYS  15  -5.221   5.957   6.806
  116    HG2  LYS  15           HG2      LYS  15  -3.031   5.112   7.732
  117    HG3  LYS  15           HG1      LYS  15  -2.339   5.658   6.193
  118    HD2  LYS  15           HD2      LYS  15  -3.782   7.427   8.178
  119    HD3  LYS  15           HD1      LYS  15  -2.034   7.310   8.019
  120    HE2  LYS  15           HE2      LYS  15  -2.214   8.132   5.700
  121    HE3  LYS  15           HE1      LYS  15  -3.956   8.293   5.902
  122    HZ1  LYS  15           HZ1      LYS  15  -3.487   9.855   7.760
  123    HZ2  LYS  15           HZ2      LYS  15  -2.902  10.427   6.285
  124    HZ3  LYS  15           HZ3      LYS  15  -1.854   9.763   7.395
  125    H    TYR  16           HN       TYR  16  -6.625   2.564   6.251
  126    HA   TYR  16           HA       TYR  16  -8.257   3.864   4.234
  127    HB2  TYR  16           HB2      TYR  16  -7.094   2.119   3.038
  128    HB3  TYR  16           HB1      TYR  16  -7.582   0.920   4.213
  129    HD1  TYR  16           HD1      TYR  16  -8.756   3.114   1.477
  130    HD2  TYR  16           HD2      TYR  16  -9.756  -0.138   4.037
  131    HE1  TYR  16           HE1      TYR  16 -10.700   2.594   0.060
  132    HE2  TYR  16           HE2      TYR  16 -11.689  -0.655   2.641
  133    HH   TYR  16           HH       TYR  16 -12.143   0.749  -0.450
  134    H    GLY  17           HN       GLY  17  -9.844   4.530   5.488
  135    HA2  GLY  17           HA2      GLY  17 -11.877   2.774   5.796
  136    HA3  GLY  17           HA1      GLY  17 -11.275   2.968   7.410
  137    H    ARG  18           HN       ARG  18 -13.756   3.856   7.059
  138    HA   ARG  18           HA       ARG  18 -13.337   6.715   6.819
  139    HB2  ARG  18           HB2      ARG  18 -15.708   6.992   6.110
  140    HB3  ARG  18           HB1      ARG  18 -14.756   6.060   4.987
  141    HG2  ARG  18           HG2      ARG  18 -16.734   4.879   4.985
  142    HG3  ARG  18           HG1      ARG  18 -15.844   4.011   6.236
  143    HD2  ARG  18           HD2      ARG  18 -17.023   5.193   7.970
  144    HD3  ARG  18           HD1      ARG  18 -17.789   6.251   6.792
  145    HE   ARG  18           HE       ARG  18 -18.344   3.482   6.356
  146   HH11  ARG  18          HH11      ARG  18 -19.372   6.381   8.096
  147   HH12  ARG  18          HH12      ARG  18 -20.974   5.857   8.352
  148   HH21  ARG  18          HH21      ARG  18 -20.559   2.748   6.681
  149   HH22  ARG  18          HH22      ARG  18 -21.664   3.734   7.513
  150    H    GLY  19           HN       GLY  19 -13.353   7.772   8.613
  151    HA2  GLY  19           HA2      GLY  19 -13.709   8.408  10.782
  152    HA3  GLY  19           HA1      GLY  19 -15.353   7.859  10.531
  153    H    LYS  20           HN       LYS  20 -16.031   6.095  11.542
  154    HA   LYS  20           HA       LYS  20 -14.562   5.041  13.742
  155    HB2  LYS  20           HB2      LYS  20 -16.994   5.412  13.803
  156    HB3  LYS  20           HB1      LYS  20 -17.228   4.285  12.490
  157    HG2  LYS  20           HG2      LYS  20 -16.075   3.366  15.099
  158    HG3  LYS  20           HG1      LYS  20 -17.812   3.594  14.916
  159    HD2  LYS  20           HD2      LYS  20 -17.796   1.992  13.032
  160    HD3  LYS  20           HD1      LYS  20 -16.061   1.757  13.265
  161    HE2  LYS  20           HE2      LYS  20 -16.483   0.966  15.536
  162    HE3  LYS  20           HE1      LYS  20 -18.212   1.185  15.295
  163    HZ1  LYS  20           HZ1      LYS  20 -16.512  -0.658  13.704
  164    HZ2  LYS  20           HZ2      LYS  20 -18.191  -0.535  13.613
  165    HZ3  LYS  20           HZ3      LYS  20 -17.452  -1.131  15.003
  166    H    THR  21           HN       THR  21 -15.119   4.132  10.494
  167    HA   THR  21           HA       THR  21 -14.255   1.388  10.745
  168    HB   THR  21           HB       THR  21 -14.857   3.045   8.284
  169    HG1  THR  21           HG1      THR  21 -16.848   1.452   9.347
  170   HG21  THR  21          HG21      THR  21 -15.218   0.078   8.815
  171   HG22  THR  21          HG22      THR  21 -13.884   0.788   7.900
  172   HG23  THR  21          HG23      THR  21 -15.538   0.938   7.301
  173    H    GLN  22           HN       GLN  22 -12.643   4.287  10.792
  174    HA   GLN  22           HA       GLN  22 -10.651   3.986   8.742
  175    HB2  GLN  22           HB2      GLN  22 -11.428   6.128   9.995
  176    HB3  GLN  22           HB1      GLN  22 -10.300   5.621  11.232
  177    HG2  GLN  22           HG2      GLN  22  -9.590   6.124   8.376
  178    HG3  GLN  22           HG1      GLN  22  -9.388   7.345   9.647
  179   HE21  GLN  22          HE21      GLN  22  -8.085   4.775   7.906
  180   HE22  GLN  22          HE22      GLN  22  -6.638   4.552   8.825
  181    H    LYS  23           HN       LYS  23  -9.202   2.475   8.706
  182    HA   LYS  23           HA       LYS  23  -7.696   2.073  11.109
  183    HB2  LYS  23           HB2      LYS  23  -7.613  -0.453  10.627
  184    HB3  LYS  23           HB1      LYS  23  -9.037   0.201  11.407
  185    HG2  LYS  23           HG2      LYS  23 -10.185   0.135   9.274
  186    HG3  LYS  23           HG1      LYS  23  -8.740  -0.592   8.543
  187    HD2  LYS  23           HD2      LYS  23  -8.824  -2.426  10.031
  188    HD3  LYS  23           HD1      LYS  23 -10.090  -1.657  10.977
  189    HE2  LYS  23           HE2      LYS  23 -10.325  -2.553   8.130
  190    HE3  LYS  23           HE1      LYS  23 -10.941  -3.460   9.518
  191    HZ1  LYS  23           HZ1      LYS  23 -11.853  -0.767   8.620
  192    HZ2  LYS  23           HZ2      LYS  23 -12.440  -1.590   9.990
  193    HZ3  LYS  23           HZ3      LYS  23 -12.697  -2.212   8.461
  194    H    ILE  24           HN       ILE  24  -5.631   0.993  10.722
  195    HA   ILE  24           HA       ILE  24  -4.711   1.821   8.079
  196    HB   ILE  24           HB       ILE  24  -3.088   1.961  10.665
  197   HG12  ILE  24          HG12      ILE  24  -3.169   4.520  10.201
  198   HG13  ILE  24          HG11      ILE  24  -4.554   4.156   9.190
  199   HG21  ILE  24          HG21      ILE  24  -2.477   3.033   7.925
  200   HG22  ILE  24          HG22      ILE  24  -1.773   1.604   8.667
  201   HG23  ILE  24          HG23      ILE  24  -1.454   3.194   9.356
  202   HD11  ILE  24          HD11      ILE  24  -5.265   4.935  11.376
  203   HD12  ILE  24          HD12      ILE  24  -4.328   3.670  12.162
  204   HD13  ILE  24          HD13      ILE  24  -5.717   3.244  11.168
  205    H    TYR  25           HN       TYR  25  -3.697   0.308   6.943
  206    HA   TYR  25           HA       TYR  25  -3.248  -2.323   8.217
  207    HB2  TYR  25           HB2      TYR  25  -3.680  -1.733   5.311
  208    HB3  TYR  25           HB1      TYR  25  -3.600  -3.305   6.069
  209    HD1  TYR  25           HD2      TYR  25  -5.549  -3.863   7.735
  210    HD2  TYR  25           HD1      TYR  25  -5.653  -0.719   4.874
  211    HE1  TYR  25           HE2      TYR  25  -8.015  -3.907   7.762
  212    HE2  TYR  25           HE1      TYR  25  -8.098  -0.776   4.898
  213    HH   TYR  25           HH       TYR  25  -9.783  -2.555   5.374
  214    H    GLU  26           HN       GLU  26  -1.548  -3.570   7.212
  215    HA   GLU  26           HA       GLU  26   0.622  -1.985   6.035
  216    HB2  GLU  26           HB2      GLU  26   0.679  -4.616   7.553
  217    HB3  GLU  26           HB1      GLU  26   2.097  -3.786   6.906
  218    HG2  GLU  26           HG2      GLU  26   1.740  -1.925   8.332
  219    HG3  GLU  26           HG1      GLU  26   0.218  -2.585   8.920
  220    H    ALA  27           HN       ALA  27   1.147  -2.546   3.917
  221    HA   ALA  27           HA       ALA  27   0.082  -5.026   2.817
  222    HB1  ALA  27           HB1      ALA  27  -1.761  -3.414   2.610
  223    HB2  ALA  27           HB2      ALA  27  -1.125  -3.879   1.034
  224    HB3  ALA  27           HB3      ALA  27  -0.693  -2.319   1.732
  225    H    SER  28           HN       SER  28   0.570  -4.897   0.308
  226    HA   SER  28           HA       SER  28   3.240  -3.753  -0.111
  227    HB2  SER  28           HB2      SER  28   2.089  -6.306  -1.262
  228    HB3  SER  28           HB1      SER  28   3.746  -5.716  -1.434
  229    HG   SER  28           HG       SER  28   3.054  -5.821   1.135
  230    H    ILE  29           HN       ILE  29   3.558  -3.039  -2.315
  231    HA   ILE  29           HA       ILE  29   1.088  -2.170  -3.534
  232    HB   ILE  29           HB       ILE  29   3.939  -1.726  -4.478
  233   HG12  ILE  29          HG12      ILE  29   3.566  -0.683  -2.312
  234   HG13  ILE  29          HG11      ILE  29   3.652   0.555  -3.553
  235   HG21  ILE  29          HG21      ILE  29   1.366  -0.433  -5.382
  236   HG22  ILE  29          HG22      ILE  29   2.394  -1.503  -6.337
  237   HG23  ILE  29          HG23      ILE  29   2.979   0.093  -5.856
  238   HD11  ILE  29          HD11      ILE  29   1.901   1.091  -1.998
  239   HD12  ILE  29          HD12      ILE  29   1.154  -0.488  -2.207
  240   HD13  ILE  29          HD13      ILE  29   1.161   0.664  -3.542
  241    H    LYS  30           HN       LYS  30   0.054  -3.079  -5.117
  242    HA   LYS  30           HA       LYS  30   1.136  -5.530  -6.283
  243    HB2  LYS  30           HB2      LYS  30  -0.904  -5.761  -5.001
  244    HB3  LYS  30           HB1      LYS  30  -1.679  -4.490  -5.925
  245    HG2  LYS  30           HG2      LYS  30  -2.527  -6.639  -6.564
  246    HG3  LYS  30           HG1      LYS  30  -1.608  -5.945  -7.899
  247    HD2  LYS  30           HD2      LYS  30   0.274  -7.363  -7.392
  248    HD3  LYS  30           HD1      LYS  30  -0.540  -7.977  -5.947
  249    HE2  LYS  30           HE2      LYS  30  -1.618  -8.232  -8.728
  250    HE3  LYS  30           HE1      LYS  30  -0.653  -9.489  -7.939
  251    HZ1  LYS  30           HZ1      LYS  30  -3.293  -8.457  -6.934
  252    HZ2  LYS  30           HZ2      LYS  30  -2.351  -9.619  -6.223
  253    HZ3  LYS  30           HZ3      LYS  30  -3.027  -9.926  -7.730
  254    H    SER  31           HN       SER  31  -0.648  -2.549  -7.191
  255    HA   SER  31           HA       SER  31   0.699  -2.397  -9.726
  256    HB2  SER  31           HB2      SER  31  -2.325  -2.809  -9.697
  257    HB3  SER  31           HB1      SER  31  -1.346  -2.440 -11.112
  258    HG   SER  31           HG       SER  31  -0.347  -4.563  -9.856
  259    H    THR  32           HN       THR  32  -0.185  -0.306 -10.915
  260    HA   THR  32           HA       THR  32  -1.675   1.497  -9.194
  261    HB   THR  32           HB       THR  32   0.845   2.540 -10.418
  262    HG1  THR  32           HG1      THR  32   0.524   0.930  -8.145
  263   HG21  THR  32          HG21      THR  32   0.645   4.178  -8.643
  264   HG22  THR  32          HG22      THR  32  -0.769   3.328  -8.023
  265   HG23  THR  32          HG23      THR  32  -0.814   4.066  -9.624
  266    H    GLU  33           HN       GLU  33  -2.700   3.049 -10.419
  267    HA   GLU  33           HA       GLU  33  -2.030   3.441 -13.173
  268    HB2  GLU  33           HB2      GLU  33  -4.143   2.840 -14.076
  269    HB3  GLU  33           HB1      GLU  33  -3.350   1.481 -13.221
  270    HG2  GLU  33           HG2      GLU  33  -4.849   1.667 -11.399
  271    HG3  GLU  33           HG1      GLU  33  -5.613   3.101 -12.087
  272    H    ILE  34           HN       ILE  34  -3.521   5.049 -14.144
  273    HA   ILE  34           HA       ILE  34  -4.216   6.942 -12.038
  274    HB   ILE  34           HB       ILE  34  -3.322   7.504 -14.874
  275   HG12  ILE  34          HG12      ILE  34  -1.447   8.796 -13.791
  276   HG13  ILE  34          HG11      ILE  34  -1.985   8.192 -12.238
  277   HG21  ILE  34          HG21      ILE  34  -3.482   9.903 -14.340
  278   HG22  ILE  34          HG22      ILE  34  -4.172   9.491 -12.769
  279   HG23  ILE  34          HG23      ILE  34  -5.046   9.093 -14.243
  280   HD11  ILE  34          HD11      ILE  34  -0.056   6.956 -13.029
  281   HD12  ILE  34          HD12      ILE  34  -0.934   6.512 -14.510
  282   HD13  ILE  34          HD13      ILE  34  -1.500   5.943 -12.939
  283    H    ASP  35           HN       ASP  35  -6.285   7.499 -11.971
  284    HA   ASP  35           HA       ASP  35  -7.953   6.905 -14.331
  285    HB2  ASP  35           HB2      ASP  35  -8.190   5.231 -12.385
  286    HB3  ASP  35           HB1      ASP  35  -8.917   6.556 -11.491
  287    H    ASP  36           HN       ASP  36  -8.243   8.875 -15.019
  288    HA   ASP  36           HA       ASP  36  -8.924  10.999 -15.210
  289    HB2  ASP  36           HB2      ASP  36 -11.083   9.900 -14.433
  290    HB3  ASP  36           HB1      ASP  36 -10.706  10.510 -12.833
  291    H    GLY  37           HN       GLY  37  -6.657  11.269 -14.343
  292    HA2  GLY  37           HA2      GLY  37  -5.430  13.069 -13.547
  293    HA3  GLY  37           HA1      GLY  37  -6.829  13.590 -12.633
  294    H    GLU  38           HN       GLU  38  -6.951  10.826 -11.356
  295    HA   GLU  38           HA       GLU  38  -4.799  11.364  -9.407
  296    HB2  GLU  38           HB2      GLU  38  -6.250  10.268  -7.729
  297    HB3  GLU  38           HB1      GLU  38  -6.976  11.718  -8.399
  298    HG2  GLU  38           HG2      GLU  38  -8.394  10.352  -9.827
  299    HG3  GLU  38           HG1      GLU  38  -7.645   8.892  -9.194
  300    H    VAL  39           HN       VAL  39  -3.617   9.774  -8.563
  301    HA   VAL  39           HA       VAL  39  -3.633   7.404 -10.218
  302    HB   VAL  39           HB       VAL  39  -1.540   8.679 -10.295
  303   HG11  VAL  39          HG11      VAL  39  -1.594   9.748  -8.196
  304   HG12  VAL  39          HG12      VAL  39  -0.067   8.862  -8.357
  305   HG13  VAL  39          HG13      VAL  39  -1.381   8.214  -7.357
  306   HG21  VAL  39          HG21      VAL  39  -1.439   6.253 -10.586
  307   HG22  VAL  39          HG22      VAL  39  -1.194   6.025  -8.869
  308   HG23  VAL  39          HG23      VAL  39   0.036   6.825  -9.827
  309    H    LEU  40           HN       LEU  40  -4.213   5.630  -9.542
  310    HA   LEU  40           HA       LEU  40  -4.808   5.265  -6.716
  311    HB2  LEU  40           HB2      LEU  40  -6.015   3.964  -9.142
  312    HB3  LEU  40           HB1      LEU  40  -6.476   3.679  -7.473
  313    HG   LEU  40           HG       LEU  40  -6.816   6.255  -8.992
  314   HD11  LEU  40          HD11      LEU  40  -8.340   4.515  -9.713
  315   HD12  LEU  40          HD12      LEU  40  -9.202   5.758  -8.806
  316   HD13  LEU  40          HD13      LEU  40  -8.818   4.215  -8.042
  317   HD21  LEU  40          HD21      LEU  40  -6.359   6.682  -6.649
  318   HD22  LEU  40          HD22      LEU  40  -7.590   5.514  -6.168
  319   HD23  LEU  40          HD23      LEU  40  -8.053   7.000  -7.004
  320    H    TYR  41           HN       TYR  41  -4.136   3.578  -5.795
  321    HA   TYR  41           HA       TYR  41  -2.180   1.873  -7.120
  322    HB2  TYR  41           HB2      TYR  41  -2.455   2.844  -4.291
  323    HB3  TYR  41           HB1      TYR  41  -1.457   1.461  -4.709
  324    HD1  TYR  41           HD1      TYR  41  -1.942   5.076  -5.538
  325    HD2  TYR  41           HD2      TYR  41   0.718   1.778  -5.312
  326    HE1  TYR  41           HE1      TYR  41  -0.039   6.572  -6.017
  327    HE2  TYR  41           HE2      TYR  41   2.604   3.250  -5.789
  328    HH   TYR  41           HH       TYR  41   3.036   5.376  -6.849
  329    H    LEU  42           HN       LEU  42  -2.310  -0.210  -6.851
  330    HA   LEU  42           HA       LEU  42  -4.667  -1.314  -5.526
  331    HB2  LEU  42           HB2      LEU  42  -4.359  -1.779  -7.989
  332    HB3  LEU  42           HB1      LEU  42  -2.812  -2.499  -7.612
  333    HG   LEU  42           HG       LEU  42  -3.964  -4.268  -6.323
  334   HD11  LEU  42          HD11      LEU  42  -5.932  -3.127  -5.617
  335   HD12  LEU  42          HD12      LEU  42  -6.436  -4.480  -6.648
  336   HD13  LEU  42          HD13      LEU  42  -6.419  -2.843  -7.279
  337   HD21  LEU  42          HD21      LEU  42  -4.928  -5.440  -8.248
  338   HD22  LEU  42          HD22      LEU  42  -3.410  -4.648  -8.668
  339   HD23  LEU  42          HD23      LEU  42  -4.946  -3.929  -9.158
  340    H    VAL  43           HN       VAL  43  -4.127  -2.140  -3.626
  341    HA   VAL  43           HA       VAL  43  -1.322  -2.869  -3.186
  342    HB   VAL  43           HB       VAL  43  -1.430  -2.049  -0.923
  343   HG11  VAL  43          HG11      VAL  43  -0.873  -0.410  -2.560
  344   HG12  VAL  43          HG12      VAL  43  -1.756   0.321  -1.221
  345   HG13  VAL  43          HG13      VAL  43  -2.572   0.015  -2.753
  346   HG21  VAL  43          HG21      VAL  43  -3.756  -2.644  -0.363
  347   HG22  VAL  43          HG22      VAL  43  -4.340  -1.371  -1.437
  348   HG23  VAL  43          HG23      VAL  43  -3.442  -0.949   0.020
  349    H    HIS  44           HN       HIS  44  -0.927  -4.549  -1.912
  350    HA   HIS  44           HA       HIS  44  -3.088  -6.531  -1.726
  351    HB2  HIS  44           HB2      HIS  44  -1.557  -7.094  -3.513
  352    HB3  HIS  44           HB1      HIS  44  -0.167  -6.841  -2.464
  353    HD1  HIS  44           HD1      HIS  44  -3.043  -9.127  -2.974
  354    HD2  HIS  44           HD2      HIS  44   0.628  -9.078  -1.080
  355    HE1  HIS  44           HE1      HIS  44  -2.689 -11.503  -2.088
  356    HE2  HIS  44           HE2      HIS  44  -0.269 -11.450  -1.435
  357    H    TYR  45           HN       TYR  45  -3.506  -6.893   0.347
  358    HA   TYR  45           HA       TYR  45  -1.651  -6.396   2.456
  359    HB2  TYR  45           HB2      TYR  45  -4.161  -8.110   2.490
  360    HB3  TYR  45           HB1      TYR  45  -3.355  -7.414   3.893
  361    HD1  TYR  45           HD2      TYR  45  -3.093  -4.786   3.793
  362    HD2  TYR  45           HD1      TYR  45  -5.999  -6.999   1.625
  363    HE1  TYR  45           HE2      TYR  45  -4.463  -2.764   3.569
  364    HE2  TYR  45           HE1      TYR  45  -7.370  -4.970   1.390
  365    HH   TYR  45           HH       TYR  45  -7.666  -2.826   2.588
  366    H    TYR  46           HN       TYR  46  -0.166  -7.799   3.295
  367    HA   TYR  46           HA       TYR  46   0.377  -9.988   1.572
  368    HB2  TYR  46           HB2      TYR  46   2.478 -10.332   2.881
  369    HB3  TYR  46           HB1      TYR  46   2.302  -8.731   2.196
  370    HD1  TYR  46           HD2      TYR  46   2.403 -10.700   5.285
  371    HD2  TYR  46           HD1      TYR  46   2.093  -6.783   3.652
  372    HE1  TYR  46           HE2      TYR  46   2.933  -9.747   7.486
  373    HE2  TYR  46           HE1      TYR  46   2.635  -5.822   5.853
  374    HH   TYR  46           HH       TYR  46   3.851  -7.719   8.400
  375    H    GLY  47           HN       GLY  47  -1.494  -9.798   4.243
  376    HA2  GLY  47           HA2      GLY  47  -1.139 -12.401   5.300
  377    HA3  GLY  47           HA1      GLY  47  -2.607 -11.426   5.414
  378    H    TRP  48           HN       TRP  48  -3.764 -11.194   3.185
  379    HA   TRP  48           HA       TRP  48  -3.456 -13.223   1.265
  380    HB2  TRP  48           HB2      TRP  48  -4.528 -14.461   3.279
  381    HB3  TRP  48           HB1      TRP  48  -5.975 -13.521   2.917
  382    HD1  TRP  48           HD1      TRP  48  -7.524 -14.433   1.001
  383    HE1  TRP  48           HE1      TRP  48  -7.372 -16.425  -0.639
  384    HE3  TRP  48           HE3      TRP  48  -2.705 -15.886   1.906
  385    HZ2  TRP  48           HZ2      TRP  48  -5.480 -18.342  -1.426
  386    HZ3  TRP  48           HZ3      TRP  48  -1.799 -17.806   0.668
  387    HH2  TRP  48           HH2      TRP  48  -3.160 -19.008  -0.967
  388    H    ASN  49           HN       ASN  49  -5.141 -13.037  -0.385
  389    HA   ASN  49           HA       ASN  49  -5.787 -10.373  -1.065
  390    HB2  ASN  49           HB2      ASN  49  -6.828 -13.006  -2.171
  391    HB3  ASN  49           HB1      ASN  49  -7.035 -11.434  -2.934
  392   HD21  ASN  49          HD21      ASN  49  -5.295 -10.492  -3.976
  393   HD22  ASN  49          HD22      ASN  49  -3.844 -11.357  -4.344
  394    H    VAL  50           HN       VAL  50  -7.507  -9.181  -0.456
  395    HA   VAL  50           HA       VAL  50  -9.504 -10.432   1.173
  396    HB   VAL  50           HB       VAL  50 -10.461  -8.083   1.485
  397   HG11  VAL  50          HG11      VAL  50  -7.563  -8.571   2.153
  398   HG12  VAL  50          HG12      VAL  50  -8.958  -9.077   3.104
  399   HG13  VAL  50          HG13      VAL  50  -8.587  -7.363   2.923
  400   HG21  VAL  50          HG21      VAL  50  -9.009  -6.201   0.863
  401   HG22  VAL  50          HG22      VAL  50  -9.607  -7.032  -0.563
  402   HG23  VAL  50          HG23      VAL  50  -7.949  -7.297  -0.020
  403    H    ARG  51           HN       ARG  51 -10.014  -8.260  -1.623
  404    HA   ARG  51           HA       ARG  51 -12.287  -9.976  -2.388
  405    HB2  ARG  51           HB2      ARG  51 -11.587  -7.152  -3.300
  406    HB3  ARG  51           HB1      ARG  51 -12.986  -8.067  -3.839
  407    HG2  ARG  51           HG2      ARG  51 -12.507  -7.220  -0.983
  408    HG3  ARG  51           HG1      ARG  51 -13.504  -6.334  -2.135
  409    HD2  ARG  51           HD2      ARG  51 -13.980  -9.194  -1.285
  410    HD3  ARG  51           HD1      ARG  51 -14.803  -7.795  -0.597
  411    HE   ARG  51           HE       ARG  51 -15.156  -7.638  -3.322
  412   HH11  ARG  51          HH11      ARG  51 -16.073  -9.949  -0.796
  413   HH12  ARG  51          HH12      ARG  51 -17.496 -10.441  -1.569
  414   HH21  ARG  51          HH21      ARG  51 -17.092  -8.317  -4.378
  415   HH22  ARG  51          HH22      ARG  51 -18.099  -9.500  -3.671
  416    H    TYR  52           HN       TYR  52  -9.821  -8.008  -3.758
  417    HA   TYR  52           HA       TYR  52  -8.651 -10.314  -5.080
  418    HB2  TYR  52           HB2      TYR  52  -9.060  -7.553  -6.320
  419    HB3  TYR  52           HB1      TYR  52  -7.932  -8.730  -6.953
  420    HD1  TYR  52           HD1      TYR  52  -9.110 -11.119  -7.421
  421    HD2  TYR  52           HD2      TYR  52 -11.061  -7.349  -7.408
  422    HE1  TYR  52           HE1      TYR  52 -10.850 -12.021  -8.904
  423    HE2  TYR  52           HE2      TYR  52 -12.812  -8.248  -8.869
  424    HH   TYR  52           HH       TYR  52 -12.912 -10.167 -10.623
  425    H    ASP  53           HN       ASP  53  -8.464  -6.923  -4.473
  426    HA   ASP  53           HA       ASP  53  -6.380  -6.930  -2.604
  427    HB2  ASP  53           HB2      ASP  53  -5.761  -5.831  -5.401
  428    HB3  ASP  53           HB1      ASP  53  -4.803  -5.473  -3.976
  429    H    GLU  54           HN       GLU  54  -5.846  -4.158  -2.713
  430    HA   GLU  54           HA       GLU  54  -8.580  -3.091  -2.956
  431    HB2  GLU  54           HB2      GLU  54  -8.072  -3.702  -0.584
  432    HB3  GLU  54           HB1      GLU  54  -6.724  -2.582  -0.614
  433    HG2  GLU  54           HG2      GLU  54  -8.750  -1.695   0.504
  434    HG3  GLU  54           HG1      GLU  54  -8.207  -0.714  -0.861
  435    H    TRP  55           HN       TRP  55  -8.779  -0.852  -3.102
  436    HA   TRP  55           HA       TRP  55  -6.599   0.305  -4.686
  437    HB2  TRP  55           HB2      TRP  55  -9.579   0.630  -4.838
  438    HB3  TRP  55           HB1      TRP  55  -8.439   1.626  -5.732
  439    HD1  TRP  55           HD1      TRP  55  -9.784  -1.966  -5.571
  440    HE1  TRP  55           HE1      TRP  55  -9.247  -3.104  -7.824
  441    HE3  TRP  55           HE3      TRP  55  -6.816   1.636  -7.569
  442    HZ2  TRP  55           HZ2      TRP  55  -7.701  -2.533 -10.140
  443    HZ3  TRP  55           HZ3      TRP  55  -5.824   1.284  -9.761
  444    HH2  TRP  55           HH2      TRP  55  -6.242  -0.748 -11.030
  445    H    VAL  56           HN       VAL  56  -5.616   1.925  -3.777
  446    HA   VAL  56           HA       VAL  56  -7.142   3.874  -2.239
  447    HB   VAL  56           HB       VAL  56  -5.204   4.127  -0.648
  448   HG11  VAL  56          HG11      VAL  56  -5.742   2.183   0.735
  449   HG12  VAL  56          HG12      VAL  56  -6.494   1.401  -0.653
  450   HG13  VAL  56          HG13      VAL  56  -7.195   2.875   0.011
  451   HG21  VAL  56          HG21      VAL  56  -3.474   3.086  -2.024
  452   HG22  VAL  56          HG22      VAL  56  -4.288   1.529  -1.883
  453   HG23  VAL  56          HG23      VAL  56  -3.587   2.289  -0.457
  454    H    LYS  57           HN       LYS  57  -6.040   5.968  -2.151
  455    HA   LYS  57           HA       LYS  57  -4.780   6.485  -4.712
  456    HB2  LYS  57           HB2      LYS  57  -6.811   7.711  -4.008
  457    HB3  LYS  57           HB1      LYS  57  -5.960   8.326  -2.614
  458    HG2  LYS  57           HG2      LYS  57  -4.671   9.778  -3.923
  459    HG3  LYS  57           HG1      LYS  57  -5.117   8.957  -5.431
  460    HD2  LYS  57           HD2      LYS  57  -7.383   9.690  -5.279
  461    HD3  LYS  57           HD1      LYS  57  -7.164  10.266  -3.630
  462    HE2  LYS  57           HE2      LYS  57  -5.687  11.445  -5.969
  463    HE3  LYS  57           HE1      LYS  57  -7.289  11.995  -5.495
  464    HZ1  LYS  57           HZ1      LYS  57  -6.497  12.707  -3.441
  465    HZ2  LYS  57           HZ2      LYS  57  -5.306  13.249  -4.519
  466    HZ3  LYS  57           HZ3      LYS  57  -5.062  11.876  -3.571
  467    H    ALA  58           HN       ALA  58  -2.988   8.233  -4.663
  468    HA   ALA  58           HA       ALA  58  -0.742   7.079  -3.456
  469    HB1  ALA  58           HB1      ALA  58   0.515   8.952  -4.320
  470    HB2  ALA  58           HB2      ALA  58  -0.973   9.874  -4.538
  471    HB3  ALA  58           HB3      ALA  58  -0.683   8.430  -5.505
  472    H    ASP  59           HN       ASP  59  -2.761   9.606  -2.313
  473    HA   ASP  59           HA       ASP  59  -0.907  10.428  -0.229
  474    HB2  ASP  59           HB2      ASP  59  -2.766  11.971   0.471
  475    HB3  ASP  59           HB1      ASP  59  -2.172  12.212  -1.165
  476    H    ARG  60           HN       ARG  60  -2.805   7.855  -0.536
  477    HA   ARG  60           HA       ARG  60  -3.819   7.816   2.235
  478    HB2  ARG  60           HB2      ARG  60  -5.062   7.251  -0.055
  479    HB3  ARG  60           HB1      ARG  60  -4.273   5.708   0.186
  480    HG2  ARG  60           HG2      ARG  60  -6.489   5.585   1.020
  481    HG3  ARG  60           HG1      ARG  60  -5.379   5.560   2.397
  482    HD2  ARG  60           HD2      ARG  60  -5.792   7.889   2.835
  483    HD3  ARG  60           HD1      ARG  60  -6.763   8.024   1.370
  484    HE   ARG  60           HE       ARG  60  -7.490   6.335   3.645
  485   HH11  ARG  60          HH11      ARG  60  -8.373   8.720   1.137
  486   HH12  ARG  60          HH12      ARG  60  -9.994   8.834   1.590
  487   HH21  ARG  60          HH21      ARG  60  -9.762   6.518   4.288
  488   HH22  ARG  60          HH22      ARG  60 -10.816   7.530   3.414
  489    H    ILE  61           HN       ILE  61  -1.050   7.209   0.784
  490    HA   ILE  61           HA       ILE  61  -0.507   4.521   1.887
  491    HB   ILE  61           HB       ILE  61   1.437   5.997   0.170
  492   HG12  ILE  61          HG12      ILE  61  -0.803   6.143  -1.033
  493   HG13  ILE  61          HG11      ILE  61   0.507   5.375  -1.908
  494   HG21  ILE  61          HG21      ILE  61   2.014   3.771  -0.595
  495   HG22  ILE  61          HG22      ILE  61   0.706   3.114   0.396
  496   HG23  ILE  61          HG23      ILE  61   2.079   3.926   1.168
  497   HD11  ILE  61          HD11      ILE  61  -1.560   4.262  -2.210
  498   HD12  ILE  61          HD12      ILE  61  -1.666   3.990  -0.436
  499   HD13  ILE  61          HD13      ILE  61  -0.341   3.272  -1.386
  500    H    ILE  62           HN       ILE  62   1.214   4.366   3.392
  501    HA   ILE  62           HA       ILE  62   2.808   6.787   3.853
  502    HB   ILE  62           HB       ILE  62   2.668   4.315   5.618
  503   HG12  ILE  62          HG12      ILE  62   1.846   6.111   7.354
  504   HG13  ILE  62          HG11      ILE  62   1.330   6.974   5.911
  505   HG21  ILE  62          HG21      ILE  62   4.842   5.333   5.671
  506   HG22  ILE  62          HG22      ILE  62   4.021   5.548   7.213
  507   HG23  ILE  62          HG23      ILE  62   4.128   6.897   6.075
  508   HD11  ILE  62          HD11      ILE  62  -0.046   4.984   5.290
  509   HD12  ILE  62          HD12      ILE  62  -0.484   5.768   6.816
  510   HD13  ILE  62          HD13      ILE  62   0.393   4.258   6.854
  511    H    TRP  63           HN       TRP  63   4.461   6.695   2.583
  512    HA   TRP  63           HA       TRP  63   5.492   4.190   1.694
  513    HB2  TRP  63           HB2      TRP  63   6.246   7.036   1.025
  514    HB3  TRP  63           HB1      TRP  63   7.092   5.637   0.362
  515    HD1  TRP  63           HD1      TRP  63   3.754   7.498   0.118
  516    HE1  TRP  63           HE1      TRP  63   2.446   6.564  -1.911
  517    HE3  TRP  63           HE3      TRP  63   6.785   3.574  -1.080
  518    HZ2  TRP  63           HZ2      TRP  63   2.692   4.477  -3.753
  519    HZ3  TRP  63           HZ3      TRP  63   6.178   2.150  -2.991
  520    HH2  TRP  63           HH2      TRP  63   4.171   2.597  -4.297
  521    HA   PRO  64           HA       PRO  64   8.369   3.367   4.898
  522    HB2  PRO  64           HB2      PRO  64  10.093   2.437   2.658
  523    HB3  PRO  64           HB1      PRO  64   9.639   1.604   4.148
  524    HG2  PRO  64           HG2      PRO  64   8.489   0.943   1.857
  525    HG3  PRO  64           HG1      PRO  64   7.547   1.012   3.354
  526    HD2  PRO  64           HD2      PRO  64   7.593   2.928   1.067
  527    HD3  PRO  64           HD1      PRO  64   6.264   2.450   2.152
  528    H    LEU  65           HN       LEU  65   9.409   4.653   5.899
  529    HA   LEU  65           HA       LEU  65  11.843   5.844   5.154
  530    HB2  LEU  65           HB2      LEU  65   9.913   7.206   3.983
  531    HB3  LEU  65           HB1      LEU  65   9.591   7.768   5.605
  532    HG   LEU  65           HG       LEU  65  12.208   8.189   4.160
  533   HD11  LEU  65          HD11      LEU  65  10.379   9.255   3.031
  534   HD12  LEU  65          HD12      LEU  65  11.407  10.454   3.825
  535   HD13  LEU  65          HD13      LEU  65   9.853   9.991   4.542
  536   HD21  LEU  65          HD21      LEU  65  12.629   9.863   5.881
  537   HD22  LEU  65          HD22      LEU  65  12.337   8.277   6.620
  538   HD23  LEU  65          HD23      LEU  65  11.069   9.499   6.628
  539    H    ASP  66           HN       ASP  66  11.803   4.383   7.041
  540    HA   ASP  66           HA       ASP  66  11.838   3.861   9.209
  541    HB2  ASP  66           HB2      ASP  66  13.438   5.726   9.297
  542    HB3  ASP  66           HB1      ASP  66  12.098   6.847   9.531
  543    H    LYS  67           HN       LYS  67   9.419   3.859   8.171
  544    HA   LYS  67           HA       LYS  67   7.854   4.469  10.519
  545    HB2  LYS  67           HB2      LYS  67   6.965   5.129   7.749
  546    HB3  LYS  67           HB1      LYS  67   5.850   4.859   9.069
  547    HG2  LYS  67           HG2      LYS  67   7.316   6.601  10.246
  548    HG3  LYS  67           HG1      LYS  67   7.703   7.099   8.576
  549    HD2  LYS  67           HD2      LYS  67   5.153   6.956   8.201
  550    HD3  LYS  67           HD1      LYS  67   5.033   6.963   9.956
  551    HE2  LYS  67           HE2      LYS  67   6.055   9.149   8.144
  552    HE3  LYS  67           HE1      LYS  67   4.627   9.109   9.177
  553    HZ1  LYS  67           HZ1      LYS  67   6.045   9.238  11.146
  554    HZ2  LYS  67           HZ2      LYS  67   6.431  10.454  10.086
  555    HZ3  LYS  67           HZ3      LYS  67   7.429   9.124  10.175
  556    H    GLY  68           HN       GLY  68   7.774   2.483  11.210
  557    HA2  GLY  68           HA2      GLY  68   6.455   0.565   9.565
  558    HA3  GLY  68           HA1      GLY  68   6.691   0.458  11.346
  559    H    LEU  69           HN       LEU  69   5.847   3.145  11.687
  560    HA   LEU  69           HA       LEU  69   3.729   4.140  10.727
  561    HB2  LEU  69           HB2      LEU  69   2.420   2.170  11.587
  562    HB3  LEU  69           HB1      LEU  69   2.992   2.560  13.201
  563    HG   LEU  69           HG       LEU  69   1.818   4.642  13.214
  564   HD11  LEU  69          HD11      LEU  69   0.498   5.404  11.259
  565   HD12  LEU  69          HD12      LEU  69   1.129   4.007  10.347
  566   HD13  LEU  69          HD13      LEU  69   2.228   5.241  10.927
  567   HD21  LEU  69          HD21      LEU  69  -0.493   3.858  13.015
  568   HD22  LEU  69          HD22      LEU  69   0.540   2.645  13.786
  569   HD23  LEU  69          HD23      LEU  69   0.070   2.458  12.095
  570    H    GLU  70           HN       GLU  70   3.526   6.101  11.834
  571    HA   GLU  70           HA       GLU  70   5.717   6.789  13.502
  572    HB2  GLU  70           HB2      GLU  70   4.627   8.334  11.889
  573    HB3  GLU  70           HB1      GLU  70   3.171   8.290  12.865
  574    HG2  GLU  70           HG2      GLU  70   4.332   9.371  14.692
  575    HG3  GLU  70           HG1      GLU  70   5.839   9.338  13.778
  576    H    HIS  71           HN       HIS  71   5.620   7.283  15.746
  577    HA   HIS  71           HA       HIS  71   3.519   5.885  17.138
  578    HB2  HIS  71           HB2      HIS  71   5.930   7.366  18.256
  579    HB3  HIS  71           HB1      HIS  71   4.814   6.397  19.204
  580    HD1  HIS  71           HD1      HIS  71   7.811   6.140  17.052
  581    HD2  HIS  71           HD2      HIS  71   5.000   3.566  18.704
  582    HE1  HIS  71           HE1      HIS  71   8.770   3.870  16.813
  583    HE2  HIS  71           HE2      HIS  71   7.018   2.314  17.675
  584    H    HIS  72           HN       HIS  72   2.111   7.410  16.091
  585    HA   HIS  72           HA       HIS  72   1.995  10.113  17.151
  586    HB2  HIS  72           HB2      HIS  72   1.700   9.424  14.688
  587    HB3  HIS  72           HB1      HIS  72   0.122   8.834  15.171
  588    HD1  HIS  72           HD1      HIS  72   1.921  11.793  14.121
  589    HD2  HIS  72           HD2      HIS  72  -1.661  10.996  16.069
  590    HE1  HIS  72           HE1      HIS  72   0.552  13.908  13.924
  591    HE2  HIS  72           HE2      HIS  72  -1.509  13.468  15.272
  592    H    HIS  73           HN       HIS  73   0.484   7.012  17.549
  593    HA   HIS  73           HA       HIS  73  -1.559   8.291  19.209
  594    HB2  HIS  73           HB2      HIS  73  -1.720   5.621  17.784
  595    HB3  HIS  73           HB1      HIS  73  -2.865   6.153  19.001
  596    HD1  HIS  73           HD1      HIS  73  -4.767   7.678  18.210
  597    HD2  HIS  73           HD2      HIS  73  -1.822   7.053  15.344
  598    HE1  HIS  73           HE1      HIS  73  -5.679   8.639  16.094
  599    HE2  HIS  73           HE2      HIS  73  -3.802   8.423  14.424
  600    H    HIS  74           HN       HIS  74  -1.852   7.587  21.219
  601    HA   HIS  74           HA       HIS  74  -0.342   5.271  22.162
  602    HB2  HIS  74           HB2      HIS  74   0.905   7.425  22.746
  603    HB3  HIS  74           HB1      HIS  74  -0.504   7.903  23.689
  604    HD1  HIS  74           HD1      HIS  74  -0.251   7.378  26.123
  605    HD2  HIS  74           HD2      HIS  74   1.874   4.720  23.731
  606    HE1  HIS  74           HE1      HIS  74   0.896   5.826  27.702
  607    HE2  HIS  74           HE2      HIS  74   2.369   4.410  26.241
  608    H    HIS  75           HN       HIS  75  -2.947   5.780  21.281
  609    HA   HIS  75           HA       HIS  75  -4.479   4.964  23.559
  610    HB2  HIS  75           HB2      HIS  75  -4.849   7.364  23.644
  611    HB3  HIS  75           HB1      HIS  75  -5.149   7.418  21.913
  612    HD1  HIS  75           HD1      HIS  75  -7.541   7.256  21.197
  613    HD2  HIS  75           HD2      HIS  75  -6.984   5.918  25.096
  614    HE1  HIS  75           HE1      HIS  75  -9.825   6.820  22.084
  615    HE2  HIS  75           HE2      HIS  75  -9.448   5.752  24.314
  616    H    HIS  76           HN       HIS  76  -5.535   3.289  22.898
  617    HA   HIS  76           HA       HIS  76  -6.037   2.859  20.082
  618    HB2  HIS  76           HB2      HIS  76  -5.021   1.001  21.308
  619    HB3  HIS  76           HB1      HIS  76  -6.307   1.058  22.508
  620    HD1  HIS  76           HD1      HIS  76  -8.317  -0.375  22.061
  621    HD2  HIS  76           HD2      HIS  76  -5.955   0.150  18.687
  622    HE1  HIS  76           HE1      HIS  76  -9.271  -1.894  20.329
  623    HE2  HIS  76           HE2      HIS  76  -7.663  -1.747  18.410
  Start of MODEL    4
    1    H1   GLU   1           HT1      GLU   1  19.592  -5.197 -15.162
    2    H2   GLU   1           HT2      GLU   1  18.512  -4.726 -16.359
    3    H3   GLU   1           HT3      GLU   1  18.215  -6.118 -15.468
    4    HA   GLU   1           HA       GLU   1  17.936  -4.832 -13.485
    5    HB2  GLU   1           HB2      GLU   1  18.344  -2.484 -15.340
    6    HB3  GLU   1           HB1      GLU   1  17.780  -2.371 -13.679
    7    HG2  GLU   1           HG2      GLU   1  20.451  -3.425 -14.576
    8    HG3  GLU   1           HG1      GLU   1  20.134  -1.867 -13.810
    9    H    ASP   2           HN       ASP   2  15.974  -5.772 -13.471
   10    HA   ASP   2           HA       ASP   2  13.814  -4.243 -14.588
   11    HB2  ASP   2           HB2      ASP   2  12.775  -6.043 -15.820
   12    HB3  ASP   2           HB1      ASP   2  14.421  -5.897 -16.408
   13    H    MET   3           HN       MET   3  11.770  -4.940 -13.704
   14    HA   MET   3           HA       MET   3  11.430  -6.883 -11.728
   15    HB2  MET   3           HB2      MET   3  12.819  -5.659 -10.203
   16    HB3  MET   3           HB1      MET   3  12.088  -4.132 -10.663
   17    HG2  MET   3           HG2      MET   3  11.251  -4.734  -8.461
   18    HG3  MET   3           HG1      MET   3   9.951  -4.861  -9.637
   19    HE1  MET   3           HE1      MET   3   9.043  -7.667  -7.087
   20    HE2  MET   3           HE2      MET   3   8.488  -6.224  -7.937
   21    HE3  MET   3           HE3      MET   3   9.768  -6.098  -6.737
   22    H    GLU   4           HN       GLU   4   9.565  -7.072 -13.028
   23    HA   GLU   4           HA       GLU   4   7.318  -6.849 -13.416
   24    HB2  GLU   4           HB2      GLU   4   7.650  -5.952 -10.536
   25    HB3  GLU   4           HB1      GLU   4   6.110  -6.402 -11.250
   26    HG2  GLU   4           HG2      GLU   4   8.491  -8.211 -11.008
   27    HG3  GLU   4           HG1      GLU   4   7.078  -8.217  -9.949
   28    HA   PRO   5           HA       PRO   5   5.870  -2.374 -13.879
   29    HB2  PRO   5           HB2      PRO   5   4.429  -2.575 -11.343
   30    HB3  PRO   5           HB1      PRO   5   3.841  -1.799 -12.845
   31    HG2  PRO   5           HG2      PRO   5   2.835  -4.135 -12.234
   32    HG3  PRO   5           HG1      PRO   5   3.536  -3.982 -13.858
   33    HD2  PRO   5           HD2      PRO   5   4.710  -5.160 -11.396
   34    HD3  PRO   5           HD1      PRO   5   4.701  -5.840 -13.047
   35    H    CYS   6           HN       CYS   6   6.124  -0.247 -12.771
   36    HA   CYS   6           HA       CYS   6   8.443  -0.099 -11.177
   37    HB2  CYS   6           HB2      CYS   6   7.848   2.325 -11.067
   38    HB3  CYS   6           HB1      CYS   6   7.853   1.670 -12.704
   39    HG   CYS   6           HG       CYS   6   4.960   1.717 -10.990
   40    H    LEU   7           HN       LEU   7   8.720   0.506  -9.019
   41    HA   LEU   7           HA       LEU   7   8.506   0.179  -6.913
   42    HB2  LEU   7           HB2      LEU   7   6.914   1.653  -5.618
   43    HB3  LEU   7           HB1      LEU   7   8.000   2.442  -6.715
   44    HG   LEU   7           HG       LEU   7   5.819   3.525  -6.535
   45   HD11  LEU   7          HD11      LEU   7   6.327   2.458  -9.272
   46   HD12  LEU   7          HD12      LEU   7   7.017   3.905  -8.539
   47   HD13  LEU   7          HD13      LEU   7   5.287   3.825  -8.874
   48   HD21  LEU   7          HD21      LEU   7   3.807   2.520  -7.563
   49   HD22  LEU   7          HD22      LEU   7   4.365   1.689  -6.115
   50   HD23  LEU   7          HD23      LEU   7   4.687   0.994  -7.707
   51    H    THR   8           HN       THR   8   6.968  -1.856  -8.353
   52    HA   THR   8           HA       THR   8   5.018  -2.630  -6.412
   53    HB   THR   8           HB       THR   8   4.851  -4.718  -7.762
   54    HG1  THR   8           HG1      THR   8   6.542  -3.517  -9.720
   55   HG21  THR   8          HG21      THR   8   3.458  -2.769  -8.233
   56   HG22  THR   8          HG22      THR   8   3.862  -3.639  -9.707
   57   HG23  THR   8          HG23      THR   8   4.706  -2.134  -9.307
   58    H    GLY   9           HN       GLY   9   5.098  -4.579  -5.198
   59    HA2  GLY   9           HA2      GLY   9   6.218  -6.372  -4.146
   60    HA3  GLY   9           HA1      GLY   9   7.748  -5.740  -4.746
   61    H    THR  10           HN       THR  10   7.093  -3.017  -3.883
   62    HA   THR  10           HA       THR  10   8.283  -3.045  -1.361
   63    HB   THR  10           HB       THR  10   6.704  -0.867  -2.710
   64    HG1  THR  10           HG1      THR  10   9.422  -1.689  -2.830
   65   HG21  THR  10          HG21      THR  10   7.156  -0.376  -0.350
   66   HG22  THR  10          HG22      THR  10   8.123   0.676  -1.379
   67   HG23  THR  10          HG23      THR  10   8.867  -0.713  -0.587
   68    H    LYS  11           HN       LYS  11   7.456  -3.151   0.557
   69    HA   LYS  11           HA       LYS  11   4.562  -3.376   0.891
   70    HB2  LYS  11           HB2      LYS  11   6.762  -4.164   2.825
   71    HB3  LYS  11           HB1      LYS  11   5.037  -4.546   2.923
   72    HG2  LYS  11           HG2      LYS  11   5.102  -6.004   1.111
   73    HG3  LYS  11           HG1      LYS  11   6.666  -5.414   0.573
   74    HD2  LYS  11           HD2      LYS  11   7.680  -6.407   2.609
   75    HD3  LYS  11           HD1      LYS  11   6.094  -7.054   3.038
   76    HE2  LYS  11           HE2      LYS  11   7.521  -8.710   1.888
   77    HE3  LYS  11           HE1      LYS  11   6.027  -8.365   1.016
   78    HZ1  LYS  11           HZ1      LYS  11   8.685  -7.170   0.373
   79    HZ2  LYS  11           HZ2      LYS  11   7.264  -6.963  -0.518
   80    HZ3  LYS  11           HZ3      LYS  11   7.988  -8.475  -0.415
   81    H    VAL  12           HN       VAL  12   3.575  -1.746   1.575
   82    HA   VAL  12           HA       VAL  12   4.976   0.363   3.050
   83    HB   VAL  12           HB       VAL  12   3.474   1.975   1.925
   84   HG11  VAL  12          HG11      VAL  12   5.072   0.264   0.029
   85   HG12  VAL  12          HG12      VAL  12   5.717   1.567   1.024
   86   HG13  VAL  12          HG13      VAL  12   4.564   1.924  -0.269
   87   HG21  VAL  12          HG21      VAL  12   2.170   1.296  -0.012
   88   HG22  VAL  12          HG22      VAL  12   1.639   0.414   1.422
   89   HG23  VAL  12          HG23      VAL  12   2.662  -0.381   0.221
   90    H    LYS  13           HN       LYS  13   3.098   1.915   3.807
   91    HA   LYS  13           HA       LYS  13   1.310   0.303   5.467
   92    HB2  LYS  13           HB2      LYS  13   3.089   2.527   5.849
   93    HB3  LYS  13           HB1      LYS  13   1.451   2.986   6.271
   94    HG2  LYS  13           HG2      LYS  13   2.832   0.570   7.339
   95    HG3  LYS  13           HG1      LYS  13   2.855   2.163   8.160
   96    HD2  LYS  13           HD2      LYS  13   0.301   1.926   7.873
   97    HD3  LYS  13           HD1      LYS  13   0.644   0.204   7.723
   98    HE2  LYS  13           HE2      LYS  13   1.350   2.042   9.970
   99    HE3  LYS  13           HE1      LYS  13   0.133   0.776  10.012
  100    HZ1  LYS  13           HZ1      LYS  13   3.080   0.286   9.727
  101    HZ2  LYS  13           HZ2      LYS  13   1.914  -0.914   9.852
  102    HZ3  LYS  13           HZ3      LYS  13   2.195   0.116  11.139
  103    H    VAL  14           HN       VAL  14  -0.886   0.757   5.242
  104    HA   VAL  14           HA       VAL  14  -1.612   2.834   3.308
  105    HB   VAL  14           HB       VAL  14  -2.727   0.011   3.446
  106   HG11  VAL  14          HG11      VAL  14  -4.059   0.661   1.460
  107   HG12  VAL  14          HG12      VAL  14  -3.534   2.330   1.706
  108   HG13  VAL  14          HG13      VAL  14  -4.518   1.527   2.924
  109   HG21  VAL  14          HG21      VAL  14  -1.171   1.385   1.255
  110   HG22  VAL  14          HG22      VAL  14  -1.818  -0.255   1.203
  111   HG23  VAL  14          HG23      VAL  14  -0.546   0.157   2.351
  112    H    LYS  15           HN       LYS  15  -3.343   3.992   3.824
  113    HA   LYS  15           HA       LYS  15  -4.694   3.423   6.368
  114    HB2  LYS  15           HB2      LYS  15  -3.480   5.548   6.280
  115    HB3  LYS  15           HB1      LYS  15  -4.336   5.996   4.813
  116    HG2  LYS  15           HG2      LYS  15  -6.459   5.958   6.093
  117    HG3  LYS  15           HG1      LYS  15  -5.524   5.644   7.557
  118    HD2  LYS  15           HD2      LYS  15  -5.232   8.068   5.779
  119    HD3  LYS  15           HD1      LYS  15  -6.111   8.017   7.305
  120    HE2  LYS  15           HE2      LYS  15  -4.027   7.422   8.463
  121    HE3  LYS  15           HE1      LYS  15  -3.160   7.517   6.931
  122    HZ1  LYS  15           HZ1      LYS  15  -3.749   9.840   6.776
  123    HZ2  LYS  15           HZ2      LYS  15  -2.915   9.528   8.208
  124    HZ3  LYS  15           HZ3      LYS  15  -4.585   9.761   8.244
  125    H    TYR  16           HN       TYR  16  -6.752   2.739   6.153
  126    HA   TYR  16           HA       TYR  16  -8.202   3.574   3.760
  127    HB2  TYR  16           HB2      TYR  16  -7.239   1.238   3.566
  128    HB3  TYR  16           HB1      TYR  16  -8.295   0.780   4.893
  129    HD1  TYR  16           HD1      TYR  16  -8.194   1.943   1.402
  130    HD2  TYR  16           HD2      TYR  16 -10.619   0.333   4.502
  131    HE1  TYR  16           HE1      TYR  16  -9.947   1.440  -0.253
  132    HE2  TYR  16           HE2      TYR  16 -12.377  -0.173   2.863
  133    HH   TYR  16           HH       TYR  16 -11.836  -0.219  -0.428
  134    H    GLY  17           HN       GLY  17  -9.915   4.726   4.477
  135    HA2  GLY  17           HA2      GLY  17 -11.787   3.577   6.200
  136    HA3  GLY  17           HA1      GLY  17 -10.754   4.701   7.072
  137    H    ARG  18           HN       ARG  18 -13.310   5.124   7.007
  138    HA   ARG  18           HA       ARG  18 -13.492   7.625   5.567
  139    HB2  ARG  18           HB2      ARG  18 -15.897   7.137   5.029
  140    HB3  ARG  18           HB1      ARG  18 -14.765   6.130   4.153
  141    HG2  ARG  18           HG2      ARG  18 -15.238   4.244   5.612
  142    HG3  ARG  18           HG1      ARG  18 -16.271   5.245   6.621
  143    HD2  ARG  18           HD2      ARG  18 -16.743   4.628   3.711
  144    HD3  ARG  18           HD1      ARG  18 -17.571   3.857   5.065
  145    HE   ARG  18           HE       ARG  18 -17.893   6.594   5.335
  146   HH11  ARG  18          HH11      ARG  18 -18.903   4.087   3.054
  147   HH12  ARG  18          HH12      ARG  18 -20.325   4.891   2.597
  148   HH21  ARG  18          HH21      ARG  18 -19.858   7.694   4.707
  149   HH22  ARG  18          HH22      ARG  18 -20.882   6.970   3.554
  150    H    GLY  19           HN       GLY  19 -13.663   9.080   7.154
  151    HA2  GLY  19           HA2      GLY  19 -14.374  10.110   9.092
  152    HA3  GLY  19           HA1      GLY  19 -15.624   8.871   9.217
  153    H    LYS  20           HN       LYS  20 -15.435   8.169  11.257
  154    HA   LYS  20           HA       LYS  20 -12.865   7.719  12.455
  155    HB2  LYS  20           HB2      LYS  20 -14.856   8.467  13.764
  156    HB3  LYS  20           HB1      LYS  20 -15.613   6.913  13.449
  157    HG2  LYS  20           HG2      LYS  20 -13.828   5.783  14.664
  158    HG3  LYS  20           HG1      LYS  20 -13.042   7.336  14.939
  159    HD2  LYS  20           HD2      LYS  20 -15.022   8.083  16.192
  160    HD3  LYS  20           HD1      LYS  20 -15.744   6.488  15.962
  161    HE2  LYS  20           HE2      LYS  20 -14.679   6.699  18.157
  162    HE3  LYS  20           HE1      LYS  20 -13.908   5.462  17.169
  163    HZ1  LYS  20           HZ1      LYS  20 -12.299   6.844  18.321
  164    HZ2  LYS  20           HZ2      LYS  20 -12.878   8.225  17.566
  165    HZ3  LYS  20           HZ3      LYS  20 -12.119   7.018  16.657
  166    H    THR  21           HN       THR  21 -15.096   5.975  10.589
  167    HA   THR  21           HA       THR  21 -14.250   3.336  11.300
  168    HB   THR  21           HB       THR  21 -15.813   4.343   8.894
  169    HG1  THR  21           HG1      THR  21 -16.506   3.501  11.484
  170   HG21  THR  21          HG21      THR  21 -16.705   2.051   8.769
  171   HG22  THR  21          HG22      THR  21 -15.668   1.562  10.114
  172   HG23  THR  21          HG23      THR  21 -14.957   2.055   8.568
  173    H    GLN  22           HN       GLN  22 -12.016   3.811  11.133
  174    HA   GLN  22           HA       GLN  22 -10.844   3.456   8.490
  175    HB2  GLN  22           HB2      GLN  22 -10.884   5.872   8.832
  176    HB3  GLN  22           HB1      GLN  22 -10.206   5.677  10.433
  177    HG2  GLN  22           HG2      GLN  22  -8.161   4.704   9.346
  178    HG3  GLN  22           HG1      GLN  22  -8.833   5.214   7.799
  179   HE21  GLN  22          HE21      GLN  22  -8.870   7.407   7.292
  180   HE22  GLN  22          HE22      GLN  22  -8.036   8.563   8.258
  181    H    LYS  23           HN       LYS  23  -8.977   2.305   8.570
  182    HA   LYS  23           HA       LYS  23  -7.655   1.938  11.103
  183    HB2  LYS  23           HB2      LYS  23  -7.389  -0.479  10.743
  184    HB3  LYS  23           HB1      LYS  23  -9.087  -0.069  10.901
  185    HG2  LYS  23           HG2      LYS  23  -7.801  -0.324   8.211
  186    HG3  LYS  23           HG1      LYS  23  -8.322  -1.750   9.094
  187    HD2  LYS  23           HD2      LYS  23 -10.170   0.563   8.536
  188    HD3  LYS  23           HD1      LYS  23  -9.956  -0.773   7.397
  189    HE2  LYS  23           HE2      LYS  23 -10.624  -2.345   9.040
  190    HE3  LYS  23           HE1      LYS  23 -10.759  -1.098  10.277
  191    HZ1  LYS  23           HZ1      LYS  23 -12.525  -0.073   8.961
  192    HZ2  LYS  23           HZ2      LYS  23 -12.947  -1.642   9.377
  193    HZ3  LYS  23           HZ3      LYS  23 -12.453  -1.299   7.824
  194    H    ILE  24           HN       ILE  24  -5.458   1.055  10.711
  195    HA   ILE  24           HA       ILE  24  -4.574   1.823   8.046
  196    HB   ILE  24           HB       ILE  24  -2.958   2.097  10.627
  197   HG12  ILE  24          HG12      ILE  24  -3.001   4.609   9.967
  198   HG13  ILE  24          HG11      ILE  24  -4.346   4.179   8.925
  199   HG21  ILE  24          HG21      ILE  24  -1.602   1.559   8.695
  200   HG22  ILE  24          HG22      ILE  24  -1.286   3.199   9.252
  201   HG23  ILE  24          HG23      ILE  24  -2.276   2.928   7.815
  202   HD11  ILE  24          HD11      ILE  24  -5.116   5.142  11.035
  203   HD12  ILE  24          HD12      ILE  24  -4.277   3.876  11.927
  204   HD13  ILE  24          HD13      ILE  24  -5.631   3.463  10.883
  205    H    TYR  25           HN       TYR  25  -3.708   0.306   6.903
  206    HA   TYR  25           HA       TYR  25  -3.067  -2.322   8.092
  207    HB2  TYR  25           HB2      TYR  25  -3.871  -1.574   5.288
  208    HB3  TYR  25           HB1      TYR  25  -3.446  -3.178   5.819
  209    HD1  TYR  25           HD1      TYR  25  -5.039  -4.281   7.547
  210    HD2  TYR  25           HD2      TYR  25  -6.080  -0.842   5.273
  211    HE1  TYR  25           HE1      TYR  25  -7.399  -4.832   7.795
  212    HE2  TYR  25           HE2      TYR  25  -8.441  -1.385   5.534
  213    HH   TYR  25           HH       TYR  25  -9.533  -3.780   7.703
  214    H    GLU  26           HN       GLU  26  -1.333  -3.494   6.866
  215    HA   GLU  26           HA       GLU  26   0.565  -1.685   5.553
  216    HB2  GLU  26           HB2      GLU  26   1.183  -4.376   6.826
  217    HB3  GLU  26           HB1      GLU  26   2.332  -3.187   6.228
  218    HG2  GLU  26           HG2      GLU  26   1.462  -1.599   7.928
  219    HG3  GLU  26           HG1      GLU  26   0.546  -2.928   8.620
  220    H    ALA  27           HN       ALA  27   1.227  -2.385   3.439
  221    HA   ALA  27           HA       ALA  27  -0.015  -4.820   2.384
  222    HB1  ALA  27           HB1      ALA  27  -1.745  -3.096   2.246
  223    HB2  ALA  27           HB2      ALA  27  -1.210  -3.641   0.656
  224    HB3  ALA  27           HB3      ALA  27  -0.651  -2.093   1.295
  225    H    SER  28           HN       SER  28   0.716  -5.315   0.196
  226    HA   SER  28           HA       SER  28   3.220  -3.992  -0.466
  227    HB2  SER  28           HB2      SER  28   3.589  -6.079  -1.850
  228    HB3  SER  28           HB1      SER  28   3.501  -6.352  -0.112
  229    HG   SER  28           HG       SER  28   2.090  -7.485  -1.977
  230    H    ILE  29           HN       ILE  29   3.529  -3.114  -2.459
  231    HA   ILE  29           HA       ILE  29   1.175  -2.337  -3.927
  232    HB   ILE  29           HB       ILE  29   4.072  -1.910  -4.694
  233   HG12  ILE  29          HG12      ILE  29   3.740  -0.976  -2.468
  234   HG13  ILE  29          HG11      ILE  29   3.892   0.324  -3.638
  235   HG21  ILE  29          HG21      ILE  29   3.214  -0.002  -5.988
  236   HG22  ILE  29          HG22      ILE  29   1.576  -0.414  -5.502
  237   HG23  ILE  29          HG23      ILE  29   2.501  -1.527  -6.514
  238   HD11  ILE  29          HD11      ILE  29   1.369  -0.675  -2.343
  239   HD12  ILE  29          HD12      ILE  29   1.418   0.523  -3.635
  240   HD13  ILE  29          HD13      ILE  29   2.172   0.877  -2.080
  241    H    LYS  30           HN       LYS  30   0.326  -3.447  -5.587
  242    HA   LYS  30           HA       LYS  30   2.027  -5.483  -6.860
  243    HB2  LYS  30           HB2      LYS  30  -0.293  -5.915  -5.577
  244    HB3  LYS  30           HB1      LYS  30  -0.937  -5.507  -7.154
  245    HG2  LYS  30           HG2      LYS  30   1.062  -7.717  -6.650
  246    HG3  LYS  30           HG1      LYS  30  -0.674  -7.955  -6.729
  247    HD2  LYS  30           HD2      LYS  30   1.012  -6.858  -8.981
  248    HD3  LYS  30           HD1      LYS  30   0.562  -8.553  -8.809
  249    HE2  LYS  30           HE2      LYS  30  -1.827  -7.869  -8.900
  250    HE3  LYS  30           HE1      LYS  30  -1.306  -6.210  -9.208
  251    HZ1  LYS  30           HZ1      LYS  30  -0.644  -8.553 -10.873
  252    HZ2  LYS  30           HZ2      LYS  30  -0.244  -6.961 -11.244
  253    HZ3  LYS  30           HZ3      LYS  30  -1.855  -7.458 -11.258
  254    H    SER  31           HN       SER  31  -0.161  -2.751  -7.469
  255    HA   SER  31           HA       SER  31   1.028  -2.312 -10.067
  256    HB2  SER  31           HB2      SER  31  -1.968  -2.849  -9.882
  257    HB3  SER  31           HB1      SER  31  -1.089  -2.351 -11.324
  258    HG   SER  31           HG       SER  31   0.168  -4.436 -10.521
  259    H    THR  32           HN       THR  32   0.069  -0.203 -11.041
  260    HA   THR  32           HA       THR  32  -1.404   1.455  -9.140
  261    HB   THR  32           HB       THR  32   0.815   2.710 -10.680
  262    HG1  THR  32           HG1      THR  32   1.014   1.044  -8.396
  263   HG21  THR  32          HG21      THR  32  -0.803   4.054  -9.564
  264   HG22  THR  32          HG22      THR  32   0.787   4.245  -8.810
  265   HG23  THR  32          HG23      THR  32  -0.446   3.265  -8.026
  266    H    GLU  33           HN       GLU  33  -2.726   2.859 -10.209
  267    HA   GLU  33           HA       GLU  33  -2.470   3.183 -13.079
  268    HB2  GLU  33           HB2      GLU  33  -4.936   1.978 -11.838
  269    HB3  GLU  33           HB1      GLU  33  -4.940   2.823 -13.378
  270    HG2  GLU  33           HG2      GLU  33  -3.307   1.245 -14.254
  271    HG3  GLU  33           HG1      GLU  33  -3.357   0.348 -12.738
  272    H    ILE  34           HN       ILE  34  -3.665   4.865 -13.914
  273    HA   ILE  34           HA       ILE  34  -4.362   6.830 -11.870
  274    HB   ILE  34           HB       ILE  34  -3.430   7.257 -14.714
  275   HG12  ILE  34          HG12      ILE  34  -1.514   8.544 -13.647
  276   HG13  ILE  34          HG11      ILE  34  -2.122   7.984 -12.095
  277   HG21  ILE  34          HG21      ILE  34  -4.230   9.327 -12.672
  278   HG22  ILE  34          HG22      ILE  34  -5.109   8.904 -14.141
  279   HG23  ILE  34          HG23      ILE  34  -3.525   9.680 -14.253
  280   HD11  ILE  34          HD11      ILE  34  -1.049   6.208 -14.272
  281   HD12  ILE  34          HD12      ILE  34  -1.645   5.733 -12.674
  282   HD13  ILE  34          HD13      ILE  34  -0.185   6.715 -12.805
  283    H    ASP  35           HN       ASP  35  -6.391   7.335 -11.793
  284    HA   ASP  35           HA       ASP  35  -8.051   6.837 -14.162
  285    HB2  ASP  35           HB2      ASP  35  -8.452   5.102 -12.388
  286    HB3  ASP  35           HB1      ASP  35  -8.965   6.394 -11.309
  287    H    ASP  36           HN       ASP  36  -8.334   8.768 -14.838
  288    HA   ASP  36           HA       ASP  36  -8.811  10.922 -15.029
  289    HB2  ASP  36           HB2      ASP  36 -11.068  10.016 -14.734
  290    HB3  ASP  36           HB1      ASP  36 -10.960  10.307 -13.000
  291    H    GLY  37           HN       GLY  37  -6.711  11.187 -13.968
  292    HA2  GLY  37           HA2      GLY  37  -5.581  13.006 -13.022
  293    HA3  GLY  37           HA1      GLY  37  -7.055  13.456 -12.183
  294    H    GLU  38           HN       GLU  38  -7.193  10.581 -11.094
  295    HA   GLU  38           HA       GLU  38  -5.185  11.107  -9.064
  296    HB2  GLU  38           HB2      GLU  38  -6.638   9.852  -7.459
  297    HB3  GLU  38           HB1      GLU  38  -7.295  11.367  -8.043
  298    HG2  GLU  38           HG2      GLU  38  -8.642   9.989  -9.688
  299    HG3  GLU  38           HG1      GLU  38  -8.129   8.576  -8.760
  300    H    VAL  39           HN       VAL  39  -3.906   9.579  -8.216
  301    HA   VAL  39           HA       VAL  39  -3.583   7.230  -9.935
  302    HB   VAL  39           HB       VAL  39  -1.613   8.120  -7.854
  303   HG11  VAL  39          HG11      VAL  39   0.043   7.011  -9.356
  304   HG12  VAL  39          HG12      VAL  39  -1.281   6.499 -10.389
  305   HG13  VAL  39          HG13      VAL  39  -1.188   5.927  -8.750
  306   HG21  VAL  39          HG21      VAL  39  -0.375   9.389  -9.603
  307   HG22  VAL  39          HG22      VAL  39  -1.916  10.111  -9.155
  308   HG23  VAL  39          HG23      VAL  39  -1.774   9.241 -10.666
  309    H    LEU  40           HN       LEU  40  -4.332   5.465  -9.225
  310    HA   LEU  40           HA       LEU  40  -4.647   5.066  -6.355
  311    HB2  LEU  40           HB2      LEU  40  -6.066   3.791  -8.693
  312    HB3  LEU  40           HB1      LEU  40  -6.333   3.413  -7.002
  313    HG   LEU  40           HG       LEU  40  -6.894   6.101  -8.253
  314   HD11  LEU  40          HD11      LEU  40  -8.351   4.387  -9.152
  315   HD12  LEU  40          HD12      LEU  40  -9.239   5.472  -8.081
  316   HD13  LEU  40          HD13      LEU  40  -8.765   3.862  -7.519
  317   HD21  LEU  40          HD21      LEU  40  -7.592   4.966  -5.532
  318   HD22  LEU  40          HD22      LEU  40  -8.085   6.542  -6.150
  319   HD23  LEU  40          HD23      LEU  40  -6.393   6.213  -5.850
  320    H    TYR  41           HN       TYR  41  -3.741   3.324  -5.514
  321    HA   TYR  41           HA       TYR  41  -1.952   1.776  -7.223
  322    HB2  TYR  41           HB2      TYR  41  -1.891   2.371  -4.254
  323    HB3  TYR  41           HB1      TYR  41  -0.779   1.278  -5.066
  324    HD1  TYR  41           HD1      TYR  41  -1.881   4.911  -5.055
  325    HD2  TYR  41           HD2      TYR  41   1.213   2.099  -5.932
  326    HE1  TYR  41           HE1      TYR  41  -0.395   6.710  -5.452
  327    HE2  TYR  41           HE2      TYR  41   2.758   3.982  -6.345
  328    HH   TYR  41           HH       TYR  41   2.099   7.147  -5.422
  329    H    LEU  42           HN       LEU  42  -1.962  -0.440  -6.951
  330    HA   LEU  42           HA       LEU  42  -4.395  -1.486  -5.695
  331    HB2  LEU  42           HB2      LEU  42  -4.146  -1.757  -8.198
  332    HB3  LEU  42           HB1      LEU  42  -2.690  -2.673  -7.911
  333    HG   LEU  42           HG       LEU  42  -4.793  -3.981  -8.534
  334   HD11  LEU  42          HD11      LEU  42  -4.357  -5.817  -6.964
  335   HD12  LEU  42          HD12      LEU  42  -3.315  -4.738  -6.025
  336   HD13  LEU  42          HD13      LEU  42  -2.913  -5.140  -7.699
  337   HD21  LEU  42          HD21      LEU  42  -6.384  -4.480  -6.789
  338   HD22  LEU  42          HD22      LEU  42  -6.334  -2.743  -7.080
  339   HD23  LEU  42          HD23      LEU  42  -5.526  -3.426  -5.667
  340    H    VAL  43           HN       VAL  43  -3.913  -2.118  -3.808
  341    HA   VAL  43           HA       VAL  43  -1.319  -3.410  -3.237
  342    HB   VAL  43           HB       VAL  43  -1.208  -2.223  -1.155
  343   HG11  VAL  43          HG11      VAL  43  -1.074   0.091  -1.815
  344   HG12  VAL  43          HG12      VAL  43  -2.071  -0.247  -3.224
  345   HG13  VAL  43          HG13      VAL  43  -0.470  -0.958  -3.105
  346   HG21  VAL  43          HG21      VAL  43  -3.964  -1.118  -1.767
  347   HG22  VAL  43          HG22      VAL  43  -2.965  -0.622  -0.413
  348   HG23  VAL  43          HG23      VAL  43  -3.576  -2.276  -0.493
  349    H    HIS  44           HN       HIS  44  -1.436  -5.009  -1.622
  350    HA   HIS  44           HA       HIS  44  -4.100  -5.600  -0.645
  351    HB2  HIS  44           HB2      HIS  44  -3.625  -8.112  -0.712
  352    HB3  HIS  44           HB1      HIS  44  -3.979  -7.341  -2.242
  353    HD1  HIS  44           HD1      HIS  44  -2.466  -7.816  -4.037
  354    HD2  HIS  44           HD2      HIS  44  -0.758  -8.724  -0.373
  355    HE1  HIS  44           HE1      HIS  44  -0.259  -8.950  -4.576
  356    HE2  HIS  44           HE2      HIS  44   0.562  -9.755  -2.359
  357    H    TYR  45           HN       TYR  45  -4.359  -5.917   1.344
  358    HA   TYR  45           HA       TYR  45  -2.274  -5.090   3.092
  359    HB2  TYR  45           HB2      TYR  45  -4.896  -6.347   3.919
  360    HB3  TYR  45           HB1      TYR  45  -3.934  -5.173   4.808
  361    HD1  TYR  45           HD1      TYR  45  -3.491  -2.963   3.075
  362    HD2  TYR  45           HD2      TYR  45  -6.933  -5.459   3.265
  363    HE1  TYR  45           HE1      TYR  45  -4.856  -1.161   2.114
  364    HE2  TYR  45           HE2      TYR  45  -8.290  -3.668   2.307
  365    HH   TYR  45           HH       TYR  45  -8.248  -1.269   2.118
  366    H    TYR  46           HN       TYR  46  -0.747  -6.257   3.720
  367    HA   TYR  46           HA       TYR  46  -0.221  -8.802   2.906
  368    HB2  TYR  46           HB2      TYR  46   1.324  -6.945   3.748
  369    HB3  TYR  46           HB1      TYR  46   1.050  -7.614   5.347
  370    HD1  TYR  46           HD1      TYR  46   2.529  -8.183   2.062
  371    HD2  TYR  46           HD2      TYR  46   2.067  -9.725   5.991
  372    HE1  TYR  46           HE1      TYR  46   4.350  -9.771   1.637
  373    HE2  TYR  46           HE2      TYR  46   3.892 -11.328   5.579
  374    HH   TYR  46           HH       TYR  46   4.921 -12.402   3.589
  375    H    GLY  47           HN       GLY  47  -0.678  -8.050   6.381
  376    HA2  GLY  47           HA2      GLY  47  -1.341 -10.871   6.755
  377    HA3  GLY  47           HA1      GLY  47  -0.900  -9.738   8.018
  378    H    TRP  48           HN       TRP  48  -3.319  -8.984   5.632
  379    HA   TRP  48           HA       TRP  48  -5.421  -9.457   7.643
  380    HB2  TRP  48           HB2      TRP  48  -5.024  -6.870   6.131
  381    HB3  TRP  48           HB1      TRP  48  -6.519  -7.293   6.947
  382    HD1  TRP  48           HD1      TRP  48  -6.565  -7.081   9.591
  383    HE1  TRP  48           HE1      TRP  48  -4.980  -5.927  11.278
  384    HE3  TRP  48           HE3      TRP  48  -2.518  -6.345   6.565
  385    HZ2  TRP  48           HZ2      TRP  48  -2.398  -4.859  11.318
  386    HZ3  TRP  48           HZ3      TRP  48  -0.539  -5.252   7.505
  387    HH2  TRP  48           HH2      TRP  48  -0.477  -4.518   9.833
  388    H    ASN  49           HN       ASN  49  -4.868  -8.436   4.284
  389    HA   ASN  49           HA       ASN  49  -7.069 -10.147   3.471
  390    HB2  ASN  49           HB2      ASN  49  -6.743  -7.259   2.720
  391    HB3  ASN  49           HB1      ASN  49  -7.787  -8.373   1.879
  392   HD21  ASN  49          HD21      ASN  49  -9.651  -9.118   2.909
  393   HD22  ASN  49          HD22      ASN  49 -10.347  -8.273   4.246
  394    H    VAL  50           HN       VAL  50  -5.712 -11.528   2.465
  395    HA   VAL  50           HA       VAL  50  -3.637 -10.486   0.800
  396    HB   VAL  50           HB       VAL  50  -3.087 -12.854   0.240
  397   HG11  VAL  50          HG11      VAL  50  -3.379 -12.262   3.176
  398   HG12  VAL  50          HG12      VAL  50  -2.038 -11.778   2.138
  399   HG13  VAL  50          HG13      VAL  50  -2.321 -13.486   2.476
  400   HG21  VAL  50          HG21      VAL  50  -5.296 -13.552   2.180
  401   HG22  VAL  50          HG22      VAL  50  -4.208 -14.688   1.370
  402   HG23  VAL  50          HG23      VAL  50  -5.380 -13.767   0.437
  403    H    ARG  51           HN       ARG  51  -6.797 -11.939   0.222
  404    HA   ARG  51           HA       ARG  51  -6.237 -11.812  -2.664
  405    HB2  ARG  51           HB2      ARG  51  -8.224 -13.197  -2.996
  406    HB3  ARG  51           HB1      ARG  51  -7.070 -13.956  -1.916
  407    HG2  ARG  51           HG2      ARG  51  -8.423 -13.532  -0.016
  408    HG3  ARG  51           HG1      ARG  51  -9.446 -12.414  -0.921
  409    HD2  ARG  51           HD2      ARG  51  -9.212 -15.373  -1.452
  410    HD3  ARG  51           HD1      ARG  51 -10.528 -14.603  -0.562
  411    HE   ARG  51           HE       ARG  51 -10.350 -13.313  -3.011
  412   HH11  ARG  51          HH11      ARG  51 -11.078 -16.571  -1.917
  413   HH12  ARG  51          HH12      ARG  51 -12.141 -16.921  -3.198
  414   HH21  ARG  51          HH21      ARG  51 -11.764 -13.774  -4.763
  415   HH22  ARG  51          HH22      ARG  51 -12.523 -15.299  -4.879
  416    H    TYR  52           HN       TYR  52  -7.315  -9.719  -0.578
  417    HA   TYR  52           HA       TYR  52  -9.818  -8.966  -1.736
  418    HB2  TYR  52           HB2      TYR  52  -9.194  -8.528   0.614
  419    HB3  TYR  52           HB1      TYR  52  -8.013  -7.332   0.061
  420    HD1  TYR  52           HD2      TYR  52 -11.516  -8.141   0.642
  421    HD2  TYR  52           HD1      TYR  52  -8.828  -5.165  -0.743
  422    HE1  TYR  52           HE2      TYR  52 -13.297  -6.462   0.843
  423    HE2  TYR  52           HE1      TYR  52 -10.616  -3.465  -0.538
  424    HH   TYR  52           HH       TYR  52 -13.068  -3.483  -0.588
  425    H    ASP  53           HN       ASP  53  -6.700  -7.323  -1.625
  426    HA   ASP  53           HA       ASP  53  -5.656  -5.807  -2.922
  427    HB2  ASP  53           HB2      ASP  53  -7.145  -7.155  -5.204
  428    HB3  ASP  53           HB1      ASP  53  -5.894  -5.948  -5.414
  429    H    GLU  54           HN       GLU  54  -6.052  -3.791  -2.649
  430    HA   GLU  54           HA       GLU  54  -8.609  -2.722  -3.622
  431    HB2  GLU  54           HB2      GLU  54  -8.731  -3.175  -1.184
  432    HB3  GLU  54           HB1      GLU  54  -7.337  -2.141  -0.947
  433    HG2  GLU  54           HG2      GLU  54  -9.386  -0.982  -0.376
  434    HG3  GLU  54           HG1      GLU  54  -8.598  -0.228  -1.758
  435    H    TRP  55           HN       TRP  55  -8.653  -0.596  -3.978
  436    HA   TRP  55           HA       TRP  55  -6.143   0.486  -4.976
  437    HB2  TRP  55           HB2      TRP  55  -9.005   1.164  -5.508
  438    HB3  TRP  55           HB1      TRP  55  -7.633   1.956  -6.280
  439    HD1  TRP  55           HD1      TRP  55  -9.525  -1.369  -6.226
  440    HE1  TRP  55           HE1      TRP  55  -8.896  -2.703  -8.335
  441    HE3  TRP  55           HE3      TRP  55  -5.757   1.600  -7.972
  442    HZ2  TRP  55           HZ2      TRP  55  -7.019  -2.537 -10.435
  443    HZ3  TRP  55           HZ3      TRP  55  -4.582   0.935 -10.014
  444    HH2  TRP  55           HH2      TRP  55  -5.200  -1.090 -11.224
  445    H    VAL  56           HN       VAL  56  -5.224   2.027  -3.904
  446    HA   VAL  56           HA       VAL  56  -6.815   3.994  -2.441
  447    HB   VAL  56           HB       VAL  56  -5.065   4.054  -0.630
  448   HG11  VAL  56          HG11      VAL  56  -7.160   2.886  -0.245
  449   HG12  VAL  56          HG12      VAL  56  -5.829   2.071   0.576
  450   HG13  VAL  56          HG13      VAL  56  -6.481   1.411  -0.927
  451   HG21  VAL  56          HG21      VAL  56  -3.228   3.009  -1.848
  452   HG22  VAL  56          HG22      VAL  56  -4.109   1.484  -1.907
  453   HG23  VAL  56          HG23      VAL  56  -3.554   2.125  -0.363
  454    H    LYS  57           HN       LYS  57  -5.896   6.056  -2.422
  455    HA   LYS  57           HA       LYS  57  -4.074   6.632  -4.599
  456    HB2  LYS  57           HB2      LYS  57  -5.201   8.412  -2.443
  457    HB3  LYS  57           HB1      LYS  57  -4.246   8.972  -3.801
  458    HG2  LYS  57           HG2      LYS  57  -5.941   8.385  -5.332
  459    HG3  LYS  57           HG1      LYS  57  -6.878   7.556  -4.081
  460    HD2  LYS  57           HD2      LYS  57  -6.973   9.726  -2.837
  461    HD3  LYS  57           HD1      LYS  57  -6.263  10.493  -4.266
  462    HE2  LYS  57           HE2      LYS  57  -8.162   9.840  -5.590
  463    HE3  LYS  57           HE1      LYS  57  -8.843   8.943  -4.236
  464    HZ1  LYS  57           HZ1      LYS  57  -9.910  11.091  -4.464
  465    HZ2  LYS  57           HZ2      LYS  57  -8.444  11.884  -4.359
  466    HZ3  LYS  57           HZ3      LYS  57  -9.042  11.051  -3.021
  467    H    ALA  58           HN       ALA  58  -2.190   8.128  -4.140
  468    HA   ALA  58           HA       ALA  58  -0.392   6.870  -2.397
  469    HB1  ALA  58           HB1      ALA  58   0.299   8.022  -4.383
  470    HB2  ALA  58           HB2      ALA  58   1.160   8.666  -2.979
  471    HB3  ALA  58           HB3      ALA  58  -0.181   9.576  -3.703
  472    H    ASP  59           HN       ASP  59  -2.572   9.518  -2.055
  473    HA   ASP  59           HA       ASP  59  -1.752  10.898   0.251
  474    HB2  ASP  59           HB2      ASP  59  -4.583  10.176  -0.563
  475    HB3  ASP  59           HB1      ASP  59  -4.099  11.507   0.475
  476    H    ARG  60           HN       ARG  60  -3.243   7.870  -0.284
  477    HA   ARG  60           HA       ARG  60  -4.144   7.503   2.457
  478    HB2  ARG  60           HB2      ARG  60  -4.686   6.091  -0.142
  479    HB3  ARG  60           HB1      ARG  60  -5.326   5.547   1.408
  480    HG2  ARG  60           HG2      ARG  60  -5.777   8.331   0.399
  481    HG3  ARG  60           HG1      ARG  60  -6.797   6.985  -0.102
  482    HD2  ARG  60           HD2      ARG  60  -6.297   7.756   2.770
  483    HD3  ARG  60           HD1      ARG  60  -7.694   8.269   1.811
  484    HE   ARG  60           HE       ARG  60  -7.021   5.495   2.471
  485   HH11  ARG  60          HH11      ARG  60  -9.466   8.031   2.163
  486   HH12  ARG  60          HH12      ARG  60 -10.783   6.983   1.957
  487   HH21  ARG  60          HH21      ARG  60  -8.850   4.011   2.171
  488   HH22  ARG  60          HH22      ARG  60 -10.418   4.637   1.903
  489    H    ILE  61           HN       ILE  61  -1.318   7.103   0.972
  490    HA   ILE  61           HA       ILE  61  -0.839   4.525   2.233
  491    HB   ILE  61           HB       ILE  61   0.556   5.718  -0.197
  492   HG12  ILE  61          HG12      ILE  61  -1.340   3.380   0.004
  493   HG13  ILE  61          HG11      ILE  61  -1.706   4.940  -0.716
  494   HG21  ILE  61          HG21      ILE  61   2.049   4.343   1.166
  495   HG22  ILE  61          HG22      ILE  61   1.692   3.576  -0.384
  496   HG23  ILE  61          HG23      ILE  61   0.878   3.020   1.086
  497   HD11  ILE  61          HD11      ILE  61   0.324   2.958  -1.686
  498   HD12  ILE  61          HD12      ILE  61   0.018   4.541  -2.407
  499   HD13  ILE  61          HD13      ILE  61  -1.241   3.306  -2.425
  500    H    ILE  62           HN       ILE  62   1.161   4.431   3.382
  501    HA   ILE  62           HA       ILE  62   2.452   7.017   3.825
  502    HB   ILE  62           HB       ILE  62   2.595   4.536   5.587
  503   HG12  ILE  62          HG12      ILE  62   1.540   6.215   7.318
  504   HG13  ILE  62          HG11      ILE  62   0.958   7.044   5.878
  505   HG21  ILE  62          HG21      ILE  62   4.657   5.760   5.681
  506   HG22  ILE  62          HG22      ILE  62   3.791   5.941   7.208
  507   HG23  ILE  62          HG23      ILE  62   3.797   7.259   6.037
  508   HD11  ILE  62          HD11      ILE  62  -0.112   4.816   5.244
  509   HD12  ILE  62          HD12      ILE  62  -0.789   5.678   6.618
  510   HD13  ILE  62          HD13      ILE  62   0.267   4.304   6.904
  511    H    TRP  63           HN       TRP  63   4.002   7.140   2.419
  512    HA   TRP  63           HA       TRP  63   5.524   4.805   1.630
  513    HB2  TRP  63           HB2      TRP  63   5.595   7.674   0.682
  514    HB3  TRP  63           HB1      TRP  63   6.622   6.395   0.045
  515    HD1  TRP  63           HD1      TRP  63   3.119   7.799  -0.179
  516    HE1  TRP  63           HE1      TRP  63   1.835   6.546  -2.003
  517    HE3  TRP  63           HE3      TRP  63   6.452   4.043  -1.068
  518    HZ2  TRP  63           HZ2      TRP  63   2.188   4.259  -3.616
  519    HZ3  TRP  63           HZ3      TRP  63   5.905   2.356  -2.779
  520    HH2  TRP  63           HH2      TRP  63   3.810   2.471  -4.022
  521    HA   PRO  64           HA       PRO  64   8.582   5.980   4.675
  522    HB2  PRO  64           HB2      PRO  64  10.410   4.176   3.248
  523    HB3  PRO  64           HB1      PRO  64   9.807   4.065   4.909
  524    HG2  PRO  64           HG2      PRO  64   8.997   2.331   3.033
  525    HG3  PRO  64           HG1      PRO  64   7.913   2.939   4.304
  526    HD2  PRO  64           HD2      PRO  64   8.120   3.794   1.441
  527    HD3  PRO  64           HD1      PRO  64   6.677   3.467   2.429
  528    H    LEU  65           HN       LEU  65   9.331   7.737   4.575
  529    HA   LEU  65           HA       LEU  65  11.612   8.757   3.618
  530    HB2  LEU  65           HB2      LEU  65  10.494   8.329   1.304
  531    HB3  LEU  65           HB1      LEU  65   9.312   9.525   1.772
  532    HG   LEU  65           HG       LEU  65  12.264  10.094   1.425
  533   HD11  LEU  65          HD11      LEU  65  11.583  11.124  -0.694
  534   HD12  LEU  65          HD12      LEU  65   9.933  10.540  -0.416
  535   HD13  LEU  65          HD13      LEU  65  11.247   9.390  -0.645
  536   HD21  LEU  65          HD21      LEU  65  11.558  12.447   1.414
  537   HD22  LEU  65          HD22      LEU  65  11.059  11.631   2.914
  538   HD23  LEU  65          HD23      LEU  65   9.880  11.930   1.652
  539    H    ASP  66           HN       ASP  66  11.454   9.732   5.554
  540    HA   ASP  66           HA       ASP  66  10.811  11.126   7.216
  541    HB2  ASP  66           HB2      ASP  66  10.884  12.749   5.218
  542    HB3  ASP  66           HB1      ASP  66   9.146  12.555   5.100
  543    H    LYS  67           HN       LYS  67   8.276  12.331   7.736
  544    HA   LYS  67           HA       LYS  67   6.371  10.138   7.463
  545    HB2  LYS  67           HB2      LYS  67   7.549   9.894   9.675
  546    HB3  LYS  67           HB1      LYS  67   6.898  11.454  10.142
  547    HG2  LYS  67           HG2      LYS  67   5.553   9.678  11.130
  548    HG3  LYS  67           HG1      LYS  67   4.634  10.561   9.897
  549    HD2  LYS  67           HD2      LYS  67   4.917   8.808   8.303
  550    HD3  LYS  67           HD1      LYS  67   6.056   7.956   9.345
  551    HE2  LYS  67           HE2      LYS  67   3.854   6.886   9.361
  552    HE3  LYS  67           HE1      LYS  67   4.264   7.515  10.950
  553    HZ1  LYS  67           HZ1      LYS  67   2.800   9.388  10.562
  554    HZ2  LYS  67           HZ2      LYS  67   1.945   7.973  10.320
  555    HZ3  LYS  67           HZ3      LYS  67   2.449   8.875   9.009
  556    H    GLY  68           HN       GLY  68   7.000  13.322   6.976
  557    HA2  GLY  68           HA2      GLY  68   4.446  14.383   7.730
  558    HA3  GLY  68           HA1      GLY  68   5.699  15.186   6.781
  559    H    LEU  69           HN       LEU  69   5.719  12.608   5.187
  560    HA   LEU  69           HA       LEU  69   5.056  11.888   3.182
  561    HB2  LEU  69           HB2      LEU  69   2.443  12.582   4.387
  562    HB3  LEU  69           HB1      LEU  69   2.501  12.080   2.705
  563    HG   LEU  69           HG       LEU  69   3.515   9.921   3.461
  564   HD11  LEU  69          HD11      LEU  69   4.490  10.598   5.559
  565   HD12  LEU  69          HD12      LEU  69   3.325   9.293   5.825
  566   HD13  LEU  69          HD13      LEU  69   2.892  10.958   6.203
  567   HD21  LEU  69          HD21      LEU  69   1.449   8.997   4.370
  568   HD22  LEU  69          HD22      LEU  69   1.163  10.068   3.000
  569   HD23  LEU  69          HD23      LEU  69   0.848  10.632   4.641
  570    H    GLU  70           HN       GLU  70   5.887  12.934   1.574
  571    HA   GLU  70           HA       GLU  70   4.998  15.628   0.947
  572    HB2  GLU  70           HB2      GLU  70   7.441  14.591   0.749
  573    HB3  GLU  70           HB1      GLU  70   6.847  14.006  -0.789
  574    HG2  GLU  70           HG2      GLU  70   7.036  16.902   0.059
  575    HG3  GLU  70           HG1      GLU  70   8.119  16.075  -1.046
  576    H    HIS  71           HN       HIS  71   3.053  15.651   0.041
  577    HA   HIS  71           HA       HIS  71   2.080  13.589  -1.706
  578    HB2  HIS  71           HB2      HIS  71   0.640  15.092  -0.240
  579    HB3  HIS  71           HB1      HIS  71   1.029  16.413  -1.334
  580    HD1  HIS  71           HD1      HIS  71  -0.784  16.827  -2.972
  581    HD2  HIS  71           HD2      HIS  71  -0.580  12.849  -1.817
  582    HE1  HIS  71           HE1      HIS  71  -2.717  15.714  -4.084
  583    HE2  HIS  71           HE2      HIS  71  -2.788  13.518  -2.850
  584    H    HIS  72           HN       HIS  72   3.289  13.379  -3.512
  585    HA   HIS  72           HA       HIS  72   4.936  15.450  -4.292
  586    HB2  HIS  72           HB2      HIS  72   5.369  12.972  -4.542
  587    HB3  HIS  72           HB1      HIS  72   4.529  13.098  -6.088
  588    HD1  HIS  72           HD1      HIS  72   7.067  15.322  -4.380
  589    HD2  HIS  72           HD2      HIS  72   6.409  13.406  -8.009
  590    HE1  HIS  72           HE1      HIS  72   9.001  15.967  -5.844
  591    HE2  HIS  72           HE2      HIS  72   8.353  15.079  -8.105
  592    H    HIS  73           HN       HIS  73   2.053  14.360  -6.058
  593    HA   HIS  73           HA       HIS  73   2.422  16.761  -7.599
  594    HB2  HIS  73           HB2      HIS  73   0.157  16.299  -8.682
  595    HB3  HIS  73           HB1      HIS  73   1.360  15.058  -8.936
  596    HD1  HIS  73           HD1      HIS  73   0.687  12.714  -8.377
  597    HD2  HIS  73           HD2      HIS  73  -1.933  15.531  -6.817
  598    HE1  HIS  73           HE1      HIS  73  -1.279  11.424  -7.588
  599    HE2  HIS  73           HE2      HIS  73  -2.958  13.182  -7.050
  600    H    HIS  74           HN       HIS  74   2.603  18.238  -6.314
  601    HA   HIS  74           HA       HIS  74   0.762  18.583  -4.095
  602    HB2  HIS  74           HB2      HIS  74   3.371  18.560  -4.116
  603    HB3  HIS  74           HB1      HIS  74   3.201  20.223  -4.640
  604    HD1  HIS  74           HD1      HIS  74   3.856  18.417  -1.748
  605    HD2  HIS  74           HD2      HIS  74   1.292  21.575  -2.612
  606    HE1  HIS  74           HE1      HIS  74   3.393  19.530   0.437
  607    HE2  HIS  74           HE2      HIS  74   2.212  21.642  -0.222
  608    H    HIS  75           HN       HIS  75   2.301  20.511  -6.643
  609    HA   HIS  75           HA       HIS  75  -0.097  22.203  -6.801
  610    HB2  HIS  75           HB2      HIS  75   1.734  23.259  -5.382
  611    HB3  HIS  75           HB1      HIS  75   2.744  23.277  -6.820
  612    HD1  HIS  75           HD1      HIS  75   2.589  25.372  -8.205
  613    HD2  HIS  75           HD2      HIS  75  -0.687  24.893  -5.703
  614    HE1  HIS  75           HE1      HIS  75   1.258  27.488  -8.405
  615    HE2  HIS  75           HE2      HIS  75  -0.861  26.974  -7.185
  616    H    HIS  76           HN       HIS  76   1.659  20.028  -8.259
  617    HA   HIS  76           HA       HIS  76   1.255  21.040 -10.910
  618    HB2  HIS  76           HB2      HIS  76   3.552  21.803 -10.367
  619    HB3  HIS  76           HB1      HIS  76   3.963  20.163  -9.891
  620    HD1  HIS  76           HD1      HIS  76   5.194  18.900 -11.646
  621    HD2  HIS  76           HD2      HIS  76   2.749  21.829 -13.277
  622    HE1  HIS  76           HE1      HIS  76   5.662  18.879 -14.092
  623    HE2  HIS  76           HE2      HIS  76   3.951  20.372 -15.064
  Start of MODEL    5
    1    H1   GLU   1           HT1      GLU   1   1.758 -10.132 -17.434
    2    H2   GLU   1           HT2      GLU   1   2.363 -11.553 -16.727
    3    H3   GLU   1           HT3      GLU   1   3.412 -10.448 -17.453
    4    HA   GLU   1           HA       GLU   1   2.979  -8.823 -15.847
    5    HB2  GLU   1           HB2      GLU   1   1.003 -10.825 -14.708
    6    HB3  GLU   1           HB1      GLU   1   1.573  -9.438 -13.809
    7    HG2  GLU   1           HG2      GLU   1  -0.621  -8.994 -14.713
    8    HG3  GLU   1           HG1      GLU   1   0.558  -7.950 -15.497
    9    H    ASP   2           HN       ASP   2   5.138  -9.212 -15.576
   10    HA   ASP   2           HA       ASP   2   5.911 -11.436 -13.841
   11    HB2  ASP   2           HB2      ASP   2   7.274 -11.006 -15.858
   12    HB3  ASP   2           HB1      ASP   2   7.600  -9.378 -15.276
   13    H    MET   3           HN       MET   3   6.753  -8.044 -14.101
   14    HA   MET   3           HA       MET   3   5.755  -6.988 -11.814
   15    HB2  MET   3           HB2      MET   3   7.196  -8.487 -10.466
   16    HB3  MET   3           HB1      MET   3   8.611  -7.949 -11.355
   17    HG2  MET   3           HG2      MET   3   8.321  -5.684 -10.472
   18    HG3  MET   3           HG1      MET   3   6.883  -6.199  -9.604
   19    HE1  MET   3           HE1      MET   3   7.714  -9.033  -8.447
   20    HE2  MET   3           HE2      MET   3   6.916  -7.786  -7.490
   21    HE3  MET   3           HE3      MET   3   8.372  -8.570  -6.876
   22    H    GLU   4           HN       GLU   4   5.562  -5.154 -13.025
   23    HA   GLU   4           HA       GLU   4   7.878  -4.036 -14.302
   24    HB2  GLU   4           HB2      GLU   4   5.107  -2.910 -13.814
   25    HB3  GLU   4           HB1      GLU   4   6.380  -2.010 -14.623
   26    HG2  GLU   4           HG2      GLU   4   6.483  -3.763 -16.350
   27    HG3  GLU   4           HG1      GLU   4   5.142  -4.585 -15.554
   28    HA   PRO   5           HA       PRO   5   9.528  -2.670 -10.357
   29    HB2  PRO   5           HB2      PRO   5  11.176  -0.944 -12.125
   30    HB3  PRO   5           HB1      PRO   5  11.679  -2.058 -10.848
   31    HG2  PRO   5           HG2      PRO   5  11.984  -2.755 -13.368
   32    HG3  PRO   5           HG1      PRO   5  11.370  -3.935 -12.196
   33    HD2  PRO   5           HD2      PRO   5   9.864  -2.351 -14.245
   34    HD3  PRO   5           HD1      PRO   5   9.724  -4.064 -13.788
   35    H    CYS   6           HN       CYS   6   7.274  -0.972 -11.639
   36    HA   CYS   6           HA       CYS   6   8.003   1.631 -10.576
   37    HB2  CYS   6           HB2      CYS   6   5.381   0.751 -11.800
   38    HB3  CYS   6           HB1      CYS   6   5.862   2.397 -11.399
   39    HG   CYS   6           HG       CYS   6   8.016   0.911 -13.422
   40    H    LEU   7           HN       LEU   7   8.284   0.671  -8.479
   41    HA   LEU   7           HA       LEU   7   7.683   0.761  -6.288
   42    HB2  LEU   7           HB2      LEU   7   4.975   1.576  -7.314
   43    HB3  LEU   7           HB1      LEU   7   5.495   1.669  -5.643
   44    HG   LEU   7           HG       LEU   7   6.920   3.136  -7.845
   45   HD11  LEU   7          HD11      LEU   7   4.685   4.158  -6.100
   46   HD12  LEU   7          HD12      LEU   7   4.614   3.860  -7.845
   47   HD13  LEU   7          HD13      LEU   7   5.664   5.121  -7.210
   48   HD21  LEU   7          HD21      LEU   7   8.173   2.843  -5.782
   49   HD22  LEU   7          HD22      LEU   7   6.830   3.506  -4.853
   50   HD23  LEU   7          HD23      LEU   7   7.710   4.533  -5.982
   51    H    THR   8           HN       THR   8   6.417  -1.503  -8.354
   52    HA   THR   8           HA       THR   8   4.541  -2.800  -6.703
   53    HB   THR   8           HB       THR   8   4.964  -4.766  -8.242
   54    HG1  THR   8           HG1      THR   8   6.298  -3.319 -10.109
   55   HG21  THR   8          HG21      THR   8   3.203  -3.136  -8.700
   56   HG22  THR   8          HG22      THR   8   3.968  -3.637 -10.208
   57   HG23  THR   8          HG23      THR   8   4.367  -2.073  -9.491
   58    H    GLY   9           HN       GLY   9   4.728  -4.354  -5.204
   59    HA2  GLY   9           HA2      GLY   9   5.769  -6.050  -3.979
   60    HA3  GLY   9           HA1      GLY   9   7.297  -5.648  -4.747
   61    H    THR  10           HN       THR  10   6.409  -2.734  -4.005
   62    HA   THR  10           HA       THR  10   8.022  -2.540  -1.675
   63    HB   THR  10           HB       THR  10   6.089  -0.544  -2.805
   64    HG1  THR  10           HG1      THR  10   7.403  -0.690  -4.421
   65   HG21  THR  10          HG21      THR  10   8.557  -0.127  -1.094
   66   HG22  THR  10          HG22      THR  10   6.888   0.060  -0.567
   67   HG23  THR  10          HG23      THR  10   7.558   1.158  -1.770
   68    H    LYS  11           HN       LYS  11   7.424  -2.802   0.314
   69    HA   LYS  11           HA       LYS  11   4.647  -3.243   0.928
   70    HB2  LYS  11           HB2      LYS  11   7.081  -3.396   2.730
   71    HB3  LYS  11           HB1      LYS  11   5.444  -3.865   3.169
   72    HG2  LYS  11           HG2      LYS  11   5.482  -5.580   1.394
   73    HG3  LYS  11           HG1      LYS  11   7.163  -5.160   1.064
   74    HD2  LYS  11           HD2      LYS  11   7.789  -5.801   3.316
   75    HD3  LYS  11           HD1      LYS  11   6.103  -6.132   3.708
   76    HE2  LYS  11           HE2      LYS  11   7.227  -8.220   3.241
   77    HE3  LYS  11           HE1      LYS  11   6.067  -7.876   1.966
   78    HZ1  LYS  11           HZ1      LYS  11   7.944  -7.098   0.572
   79    HZ2  LYS  11           HZ2      LYS  11   8.126  -8.691   1.066
   80    HZ3  LYS  11           HZ3      LYS  11   9.006  -7.500   1.824
   81    H    VAL  12           HN       VAL  12   3.382  -1.781   1.671
   82    HA   VAL  12           HA       VAL  12   4.555   0.717   2.660
   83    HB   VAL  12           HB       VAL  12   2.703   1.934   1.561
   84   HG11  VAL  12          HG11      VAL  12   4.373   0.274  -0.316
   85   HG12  VAL  12          HG12      VAL  12   4.869   1.775   0.459
   86   HG13  VAL  12          HG13      VAL  12   3.565   1.787  -0.724
   87   HG21  VAL  12          HG21      VAL  12   2.101  -0.723   0.250
   88   HG22  VAL  12          HG22      VAL  12   1.337   0.819  -0.142
   89   HG23  VAL  12          HG23      VAL  12   1.094   0.087   1.446
   90    H    LYS  13           HN       LYS  13   2.717   2.069   3.618
   91    HA   LYS  13           HA       LYS  13   1.113   0.419   5.443
   92    HB2  LYS  13           HB2      LYS  13   3.012   2.526   5.775
   93    HB3  LYS  13           HB1      LYS  13   1.422   3.149   6.182
   94    HG2  LYS  13           HG2      LYS  13   2.567   0.666   7.399
   95    HG3  LYS  13           HG1      LYS  13   2.786   2.299   8.090
   96    HD2  LYS  13           HD2      LYS  13   0.217   2.382   7.918
   97    HD3  LYS  13           HD1      LYS  13   0.335   0.627   7.809
   98    HE2  LYS  13           HE2      LYS  13   1.513   2.310  10.006
   99    HE3  LYS  13           HE1      LYS  13  -0.031   1.489  10.113
  100    HZ1  LYS  13           HZ1      LYS  13   1.115  -0.631   9.928
  101    HZ2  LYS  13           HZ2      LYS  13   1.699   0.260  11.208
  102    HZ3  LYS  13           HZ3      LYS  13   2.620   0.150   9.808
  103    H    VAL  14           HN       VAL  14  -1.129   0.925   5.396
  104    HA   VAL  14           HA       VAL  14  -1.961   3.061   3.530
  105    HB   VAL  14           HB       VAL  14  -3.061   0.236   3.711
  106   HG11  VAL  14          HG11      VAL  14  -4.623   0.864   1.960
  107   HG12  VAL  14          HG12      VAL  14  -4.046   2.533   2.033
  108   HG13  VAL  14          HG13      VAL  14  -4.891   1.827   3.414
  109   HG21  VAL  14          HG21      VAL  14  -1.746   1.701   1.413
  110   HG22  VAL  14          HG22      VAL  14  -2.384   0.059   1.372
  111   HG23  VAL  14          HG23      VAL  14  -1.009   0.444   2.404
  112    H    LYS  15           HN       LYS  15  -3.538   4.381   4.290
  113    HA   LYS  15           HA       LYS  15  -4.865   3.676   6.863
  114    HB2  LYS  15           HB2      LYS  15  -3.126   5.553   6.797
  115    HB3  LYS  15           HB1      LYS  15  -4.286   6.355   5.714
  116    HG2  LYS  15           HG2      LYS  15  -4.916   5.635   8.600
  117    HG3  LYS  15           HG1      LYS  15  -4.229   7.174   8.124
  118    HD2  LYS  15           HD2      LYS  15  -6.241   7.592   6.743
  119    HD3  LYS  15           HD1      LYS  15  -6.904   6.047   7.288
  120    HE2  LYS  15           HE2      LYS  15  -6.796   6.861   9.616
  121    HE3  LYS  15           HE1      LYS  15  -6.187   8.405   9.023
  122    HZ1  LYS  15           HZ1      LYS  15  -8.498   8.597   9.424
  123    HZ2  LYS  15           HZ2      LYS  15  -8.892   7.244   8.571
  124    HZ3  LYS  15           HZ3      LYS  15  -8.322   8.618   7.756
  125    H    TYR  16           HN       TYR  16  -7.076   3.276   6.397
  126    HA   TYR  16           HA       TYR  16  -8.453   5.430   5.461
  127    HB2  TYR  16           HB2      TYR  16  -9.841   4.427   3.600
  128    HB3  TYR  16           HB1      TYR  16  -8.191   4.766   3.157
  129    HD1  TYR  16           HD2      TYR  16  -7.718   2.223   4.936
  130    HD2  TYR  16           HD1      TYR  16  -9.727   3.138   1.433
  131    HE1  TYR  16           HE2      TYR  16  -7.432  -0.192   4.171
  132    HE2  TYR  16           HE1      TYR  16  -9.500   0.825   0.577
  133    HH   TYR  16           HH       TYR  16  -8.005  -1.109   1.023
  134    H    GLY  17           HN       GLY  17 -10.809   5.268   5.632
  135    HA2  GLY  17           HA2      GLY  17 -11.736   2.995   7.009
  136    HA3  GLY  17           HA1      GLY  17 -11.330   4.329   8.084
  137    H    ARG  18           HN       ARG  18 -13.745   2.903   7.103
  138    HA   ARG  18           HA       ARG  18 -15.365   5.238   7.251
  139    HB2  ARG  18           HB2      ARG  18 -16.885   4.361   5.443
  140    HB3  ARG  18           HB1      ARG  18 -15.338   4.939   4.858
  141    HG2  ARG  18           HG2      ARG  18 -14.555   2.601   4.736
  142    HG3  ARG  18           HG1      ARG  18 -16.158   2.064   5.246
  143    HD2  ARG  18           HD2      ARG  18 -17.131   3.164   3.286
  144    HD3  ARG  18           HD1      ARG  18 -15.518   3.679   2.796
  145    HE   ARG  18           HE       ARG  18 -15.733   0.864   3.158
  146   HH11  ARG  18          HH11      ARG  18 -16.259   3.503   0.876
  147   HH12  ARG  18          HH12      ARG  18 -16.126   2.508  -0.504
  148   HH21  ARG  18          HH21      ARG  18 -15.524  -0.469   1.301
  149   HH22  ARG  18          HH22      ARG  18 -15.641   0.211  -0.269
  150    H    GLY  19           HN       GLY  19 -16.232   4.803   9.126
  151    HA2  GLY  19           HA2      GLY  19 -17.575   3.765  10.683
  152    HA3  GLY  19           HA1      GLY  19 -18.019   2.603   9.439
  153    H    LYS  20           HN       LYS  20 -17.373   0.605   9.737
  154    HA   LYS  20           HA       LYS  20 -15.517   0.027  11.898
  155    HB2  LYS  20           HB2      LYS  20 -17.678  -1.170  11.760
  156    HB3  LYS  20           HB1      LYS  20 -17.227  -1.809  10.196
  157    HG2  LYS  20           HG2      LYS  20 -16.960  -3.534  11.862
  158    HG3  LYS  20           HG1      LYS  20 -15.377  -3.050  11.262
  159    HD2  LYS  20           HD2      LYS  20 -15.263  -3.350  13.653
  160    HD3  LYS  20           HD1      LYS  20 -15.081  -1.640  13.284
  161    HE2  LYS  20           HE2      LYS  20 -17.422  -1.250  13.900
  162    HE3  LYS  20           HE1      LYS  20 -17.635  -2.975  14.200
  163    HZ1  LYS  20           HZ1      LYS  20 -15.979  -2.816  15.965
  164    HZ2  LYS  20           HZ2      LYS  20 -17.278  -1.809  16.264
  165    HZ3  LYS  20           HZ3      LYS  20 -15.824  -1.156  15.705
  166    H    THR  21           HN       THR  21 -15.290   0.528   8.584
  167    HA   THR  21           HA       THR  21 -13.211  -1.422   8.087
  168    HB   THR  21           HB       THR  21 -13.930   0.974   6.347
  169    HG1  THR  21           HG1      THR  21 -15.405  -1.257   6.962
  170   HG21  THR  21          HG21      THR  21 -13.162  -0.457   4.505
  171   HG22  THR  21          HG22      THR  21 -12.828  -1.760   5.643
  172   HG23  THR  21          HG23      THR  21 -11.882  -0.275   5.707
  173    H    GLN  22           HN       GLN  22 -13.214   1.330   9.903
  174    HA   GLN  22           HA       GLN  22 -10.846   2.588   8.885
  175    HB2  GLN  22           HB2      GLN  22 -12.479   3.999  10.001
  176    HB3  GLN  22           HB1      GLN  22 -12.293   3.077  11.483
  177    HG2  GLN  22           HG2      GLN  22 -11.082   5.224  11.625
  178    HG3  GLN  22           HG1      GLN  22 -10.027   3.811  11.707
  179   HE21  GLN  22          HE21      GLN  22  -8.426   3.601  10.329
  180   HE22  GLN  22          HE22      GLN  22  -8.072   4.617   8.996
  181    H    LYS  23           HN       LYS  23  -9.085   1.704   8.880
  182    HA   LYS  23           HA       LYS  23  -7.652   1.243  11.257
  183    HB2  LYS  23           HB2      LYS  23  -7.071  -1.018  10.984
  184    HB3  LYS  23           HB1      LYS  23  -8.820  -0.924  11.033
  185    HG2  LYS  23           HG2      LYS  23  -9.000  -1.341   8.736
  186    HG3  LYS  23           HG1      LYS  23  -7.268  -1.082   8.483
  187    HD2  LYS  23           HD2      LYS  23  -7.533  -3.427   8.530
  188    HD3  LYS  23           HD1      LYS  23  -6.895  -2.866  10.097
  189    HE2  LYS  23           HE2      LYS  23  -9.068  -3.025  11.113
  190    HE3  LYS  23           HE1      LYS  23  -9.786  -3.491   9.569
  191    HZ1  LYS  23           HZ1      LYS  23  -7.824  -5.069  11.144
  192    HZ2  LYS  23           HZ2      LYS  23  -8.354  -5.485   9.633
  193    HZ3  LYS  23           HZ3      LYS  23  -9.450  -5.440  10.910
  194    H    ILE  24           HN       ILE  24  -5.423   0.700  10.749
  195    HA   ILE  24           HA       ILE  24  -4.698   1.694   8.116
  196    HB   ILE  24           HB       ILE  24  -3.080   1.664  10.695
  197   HG12  ILE  24          HG12      ILE  24  -4.286   4.019   9.319
  198   HG13  ILE  24          HG11      ILE  24  -5.140   3.172  10.609
  199   HG21  ILE  24          HG21      ILE  24  -1.590   3.170   9.462
  200   HG22  ILE  24          HG22      ILE  24  -2.628   3.033   8.039
  201   HG23  ILE  24          HG23      ILE  24  -1.746   1.629   8.625
  202   HD11  ILE  24          HD11      ILE  24  -4.006   5.137  11.460
  203   HD12  ILE  24          HD12      ILE  24  -2.464   4.537  10.824
  204   HD13  ILE  24          HD13      ILE  24  -3.310   3.651  12.105
  205    H    TYR  25           HN       TYR  25  -3.719   0.279   6.862
  206    HA   TYR  25           HA       TYR  25  -3.188  -2.448   7.887
  207    HB2  TYR  25           HB2      TYR  25  -3.721  -1.475   5.090
  208    HB3  TYR  25           HB1      TYR  25  -3.361  -3.116   5.537
  209    HD1  TYR  25           HD1      TYR  25  -5.923  -0.435   5.904
  210    HD2  TYR  25           HD2      TYR  25  -5.105  -4.604   5.973
  211    HE1  TYR  25           HE1      TYR  25  -8.340  -0.920   5.794
  212    HE2  TYR  25           HE2      TYR  25  -7.509  -5.087   5.878
  213    HH   TYR  25           HH       TYR  25  -9.677  -3.950   6.376
  214    H    GLU  26           HN       GLU  26  -1.430  -3.556   6.773
  215    HA   GLU  26           HA       GLU  26   0.590  -1.790   5.627
  216    HB2  GLU  26           HB2      GLU  26   0.923  -4.357   7.195
  217    HB3  GLU  26           HB1      GLU  26   2.236  -3.521   6.371
  218    HG2  GLU  26           HG2      GLU  26   1.865  -1.553   7.757
  219    HG3  GLU  26           HG1      GLU  26   0.545  -2.372   8.577
  220    H    ALA  27           HN       ALA  27   1.061  -2.250   3.560
  221    HA   ALA  27           HA       ALA  27  -0.092  -4.694   2.379
  222    HB1  ALA  27           HB1      ALA  27  -0.946  -3.387   0.540
  223    HB2  ALA  27           HB2      ALA  27  -0.341  -1.909   1.286
  224    HB3  ALA  27           HB3      ALA  27  -1.629  -2.823   2.064
  225    H    SER  28           HN       SER  28   0.569  -4.717  -0.009
  226    HA   SER  28           HA       SER  28   3.176  -3.511  -0.467
  227    HB2  SER  28           HB2      SER  28   2.395  -6.348  -1.206
  228    HB3  SER  28           HB1      SER  28   3.947  -5.555  -1.520
  229    HG   SER  28           HG       SER  28   3.377  -5.288   1.037
  230    H    ILE  29           HN       ILE  29   3.341  -2.623  -2.435
  231    HA   ILE  29           HA       ILE  29   0.972  -2.079  -3.905
  232    HB   ILE  29           HB       ILE  29   3.835  -1.689  -4.831
  233   HG12  ILE  29          HG12      ILE  29   3.544  -0.555  -2.700
  234   HG13  ILE  29          HG11      ILE  29   3.621   0.635  -3.990
  235   HG21  ILE  29          HG21      ILE  29   2.262  -1.491  -6.662
  236   HG22  ILE  29          HG22      ILE  29   2.899   0.105  -6.262
  237   HG23  ILE  29          HG23      ILE  29   1.281  -0.358  -5.734
  238   HD11  ILE  29          HD11      ILE  29   1.156  -0.310  -2.540
  239   HD12  ILE  29          HD12      ILE  29   1.153   0.793  -3.914
  240   HD13  ILE  29          HD13      ILE  29   1.931   1.273  -2.407
  241    H    LYS  30           HN       LYS  30   0.033  -3.226  -5.455
  242    HA   LYS  30           HA       LYS  30   1.499  -5.537  -6.499
  243    HB2  LYS  30           HB2      LYS  30  -0.660  -5.765  -5.112
  244    HB3  LYS  30           HB1      LYS  30  -1.496  -5.097  -6.495
  245    HG2  LYS  30           HG2      LYS  30   0.183  -7.591  -6.663
  246    HG3  LYS  30           HG1      LYS  30  -1.511  -7.616  -6.210
  247    HD2  LYS  30           HD2      LYS  30  -0.463  -6.442  -8.755
  248    HD3  LYS  30           HD1      LYS  30  -1.024  -8.113  -8.618
  249    HE2  LYS  30           HE2      LYS  30  -2.656  -5.609  -8.151
  250    HE3  LYS  30           HE1      LYS  30  -2.791  -6.710  -9.514
  251    HZ1  LYS  30           HZ1      LYS  30  -4.522  -7.208  -7.986
  252    HZ2  LYS  30           HZ2      LYS  30  -3.529  -7.301  -6.666
  253    HZ3  LYS  30           HZ3      LYS  30  -3.429  -8.472  -7.875
  254    H    SER  31           HN       SER  31  -0.718  -2.889  -7.509
  255    HA   SER  31           HA       SER  31   0.769  -2.690  -9.953
  256    HB2  SER  31           HB2      SER  31  -0.983  -4.400 -10.473
  257    HB3  SER  31           HB1      SER  31  -2.222  -3.260  -9.953
  258    HG   SER  31           HG       SER  31  -2.204  -2.738 -11.977
  259    H    THR  32           HN       THR  32   0.088  -0.608 -11.073
  260    HA   THR  32           HA       THR  32  -1.349   1.193  -9.252
  261    HB   THR  32           HB       THR  32   0.943   2.210 -10.838
  262    HG1  THR  32           HG1      THR  32   1.319   0.296  -9.176
  263   HG21  THR  32          HG21      THR  32   1.061   3.797  -9.005
  264   HG22  THR  32          HG22      THR  32  -0.247   2.937  -8.192
  265   HG23  THR  32          HG23      THR  32  -0.542   3.738  -9.740
  266    H    GLU  33           HN       GLU  33  -2.580   2.658 -10.336
  267    HA   GLU  33           HA       GLU  33  -2.342   2.935 -13.202
  268    HB2  GLU  33           HB2      GLU  33  -4.856   1.821 -11.960
  269    HB3  GLU  33           HB1      GLU  33  -4.819   2.639 -13.516
  270    HG2  GLU  33           HG2      GLU  33  -3.236   0.982 -14.352
  271    HG3  GLU  33           HG1      GLU  33  -3.311   0.124 -12.817
  272    H    ILE  34           HN       ILE  34  -3.767   4.588 -14.035
  273    HA   ILE  34           HA       ILE  34  -4.108   6.617 -11.980
  274    HB   ILE  34           HB       ILE  34  -3.471   6.964 -14.910
  275   HG12  ILE  34          HG12      ILE  34  -1.508   8.298 -14.064
  276   HG13  ILE  34          HG11      ILE  34  -1.950   7.823 -12.432
  277   HG21  ILE  34          HG21      ILE  34  -3.528   9.410 -14.558
  278   HG22  ILE  34          HG22      ILE  34  -4.167   9.127 -12.937
  279   HG23  ILE  34          HG23      ILE  34  -5.103   8.640 -14.348
  280   HD11  ILE  34          HD11      ILE  34  -1.568   5.498 -13.039
  281   HD12  ILE  34          HD12      ILE  34  -0.117   6.487 -13.218
  282   HD13  ILE  34          HD13      ILE  34  -1.041   5.994 -14.651
  283    H    ASP  35           HN       ASP  35  -6.032   7.342 -11.661
  284    HA   ASP  35           HA       ASP  35  -8.188   6.751 -13.556
  285    HB2  ASP  35           HB2      ASP  35  -8.281   5.004 -11.884
  286    HB3  ASP  35           HB1      ASP  35  -8.133   6.179 -10.590
  287    H    ASP  36           HN       ASP  36  -8.988   8.621 -14.119
  288    HA   ASP  36           HA       ASP  36  -9.838  10.681 -14.127
  289    HB2  ASP  36           HB2      ASP  36 -10.488   9.884 -11.326
  290    HB3  ASP  36           HB1      ASP  36 -10.708  11.570 -11.775
  291    H    GLY  37           HN       GLY  37  -6.969  10.378 -13.616
  292    HA2  GLY  37           HA2      GLY  37  -5.505  12.270 -13.890
  293    HA3  GLY  37           HA1      GLY  37  -6.581  13.194 -12.854
  294    H    GLU  38           HN       GLU  38  -6.593  10.665 -11.099
  295    HA   GLU  38           HA       GLU  38  -4.089  11.301  -9.684
  296    HB2  GLU  38           HB2      GLU  38  -5.330  10.368  -7.705
  297    HB3  GLU  38           HB1      GLU  38  -5.905  11.932  -8.286
  298    HG2  GLU  38           HG2      GLU  38  -7.757  10.822  -9.404
  299    HG3  GLU  38           HG1      GLU  38  -7.150   9.258  -8.879
  300    H    VAL  39           HN       VAL  39  -3.009   9.659  -8.691
  301    HA   VAL  39           HA       VAL  39  -3.330   7.227 -10.201
  302    HB   VAL  39           HB       VAL  39  -1.161   8.327 -10.442
  303   HG11  VAL  39          HG11      VAL  39  -0.812   7.948  -7.492
  304   HG12  VAL  39          HG12      VAL  39  -1.044   9.459  -8.368
  305   HG13  VAL  39          HG13      VAL  39   0.431   8.514  -8.623
  306   HG21  VAL  39          HG21      VAL  39  -1.280   5.904 -10.651
  307   HG22  VAL  39          HG22      VAL  39  -0.957   5.707  -8.940
  308   HG23  VAL  39          HG23      VAL  39   0.282   6.370  -9.999
  309    H    LEU  40           HN       LEU  40  -3.983   5.501  -9.419
  310    HA   LEU  40           HA       LEU  40  -4.348   5.298  -6.533
  311    HB2  LEU  40           HB2      LEU  40  -5.860   3.899  -8.728
  312    HB3  LEU  40           HB1      LEU  40  -6.182   3.814  -7.008
  313    HG   LEU  40           HG       LEU  40  -6.596   6.181  -8.815
  314   HD11  LEU  40          HD11      LEU  40  -8.506   4.465  -7.254
  315   HD12  LEU  40          HD12      LEU  40  -8.258   4.435  -8.998
  316   HD13  LEU  40          HD13      LEU  40  -8.931   5.875  -8.229
  317   HD21  LEU  40          HD21      LEU  40  -7.488   7.320  -6.846
  318   HD22  LEU  40          HD22      LEU  40  -5.781   6.937  -6.659
  319   HD23  LEU  40          HD23      LEU  40  -7.000   5.961  -5.832
  320    H    TYR  41           HN       TYR  41  -3.757   3.476  -5.598
  321    HA   TYR  41           HA       TYR  41  -2.060   1.736  -7.192
  322    HB2  TYR  41           HB2      TYR  41  -1.982   2.454  -4.262
  323    HB3  TYR  41           HB1      TYR  41  -0.989   1.207  -5.001
  324    HD1  TYR  41           HD1      TYR  41  -1.760   4.834  -5.205
  325    HD2  TYR  41           HD2      TYR  41   1.054   1.762  -5.937
  326    HE1  TYR  41           HE1      TYR  41  -0.078   6.525  -5.774
  327    HE2  TYR  41           HE2      TYR  41   2.752   3.437  -6.499
  328    HH   TYR  41           HH       TYR  41   2.444   6.656  -5.749
  329    H    LEU  42           HN       LEU  42  -2.349  -0.352  -7.037
  330    HA   LEU  42           HA       LEU  42  -4.708  -1.263  -5.570
  331    HB2  LEU  42           HB2      LEU  42  -4.275  -1.566  -8.198
  332    HB3  LEU  42           HB1      LEU  42  -3.233  -2.856  -7.650
  333    HG   LEU  42           HG       LEU  42  -6.210  -2.626  -7.347
  334   HD11  LEU  42          HD11      LEU  42  -6.244  -4.728  -8.578
  335   HD12  LEU  42          HD12      LEU  42  -4.492  -4.610  -8.785
  336   HD13  LEU  42          HD13      LEU  42  -5.551  -3.386  -9.483
  337   HD21  LEU  42          HD21      LEU  42  -6.187  -4.786  -6.223
  338   HD22  LEU  42          HD22      LEU  42  -5.394  -3.530  -5.269
  339   HD23  LEU  42          HD23      LEU  42  -4.423  -4.727  -6.134
  340    H    VAL  43           HN       VAL  43  -4.035  -2.083  -3.741
  341    HA   VAL  43           HA       VAL  43  -1.268  -3.098  -3.521
  342    HB   VAL  43           HB       VAL  43  -1.156  -2.151  -1.316
  343   HG11  VAL  43          HG11      VAL  43  -0.715  -0.604  -3.114
  344   HG12  VAL  43          HG12      VAL  43  -1.360   0.203  -1.683
  345   HG13  VAL  43          HG13      VAL  43  -2.396  -0.077  -3.080
  346   HG21  VAL  43          HG21      VAL  43  -3.451  -2.608  -0.550
  347   HG22  VAL  43          HG22      VAL  43  -4.067  -1.358  -1.627
  348   HG23  VAL  43          HG23      VAL  43  -3.036  -0.915  -0.272
  349    H    HIS  44           HN       HIS  44  -1.042  -4.888  -2.202
  350    HA   HIS  44           HA       HIS  44  -3.555  -5.952  -1.256
  351    HB2  HIS  44           HB2      HIS  44  -2.993  -8.289  -1.789
  352    HB3  HIS  44           HB1      HIS  44  -3.072  -7.312  -3.235
  353    HD1  HIS  44           HD1      HIS  44  -1.693  -9.046  -4.564
  354    HD2  HIS  44           HD2      HIS  44   0.315  -7.564  -1.238
  355    HE1  HIS  44           HE1      HIS  44   0.654  -9.881  -4.762
  356    HE2  HIS  44           HE2      HIS  44   1.623  -9.341  -2.511
  357    H    TYR  45           HN       TYR  45  -3.626  -6.836   0.605
  358    HA   TYR  45           HA       TYR  45  -1.412  -6.286   2.357
  359    HB2  TYR  45           HB2      TYR  45  -4.094  -7.569   2.994
  360    HB3  TYR  45           HB1      TYR  45  -3.001  -6.781   4.140
  361    HD1  TYR  45           HD2      TYR  45  -2.344  -4.312   3.347
  362    HD2  TYR  45           HD1      TYR  45  -5.953  -6.291   2.336
  363    HE1  TYR  45           HE2      TYR  45  -3.381  -2.146   2.825
  364    HE2  TYR  45           HE1      TYR  45  -6.992  -4.118   1.798
  365    HH   TYR  45           HH       TYR  45  -6.685  -1.742   2.326
  366    H    TYR  46           HN       TYR  46   0.048  -7.761   2.917
  367    HA   TYR  46           HA       TYR  46   0.153 -10.063   1.393
  368    HB2  TYR  46           HB2      TYR  46   2.234 -10.660   2.803
  369    HB3  TYR  46           HB1      TYR  46   2.257  -9.241   1.778
  370    HD1  TYR  46           HD2      TYR  46   2.289 -10.466   5.224
  371    HD2  TYR  46           HD1      TYR  46   2.345  -7.001   2.763
  372    HE1  TYR  46           HE2      TYR  46   3.072  -9.124   7.136
  373    HE2  TYR  46           HE1      TYR  46   3.138  -5.651   4.664
  374    HH   TYR  46           HH       TYR  46   4.287  -7.113   7.508
  375    H    GLY  47           HN       GLY  47   0.718 -12.221   2.017
  376    HA2  GLY  47           HA2      GLY  47  -1.463 -13.667   2.509
  377    HA3  GLY  47           HA1      GLY  47   0.147 -14.275   2.815
  378    H    TRP  48           HN       TRP  48  -2.725 -13.001   4.096
  379    HA   TRP  48           HA       TRP  48  -2.796 -14.347   6.526
  380    HB2  TRP  48           HB2      TRP  48  -0.871 -12.956   7.203
  381    HB3  TRP  48           HB1      TRP  48  -1.738 -11.502   6.747
  382    HD1  TRP  48           HD1      TRP  48  -2.844 -10.283   8.712
  383    HE1  TRP  48           HE1      TRP  48  -3.535 -10.910  11.116
  384    HE3  TRP  48           HE3      TRP  48  -1.832 -15.285   8.564
  385    HZ2  TRP  48           HZ2      TRP  48  -3.658 -13.224  12.709
  386    HZ3  TRP  48           HZ3      TRP  48  -2.268 -16.633  10.566
  387    HH2  TRP  48           HH2      TRP  48  -3.158 -15.617  12.600
  388    H    ASN  49           HN       ASN  49  -3.291 -11.269   5.012
  389    HA   ASN  49           HA       ASN  49  -5.954 -10.997   6.122
  390    HB2  ASN  49           HB2      ASN  49  -4.423  -9.092   6.159
  391    HB3  ASN  49           HB1      ASN  49  -4.216  -9.206   4.420
  392   HD21  ASN  49          HD21      ASN  49  -6.320  -8.275   7.001
  393   HD22  ASN  49          HD22      ASN  49  -7.393  -7.327   6.049
  394    H    VAL  50           HN       VAL  50  -7.556 -12.004   5.056
  395    HA   VAL  50           HA       VAL  50  -7.248 -12.915   2.351
  396    HB   VAL  50           HB       VAL  50  -9.727 -13.004   4.118
  397   HG11  VAL  50          HG11      VAL  50  -9.039 -14.654   1.687
  398   HG12  VAL  50          HG12      VAL  50 -10.256 -13.382   1.762
  399   HG13  VAL  50          HG13      VAL  50 -10.466 -14.857   2.705
  400   HG21  VAL  50          HG21      VAL  50  -7.839 -14.117   5.189
  401   HG22  VAL  50          HG22      VAL  50  -7.573 -15.082   3.738
  402   HG23  VAL  50          HG23      VAL  50  -9.052 -15.290   4.677
  403    H    ARG  51           HN       ARG  51  -8.567 -10.216   3.884
  404    HA   ARG  51           HA       ARG  51 -10.387  -9.118   2.075
  405    HB2  ARG  51           HB2      ARG  51  -9.718  -8.449   4.457
  406    HB3  ARG  51           HB1      ARG  51  -8.309  -7.700   3.768
  407    HG2  ARG  51           HG2      ARG  51 -11.085  -6.834   3.058
  408    HG3  ARG  51           HG1      ARG  51 -10.256  -6.262   4.495
  409    HD2  ARG  51           HD2      ARG  51  -8.391  -5.562   2.917
  410    HD3  ARG  51           HD1      ARG  51  -9.567  -5.806   1.619
  411    HE   ARG  51           HE       ARG  51  -9.948  -3.971   3.894
  412   HH11  ARG  51          HH11      ARG  51 -10.540  -4.812   0.506
  413   HH12  ARG  51          HH12      ARG  51 -11.234  -3.316   0.100
  414   HH21  ARG  51          HH21      ARG  51 -10.980  -1.975   3.387
  415   HH22  ARG  51          HH22      ARG  51 -11.552  -1.657   1.814
  416    H    TYR  52           HN       TYR  52  -6.891  -8.928   2.256
  417    HA   TYR  52           HA       TYR  52  -5.213  -8.867   0.850
  418    HB2  TYR  52           HB2      TYR  52  -6.631 -10.898   0.157
  419    HB3  TYR  52           HB1      TYR  52  -6.899 -10.006  -1.327
  420    HD1  TYR  52           HD2      TYR  52  -4.114 -11.018   0.911
  421    HD2  TYR  52           HD1      TYR  52  -5.415 -10.405  -3.074
  422    HE1  TYR  52           HE2      TYR  52  -1.975 -11.891   0.098
  423    HE2  TYR  52           HE1      TYR  52  -3.279 -11.298  -3.907
  424    HH   TYR  52           HH       TYR  52  -1.078 -12.918  -1.868
  425    H    ASP  53           HN       ASP  53  -7.243  -8.300  -1.989
  426    HA   ASP  53           HA       ASP  53  -5.421  -6.094  -2.620
  427    HB2  ASP  53           HB2      ASP  53  -7.405  -7.595  -4.308
  428    HB3  ASP  53           HB1      ASP  53  -6.707  -6.086  -4.851
  429    H    GLU  54           HN       GLU  54  -5.957  -4.016  -2.789
  430    HA   GLU  54           HA       GLU  54  -8.657  -3.163  -3.173
  431    HB2  GLU  54           HB2      GLU  54  -8.610  -3.576  -0.710
  432    HB3  GLU  54           HB1      GLU  54  -7.270  -2.456  -0.569
  433    HG2  GLU  54           HG2      GLU  54  -9.401  -1.437   0.089
  434    HG3  GLU  54           HG1      GLU  54  -8.687  -0.621  -1.303
  435    H    TRP  55           HN       TRP  55  -8.832  -0.937  -3.460
  436    HA   TRP  55           HA       TRP  55  -6.475   0.219  -4.742
  437    HB2  TRP  55           HB2      TRP  55  -9.391   0.696  -4.870
  438    HB3  TRP  55           HB1      TRP  55  -8.232   1.730  -5.702
  439    HD1  TRP  55           HD1      TRP  55  -9.615  -1.861  -5.780
  440    HE1  TRP  55           HE1      TRP  55  -9.089  -2.889  -8.080
  441    HE3  TRP  55           HE3      TRP  55  -6.681   1.860  -7.651
  442    HZ2  TRP  55           HZ2      TRP  55  -7.592  -2.191 -10.398
  443    HZ3  TRP  55           HZ3      TRP  55  -5.722   1.612  -9.893
  444    HH2  TRP  55           HH2      TRP  55  -6.156  -0.373 -11.234
  445    H    VAL  56           HN       VAL  56  -5.487   1.833  -3.808
  446    HA   VAL  56           HA       VAL  56  -7.001   3.772  -2.240
  447    HB   VAL  56           HB       VAL  56  -5.108   3.979  -0.586
  448   HG11  VAL  56          HG11      VAL  56  -6.485   1.300  -0.640
  449   HG12  VAL  56          HG12      VAL  56  -7.162   2.803  -0.018
  450   HG13  VAL  56          HG13      VAL  56  -5.771   2.070   0.777
  451   HG21  VAL  56          HG21      VAL  56  -3.532   2.124  -0.331
  452   HG22  VAL  56          HG22      VAL  56  -3.379   2.858  -1.927
  453   HG23  VAL  56          HG23      VAL  56  -4.228   1.329  -1.744
  454    H    LYS  57           HN       LYS  57  -6.027   5.858  -2.165
  455    HA   LYS  57           HA       LYS  57  -4.464   6.368  -4.549
  456    HB2  LYS  57           HB2      LYS  57  -6.524   7.683  -4.033
  457    HB3  LYS  57           HB1      LYS  57  -5.752   8.266  -2.574
  458    HG2  LYS  57           HG2      LYS  57  -4.074   9.426  -3.912
  459    HG3  LYS  57           HG1      LYS  57  -4.831   8.821  -5.392
  460    HD2  LYS  57           HD2      LYS  57  -6.882   9.991  -4.879
  461    HD3  LYS  57           HD1      LYS  57  -6.251  10.499  -3.317
  462    HE2  LYS  57           HE2      LYS  57  -4.596  11.881  -4.396
  463    HE3  LYS  57           HE1      LYS  57  -5.086  11.305  -5.984
  464    HZ1  LYS  57           HZ1      LYS  57  -6.800  12.849  -4.108
  465    HZ2  LYS  57           HZ2      LYS  57  -7.247  12.273  -5.641
  466    HZ3  LYS  57           HZ3      LYS  57  -6.070  13.452  -5.509
  467    H    ALA  58           HN       ALA  58  -2.624   7.814  -4.396
  468    HA   ALA  58           HA       ALA  58  -0.572   6.877  -2.812
  469    HB1  ALA  58           HB1      ALA  58   0.743   8.682  -3.670
  470    HB2  ALA  58           HB2      ALA  58  -0.706   9.620  -3.999
  471    HB3  ALA  58           HB3      ALA  58  -0.379   8.185  -4.950
  472    H    ASP  59           HN       ASP  59  -2.811   9.423  -2.205
  473    HA   ASP  59           HA       ASP  59  -1.334  10.778  -0.163
  474    HB2  ASP  59           HB2      ASP  59  -4.249  10.936  -0.891
  475    HB3  ASP  59           HB1      ASP  59  -3.464  11.976   0.289
  476    H    ARG  60           HN       ARG  60  -3.135   7.930  -0.107
  477    HA   ARG  60           HA       ARG  60  -3.558   8.178   2.785
  478    HB2  ARG  60           HB2      ARG  60  -4.869   6.559   0.685
  479    HB3  ARG  60           HB1      ARG  60  -4.794   5.938   2.325
  480    HG2  ARG  60           HG2      ARG  60  -5.878   8.111   3.040
  481    HG3  ARG  60           HG1      ARG  60  -6.191   8.396   1.318
  482    HD2  ARG  60           HD2      ARG  60  -7.371   6.268   1.146
  483    HD3  ARG  60           HD1      ARG  60  -6.770   5.942   2.781
  484    HE   ARG  60           HE       ARG  60  -8.243   7.490   3.675
  485   HH11  ARG  60          HH11      ARG  60  -8.970   6.595   0.320
  486   HH12  ARG  60          HH12      ARG  60 -10.639   6.912   0.407
  487   HH21  ARG  60          HH21      ARG  60 -10.573   7.999   3.788
  488   HH22  ARG  60          HH22      ARG  60 -11.561   7.795   2.414
  489    H    ILE  61           HN       ILE  61  -1.173   7.293   0.949
  490    HA   ILE  61           HA       ILE  61  -0.742   4.761   2.310
  491    HB   ILE  61           HB       ILE  61   0.584   5.822  -0.211
  492   HG12  ILE  61          HG12      ILE  61  -1.509   3.667   0.149
  493   HG13  ILE  61          HG11      ILE  61  -1.753   5.232  -0.612
  494   HG21  ILE  61          HG21      ILE  61   0.771   3.125   1.115
  495   HG22  ILE  61          HG22      ILE  61   2.044   4.352   1.083
  496   HG23  ILE  61          HG23      ILE  61   1.528   3.570  -0.416
  497   HD11  ILE  61          HD11      ILE  61   0.008   3.009  -1.591
  498   HD12  ILE  61          HD12      ILE  61  -0.159   4.584  -2.376
  499   HD13  ILE  61          HD13      ILE  61  -1.543   3.492  -2.276
  500    H    ILE  62           HN       ILE  62   1.048   4.557   3.535
  501    HA   ILE  62           HA       ILE  62   2.709   6.947   3.832
  502    HB   ILE  62           HB       ILE  62   2.592   4.599   5.764
  503   HG12  ILE  62          HG12      ILE  62   1.519   6.390   7.353
  504   HG13  ILE  62          HG11      ILE  62   1.035   7.185   5.859
  505   HG21  ILE  62          HG21      ILE  62   3.840   7.309   6.060
  506   HG22  ILE  62          HG22      ILE  62   4.671   5.775   5.799
  507   HG23  ILE  62          HG23      ILE  62   3.789   6.053   7.301
  508   HD11  ILE  62          HD11      ILE  62  -0.170   5.046   5.249
  509   HD12  ILE  62          HD12      ILE  62  -0.798   5.894   6.653
  510   HD13  ILE  62          HD13      ILE  62   0.206   4.469   6.880
  511    H    TRP  63           HN       TRP  63   4.269   6.722   2.528
  512    HA   TRP  63           HA       TRP  63   5.309   4.175   1.725
  513    HB2  TRP  63           HB2      TRP  63   6.122   7.003   1.032
  514    HB3  TRP  63           HB1      TRP  63   6.789   5.551   0.291
  515    HD1  TRP  63           HD1      TRP  63   3.607   7.692   0.351
  516    HE1  TRP  63           HE1      TRP  63   2.136   7.013  -1.637
  517    HE3  TRP  63           HE3      TRP  63   6.282   3.662  -1.248
  518    HZ2  TRP  63           HZ2      TRP  63   2.133   5.004  -3.636
  519    HZ3  TRP  63           HZ3      TRP  63   5.487   2.412  -3.203
  520    HH2  TRP  63           HH2      TRP  63   3.459   3.064  -4.365
  521    HA   PRO  64           HA       PRO  64   8.412   4.397   4.967
  522    HB2  PRO  64           HB2      PRO  64   9.663   2.212   3.401
  523    HB3  PRO  64           HB1      PRO  64   9.198   2.220   5.104
  524    HG2  PRO  64           HG2      PRO  64   7.814   0.807   3.312
  525    HG3  PRO  64           HG1      PRO  64   7.008   1.649   4.650
  526    HD2  PRO  64           HD2      PRO  64   7.219   2.445   1.771
  527    HD3  PRO  64           HD1      PRO  64   5.838   2.562   2.887
  528    H    LEU  65           HN       LEU  65   9.808   5.901   4.777
  529    HA   LEU  65           HA       LEU  65  11.960   6.150   3.026
  530    HB2  LEU  65           HB2      LEU  65   9.855   6.559   1.483
  531    HB3  LEU  65           HB1      LEU  65   9.740   8.075   2.343
  532    HG   LEU  65           HG       LEU  65  10.774   8.407   0.183
  533   HD11  LEU  65          HD11      LEU  65  12.814   8.704   2.364
  534   HD12  LEU  65          HD12      LEU  65  11.580   9.877   1.906
  535   HD13  LEU  65          HD13      LEU  65  12.882   9.485   0.783
  536   HD21  LEU  65          HD21      LEU  65  12.860   6.442   1.075
  537   HD22  LEU  65          HD22      LEU  65  12.866   7.370  -0.435
  538   HD23  LEU  65          HD23      LEU  65  11.610   6.169  -0.138
  539    H    ASP  66           HN       ASP  66  12.476   6.483   5.294
  540    HA   ASP  66           HA       ASP  66  13.334   7.846   6.889
  541    HB2  ASP  66           HB2      ASP  66  14.011   9.452   5.291
  542    HB3  ASP  66           HB1      ASP  66  12.370  10.003   5.019
  543    H    LYS  67           HN       LYS  67  10.041   8.442   6.009
  544    HA   LYS  67           HA       LYS  67   8.101   8.442   7.161
  545    HB2  LYS  67           HB2      LYS  67   9.196   6.813   8.769
  546    HB3  LYS  67           HB1      LYS  67   9.697   8.180   9.741
  547    HG2  LYS  67           HG2      LYS  67   7.765   7.199  10.760
  548    HG3  LYS  67           HG1      LYS  67   7.280   8.743  10.059
  549    HD2  LYS  67           HD2      LYS  67   6.326   7.599   8.133
  550    HD3  LYS  67           HD1      LYS  67   6.885   6.048   8.749
  551    HE2  LYS  67           HE2      LYS  67   4.836   7.847  10.058
  552    HE3  LYS  67           HE1      LYS  67   4.498   6.370   9.172
  553    HZ1  LYS  67           HZ1      LYS  67   5.829   5.168  10.888
  554    HZ2  LYS  67           HZ2      LYS  67   4.428   5.878  11.441
  555    HZ3  LYS  67           HZ3      LYS  67   5.897   6.605  11.791
  556    H    GLY  68           HN       GLY  68   6.733  10.054   8.002
  557    HA2  GLY  68           HA2      GLY  68   6.427  12.081   9.243
  558    HA3  GLY  68           HA1      GLY  68   8.098  12.488   8.890
  559    H    LEU  69           HN       LEU  69   8.110  11.798   6.162
  560    HA   LEU  69           HA       LEU  69   7.814  12.619   4.140
  561    HB2  LEU  69           HB2      LEU  69   5.075  13.133   5.207
  562    HB3  LEU  69           HB1      LEU  69   5.496  13.640   3.579
  563    HG   LEU  69           HG       LEU  69   6.069  11.196   3.134
  564   HD11  LEU  69          HD11      LEU  69   6.262  10.392   5.401
  565   HD12  LEU  69          HD12      LEU  69   5.020   9.495   4.529
  566   HD13  LEU  69          HD13      LEU  69   4.558  10.738   5.692
  567   HD21  LEU  69          HD21      LEU  69   4.057  12.221   2.256
  568   HD22  LEU  69          HD22      LEU  69   3.207  11.896   3.768
  569   HD23  LEU  69          HD23      LEU  69   3.733  10.558   2.746
  570    H    GLU  70           HN       GLU  70   8.367  14.327   6.598
  571    HA   GLU  70           HA       GLU  70   9.088  16.661   5.133
  572    HB2  GLU  70           HB2      GLU  70   6.724  17.166   5.793
  573    HB3  GLU  70           HB1      GLU  70   7.162  16.920   7.468
  574    HG2  GLU  70           HG2      GLU  70   8.398  19.070   5.746
  575    HG3  GLU  70           HG1      GLU  70   6.941  19.320   6.691
  576    H    HIS  71           HN       HIS  71  11.091  16.743   5.712
  577    HA   HIS  71           HA       HIS  71  11.716  17.132   8.453
  578    HB2  HIS  71           HB2      HIS  71  12.910  14.820   6.945
  579    HB3  HIS  71           HB1      HIS  71  13.899  15.685   8.119
  580    HD1  HIS  71           HD1      HIS  71  12.080  12.725   7.997
  581    HD2  HIS  71           HD2      HIS  71  12.115  15.913  10.664
  582    HE1  HIS  71           HE1      HIS  71  11.110  11.840  10.120
  583    HE2  HIS  71           HE2      HIS  71  10.875  13.869  11.594
  584    H    HIS  72           HN       HIS  72  11.722  19.137   7.540
  585    HA   HIS  72           HA       HIS  72  13.560  19.956   5.557
  586    HB2  HIS  72           HB2      HIS  72  13.040  22.262   6.190
  587    HB3  HIS  72           HB1      HIS  72  11.578  21.296   6.101
  588    HD1  HIS  72           HD1      HIS  72  10.398  20.760   8.395
  589    HD2  HIS  72           HD2      HIS  72  13.586  23.402   8.655
  590    HE1  HIS  72           HE1      HIS  72  10.143  21.916  10.623
  591    HE2  HIS  72           HE2      HIS  72  12.190  23.375  10.820
  592    H    HIS  73           HN       HIS  73  14.085  19.176   8.808
  593    HA   HIS  73           HA       HIS  73  16.459  20.807   9.049
  594    HB2  HIS  73           HB2      HIS  73  15.067  20.364  11.049
  595    HB3  HIS  73           HB1      HIS  73  15.416  18.646  10.912
  596    HD1  HIS  73           HD1      HIS  73  17.197  17.924  12.506
  597    HD2  HIS  73           HD2      HIS  73  17.704  21.872  11.323
  598    HE1  HIS  73           HE1      HIS  73  19.213  18.742  13.733
  599    HE2  HIS  73           HE2      HIS  73  19.689  20.942  12.682
  600    H    HIS  74           HN       HIS  74  15.733  17.843   7.607
  601    HA   HIS  74           HA       HIS  74  18.570  17.312   7.402
  602    HB2  HIS  74           HB2      HIS  74  17.777  15.829   9.218
  603    HB3  HIS  74           HB1      HIS  74  16.569  15.159   8.128
  604    HD1  HIS  74           HD1      HIS  74  17.279  13.061   6.958
  605    HD2  HIS  74           HD2      HIS  74  20.525  15.339   8.197
  606    HE1  HIS  74           HE1      HIS  74  19.316  11.719   6.383
  607    HE2  HIS  74           HE2      HIS  74  21.192  12.972   7.456
  608    H    HIS  75           HN       HIS  75  18.830  17.656   5.378
  609    HA   HIS  75           HA       HIS  75  16.875  17.408   3.367
  610    HB2  HIS  75           HB2      HIS  75  18.906  18.915   3.337
  611    HB3  HIS  75           HB1      HIS  75  19.871  17.491   2.991
  612    HD1  HIS  75           HD1      HIS  75  19.941  16.694   0.577
  613    HD2  HIS  75           HD2      HIS  75  17.104  19.654   1.236
  614    HE1  HIS  75           HE1      HIS  75  19.097  17.344  -1.676
  615    HE2  HIS  75           HE2      HIS  75  17.651  19.326  -1.247
  616    H    HIS  76           HN       HIS  76  16.497  15.840   1.896
  617    HA   HIS  76           HA       HIS  76  17.637  13.216   2.455
  618    HB2  HIS  76           HB2      HIS  76  15.227  13.969   0.761
  619    HB3  HIS  76           HB1      HIS  76  15.718  12.342   1.202
  620    HD1  HIS  76           HD1      HIS  76  13.515  15.038   2.236
  621    HD2  HIS  76           HD2      HIS  76  15.490  11.910   4.130
  622    HE1  HIS  76           HE1      HIS  76  12.348  14.736   4.411
  623    HE2  HIS  76           HE2      HIS  76  13.459  12.766   5.499
  Start of MODEL    6
    1    H1   GLU   1           HT1      GLU   1  12.111 -13.229 -16.657
    2    H2   GLU   1           HT2      GLU   1  10.707 -14.117 -17.004
    3    H3   GLU   1           HT3      GLU   1  10.863 -13.252 -15.544
    4    HA   GLU   1           HA       GLU   1  10.873 -11.972 -18.184
    5    HB2  GLU   1           HB2      GLU   1   8.601 -12.167 -16.167
    6    HB3  GLU   1           HB1      GLU   1   8.626 -11.061 -17.516
    7    HG2  GLU   1           HG2      GLU   1   7.209 -12.916 -18.041
    8    HG3  GLU   1           HG1      GLU   1   8.648 -13.012 -19.049
    9    H    ASP   2           HN       ASP   2  10.588  -9.657 -17.949
   10    HA   ASP   2           HA       ASP   2  11.382  -8.698 -15.312
   11    HB2  ASP   2           HB2      ASP   2  13.263  -8.513 -16.958
   12    HB3  ASP   2           HB1      ASP   2  12.228  -7.519 -17.975
   13    H    MET   3           HN       MET   3   9.258  -8.351 -14.806
   14    HA   MET   3           HA       MET   3   8.030  -6.129 -16.239
   15    HB2  MET   3           HB2      MET   3   6.892  -8.224 -16.916
   16    HB3  MET   3           HB1      MET   3   6.594  -8.586 -15.222
   17    HG2  MET   3           HG2      MET   3   5.195  -6.580 -15.035
   18    HG3  MET   3           HG1      MET   3   5.489  -6.221 -16.734
   19    HE1  MET   3           HE1      MET   3   4.824  -9.752 -15.027
   20    HE2  MET   3           HE2      MET   3   3.074  -9.862 -15.194
   21    HE3  MET   3           HE3      MET   3   3.783  -8.624 -14.155
   22    H    GLU   4           HN       GLU   4   8.070  -4.562 -14.846
   23    HA   GLU   4           HA       GLU   4   7.204  -5.101 -12.104
   24    HB2  GLU   4           HB2      GLU   4   9.343  -3.151 -12.998
   25    HB3  GLU   4           HB1      GLU   4   8.762  -3.353 -11.349
   26    HG2  GLU   4           HG2      GLU   4   9.644  -5.566 -11.238
   27    HG3  GLU   4           HG1      GLU   4  10.074  -5.530 -12.945
   28    HA   PRO   5           HA       PRO   5   3.963  -2.590 -14.078
   29    HB2  PRO   5           HB2      PRO   5   3.172  -2.855 -11.207
   30    HB3  PRO   5           HB1      PRO   5   2.159  -2.919 -12.654
   31    HG2  PRO   5           HG2      PRO   5   2.903  -5.164 -11.466
   32    HG3  PRO   5           HG1      PRO   5   2.895  -5.044 -13.235
   33    HD2  PRO   5           HD2      PRO   5   5.217  -5.098 -11.371
   34    HD3  PRO   5           HD1      PRO   5   5.094  -5.643 -13.044
   35    H    CYS   6           HN       CYS   6   4.459  -1.677 -10.703
   36    HA   CYS   6           HA       CYS   6   5.704   0.813 -11.201
   37    HB2  CYS   6           HB2      CYS   6   3.372   1.145 -12.227
   38    HB3  CYS   6           HB1      CYS   6   2.726   0.997 -10.606
   39    HG   CYS   6           HG       CYS   6   2.933   3.661 -11.774
   40    H    LEU   7           HN       LEU   7   6.781   1.014  -9.311
   41    HA   LEU   7           HA       LEU   7   7.384   1.001  -7.140
   42    HB2  LEU   7           HB2      LEU   7   4.435   1.487  -6.751
   43    HB3  LEU   7           HB1      LEU   7   5.535   1.403  -5.398
   44    HG   LEU   7           HG       LEU   7   5.150   3.672  -5.793
   45   HD11  LEU   7          HD11      LEU   7   7.803   3.053  -7.039
   46   HD12  LEU   7          HD12      LEU   7   7.441   3.211  -5.324
   47   HD13  LEU   7          HD13      LEU   7   7.298   4.610  -6.387
   48   HD21  LEU   7          HD21      LEU   7   5.455   4.800  -7.961
   49   HD22  LEU   7          HD22      LEU   7   4.169   3.601  -8.001
   50   HD23  LEU   7          HD23      LEU   7   5.735   3.233  -8.720
   51    H    THR   8           HN       THR   8   6.622  -1.569  -8.394
   52    HA   THR   8           HA       THR   8   5.191  -3.117  -6.575
   53    HB   THR   8           HB       THR   8   6.241  -4.971  -8.082
   54    HG1  THR   8           HG1      THR   8   7.829  -3.631  -9.036
   55   HG21  THR   8          HG21      THR   8   3.921  -4.166  -8.061
   56   HG22  THR   8          HG22      THR   8   4.488  -4.502  -9.686
   57   HG23  THR   8          HG23      THR   8   4.390  -2.834  -9.114
   58    H    GLY   9           HN       GLY   9   5.758  -4.700  -5.204
   59    HA2  GLY   9           HA2      GLY   9   7.268  -6.131  -4.082
   60    HA3  GLY   9           HA1      GLY   9   8.597  -5.109  -4.621
   61    H    THR  10           HN       THR  10   7.369  -2.658  -3.920
   62    HA   THR  10           HA       THR  10   8.334  -2.303  -1.336
   63    HB   THR  10           HB       THR  10   6.283  -0.549  -2.641
   64    HG1  THR  10           HG1      THR  10   7.620  -0.464  -4.267
   65   HG21  THR  10          HG21      THR  10   8.718   0.014  -0.926
   66   HG22  THR  10          HG22      THR  10   7.037   0.089  -0.401
   67   HG23  THR  10          HG23      THR  10   7.641   1.240  -1.592
   68    H    LYS  11           HN       LYS  11   7.385  -2.728   0.568
   69    HA   LYS  11           HA       LYS  11   4.502  -3.058   0.618
   70    HB2  LYS  11           HB2      LYS  11   4.742  -3.904   2.900
   71    HB3  LYS  11           HB1      LYS  11   5.713  -4.835   1.778
   72    HG2  LYS  11           HG2      LYS  11   7.717  -3.978   2.587
   73    HG3  LYS  11           HG1      LYS  11   6.929  -2.602   3.362
   74    HD2  LYS  11           HD2      LYS  11   6.601  -5.483   4.218
   75    HD3  LYS  11           HD1      LYS  11   7.709  -4.331   4.969
   76    HE2  LYS  11           HE2      LYS  11   5.746  -2.861   5.454
   77    HE3  LYS  11           HE1      LYS  11   4.698  -4.128   4.830
   78    HZ1  LYS  11           HZ1      LYS  11   6.557  -4.533   7.088
   79    HZ2  LYS  11           HZ2      LYS  11   5.272  -5.547   6.628
   80    HZ3  LYS  11           HZ3      LYS  11   4.975  -4.029   7.263
   81    H    VAL  12           HN       VAL  12   3.254  -1.631   1.445
   82    HA   VAL  12           HA       VAL  12   4.487   0.713   2.726
   83    HB   VAL  12           HB       VAL  12   2.771   2.097   1.675
   84   HG11  VAL  12          HG11      VAL  12   4.309   0.429  -0.306
   85   HG12  VAL  12          HG12      VAL  12   4.911   1.846   0.554
   86   HG13  VAL  12          HG13      VAL  12   3.609   2.015  -0.625
   87   HG21  VAL  12          HG21      VAL  12   1.319   1.206  -0.087
   88   HG22  VAL  12          HG22      VAL  12   1.013   0.401   1.452
   89   HG23  VAL  12          HG23      VAL  12   1.955  -0.416   0.204
   90    H    LYS  13           HN       LYS  13   2.699   2.001   3.849
   91    HA   LYS  13           HA       LYS  13   0.799   0.154   5.052
   92    HB2  LYS  13           HB2      LYS  13   2.671   0.897   6.605
   93    HB3  LYS  13           HB1      LYS  13   2.059   2.538   6.400
   94    HG2  LYS  13           HG2      LYS  13   0.123   2.119   7.589
   95    HG3  LYS  13           HG1      LYS  13   0.271   0.370   7.414
   96    HD2  LYS  13           HD2      LYS  13   0.809   1.123   9.701
   97    HD3  LYS  13           HD1      LYS  13   2.185   0.354   8.914
   98    HE2  LYS  13           HE2      LYS  13   3.068   2.590   8.363
   99    HE3  LYS  13           HE1      LYS  13   1.712   3.312   9.226
  100    HZ1  LYS  13           HZ1      LYS  13   3.656   3.246  10.603
  101    HZ2  LYS  13           HZ2      LYS  13   3.805   1.572  10.407
  102    HZ3  LYS  13           HZ3      LYS  13   2.490   2.215  11.241
  103    H    VAL  14           HN       VAL  14  -1.231   0.916   5.215
  104    HA   VAL  14           HA       VAL  14  -1.739   3.395   3.715
  105    HB   VAL  14           HB       VAL  14  -3.405   0.864   3.711
  106   HG11  VAL  14          HG11      VAL  14  -4.720   2.927   3.478
  107   HG12  VAL  14          HG12      VAL  14  -4.781   1.913   2.052
  108   HG13  VAL  14          HG13      VAL  14  -3.765   3.358   2.057
  109   HG21  VAL  14          HG21      VAL  14  -2.724   0.636   1.351
  110   HG22  VAL  14          HG22      VAL  14  -1.346   0.546   2.443
  111   HG23  VAL  14          HG23      VAL  14  -1.648   2.021   1.530
  112    H    LYS  15           HN       LYS  15  -3.077   4.802   4.595
  113    HA   LYS  15           HA       LYS  15  -4.515   4.081   7.067
  114    HB2  LYS  15           HB2      LYS  15  -2.840   5.998   7.223
  115    HB3  LYS  15           HB1      LYS  15  -3.826   6.808   5.997
  116    HG2  LYS  15           HG2      LYS  15  -5.717   6.919   7.512
  117    HG3  LYS  15           HG1      LYS  15  -4.820   6.041   8.749
  118    HD2  LYS  15           HD2      LYS  15  -3.171   7.866   8.833
  119    HD3  LYS  15           HD1      LYS  15  -4.087   8.745   7.616
  120    HE2  LYS  15           HE2      LYS  15  -5.104   7.979  10.362
  121    HE3  LYS  15           HE1      LYS  15  -4.513   9.572   9.909
  122    HZ1  LYS  15           HZ1      LYS  15  -6.973   8.215   8.914
  123    HZ2  LYS  15           HZ2      LYS  15  -6.338   9.637   8.239
  124    HZ3  LYS  15           HZ3      LYS  15  -6.850   9.625   9.830
  125    H    TYR  16           HN       TYR  16  -6.490   3.453   6.299
  126    HA   TYR  16           HA       TYR  16  -7.755   5.130   4.248
  127    HB2  TYR  16           HB2      TYR  16  -7.414   2.479   4.193
  128    HB3  TYR  16           HB1      TYR  16  -8.808   2.511   5.259
  129    HD1  TYR  16           HD1      TYR  16 -10.860   3.847   4.362
  130    HD2  TYR  16           HD2      TYR  16  -7.705   2.423   1.927
  131    HE1  TYR  16           HE1      TYR  16 -12.360   3.919   2.392
  132    HE2  TYR  16           HE2      TYR  16  -9.184   2.489  -0.070
  133    HH   TYR  16           HH       TYR  16 -11.572   2.417  -0.526
  134    H    GLY  17           HN       GLY  17  -8.917   6.675   5.244
  135    HA2  GLY  17           HA2      GLY  17 -10.104   5.990   7.837
  136    HA3  GLY  17           HA1      GLY  17  -9.292   7.509   7.539
  137    H    ARG  18           HN       ARG  18 -12.112   5.979   7.754
  138    HA   ARG  18           HA       ARG  18 -13.639   8.295   6.895
  139    HB2  ARG  18           HB2      ARG  18 -14.603   5.445   6.548
  140    HB3  ARG  18           HB1      ARG  18 -15.425   6.894   6.070
  141    HG2  ARG  18           HG2      ARG  18 -13.659   7.269   4.315
  142    HG3  ARG  18           HG1      ARG  18 -13.021   5.669   4.749
  143    HD2  ARG  18           HD2      ARG  18 -15.120   4.630   4.222
  144    HD3  ARG  18           HD1      ARG  18 -15.846   6.189   3.854
  145    HE   ARG  18           HE       ARG  18 -13.595   5.809   2.245
  146   HH11  ARG  18          HH11      ARG  18 -16.842   4.468   2.688
  147   HH12  ARG  18          HH12      ARG  18 -17.050   4.022   1.054
  148   HH21  ARG  18          HH21      ARG  18 -13.880   5.181  -0.039
  149   HH22  ARG  18          HH22      ARG  18 -15.342   4.460  -0.525
  150    H    GLY  19           HN       GLY  19 -15.836   8.028   8.109
  151    HA2  GLY  19           HA2      GLY  19 -15.499   8.016  10.827
  152    HA3  GLY  19           HA1      GLY  19 -17.024   7.649  10.043
  153    H    LYS  20           HN       LYS  20 -16.820   5.245   9.036
  154    HA   LYS  20           HA       LYS  20 -16.206   3.518  11.310
  155    HB2  LYS  20           HB2      LYS  20 -18.420   3.175  10.355
  156    HB3  LYS  20           HB1      LYS  20 -17.737   2.963   8.750
  157    HG2  LYS  20           HG2      LYS  20 -18.333   0.802   9.624
  158    HG3  LYS  20           HG1      LYS  20 -16.575   0.940   9.550
  159    HD2  LYS  20           HD2      LYS  20 -16.662   1.603  12.001
  160    HD3  LYS  20           HD1      LYS  20 -18.349   1.099  11.972
  161    HE2  LYS  20           HE2      LYS  20 -17.040  -0.739  12.795
  162    HE3  LYS  20           HE1      LYS  20 -17.598  -1.142  11.173
  163    HZ1  LYS  20           HZ1      LYS  20 -15.276  -1.731  11.456
  164    HZ2  LYS  20           HZ2      LYS  20 -14.894  -0.174  11.908
  165    HZ3  LYS  20           HZ3      LYS  20 -15.383  -0.478  10.327
  166    H    THR  21           HN       THR  21 -15.504   3.860   7.866
  167    HA   THR  21           HA       THR  21 -13.714   1.650   7.792
  168    HB   THR  21           HB       THR  21 -14.006   3.867   5.759
  169    HG1  THR  21           HG1      THR  21 -15.481   1.451   5.873
  170   HG21  THR  21          HG21      THR  21 -12.163   2.278   5.399
  171   HG22  THR  21          HG22      THR  21 -13.396   2.187   4.155
  172   HG23  THR  21          HG23      THR  21 -13.321   0.936   5.405
  173    H    GLN  22           HN       GLN  22 -12.572   2.807   9.760
  174    HA   GLN  22           HA       GLN  22 -10.171   4.034   8.620
  175    HB2  GLN  22           HB2      GLN  22 -11.183   5.813   9.889
  176    HB3  GLN  22           HB1      GLN  22 -11.449   4.735  11.249
  177    HG2  GLN  22           HG2      GLN  22  -9.562   6.227  11.749
  178    HG3  GLN  22           HG1      GLN  22  -9.083   4.531  11.584
  179   HE21  GLN  22          HE21      GLN  22  -7.617   3.949  10.115
  180   HE22  GLN  22          HE22      GLN  22  -6.796   5.049   9.061
  181    H    LYS  23           HN       LYS  23  -8.859   2.609   8.493
  182    HA   LYS  23           HA       LYS  23  -7.808   1.394  10.807
  183    HB2  LYS  23           HB2      LYS  23  -7.882  -0.976   9.985
  184    HB3  LYS  23           HB1      LYS  23  -9.454  -0.341  10.379
  185    HG2  LYS  23           HG2      LYS  23  -8.393  -0.661   7.568
  186    HG3  LYS  23           HG1      LYS  23  -9.422  -1.822   8.400
  187    HD2  LYS  23           HD2      LYS  23 -11.007   0.237   8.693
  188    HD3  LYS  23           HD1      LYS  23 -10.073   0.906   7.361
  189    HE2  LYS  23           HE2      LYS  23 -11.554  -1.697   7.372
  190    HE3  LYS  23           HE1      LYS  23 -12.112  -0.222   6.584
  191    HZ1  LYS  23           HZ1      LYS  23 -11.216  -1.555   4.922
  192    HZ2  LYS  23           HZ2      LYS  23  -9.976  -2.087   5.832
  193    HZ3  LYS  23           HZ3      LYS  23  -9.914  -0.519   5.176
  194    H    ILE  24           HN       ILE  24  -5.711   0.975  10.628
  195    HA   ILE  24           HA       ILE  24  -4.453   1.768   8.123
  196    HB   ILE  24           HB       ILE  24  -3.369   1.700  10.962
  197   HG12  ILE  24          HG12      ILE  24  -4.138   4.120   9.335
  198   HG13  ILE  24          HG11      ILE  24  -5.208   3.371  10.515
  199   HG21  ILE  24          HG21      ILE  24  -1.627   1.451   9.255
  200   HG22  ILE  24          HG22      ILE  24  -1.511   3.024  10.044
  201   HG23  ILE  24          HG23      ILE  24  -2.216   2.896   8.433
  202   HD11  ILE  24          HD11      ILE  24  -2.507   4.569  11.089
  203   HD12  ILE  24          HD12      ILE  24  -3.597   3.791  12.243
  204   HD13  ILE  24          HD13      ILE  24  -4.088   5.291  11.452
  205    H    TYR  25           HN       TYR  25  -3.263   0.301   7.137
  206    HA   TYR  25           HA       TYR  25  -2.419  -2.128   8.439
  207    HB2  TYR  25           HB2      TYR  25  -3.446  -3.338   6.271
  208    HB3  TYR  25           HB1      TYR  25  -4.337  -3.197   7.772
  209    HD1  TYR  25           HD2      TYR  25  -3.886  -0.405   5.310
  210    HD2  TYR  25           HD1      TYR  25  -6.476  -3.405   6.860
  211    HE1  TYR  25           HE2      TYR  25  -5.790   0.593   4.089
  212    HE2  TYR  25           HE1      TYR  25  -8.333  -2.436   5.664
  213    HH   TYR  25           HH       TYR  25  -8.019  -0.175   3.209
  214    H    GLU  26           HN       GLU  26  -1.129  -3.480   6.960
  215    HA   GLU  26           HA       GLU  26   0.475  -1.733   5.236
  216    HB2  GLU  26           HB2      GLU  26   1.239  -4.227   6.752
  217    HB3  GLU  26           HB1      GLU  26   2.314  -3.322   5.695
  218    HG2  GLU  26           HG2      GLU  26   2.212  -1.409   7.128
  219    HG3  GLU  26           HG1      GLU  26   0.984  -2.177   8.132
  220    H    ALA  27           HN       ALA  27   0.918  -2.326   3.202
  221    HA   ALA  27           HA       ALA  27  -0.171  -4.852   2.194
  222    HB1  ALA  27           HB1      ALA  27  -1.340  -3.725   0.429
  223    HB2  ALA  27           HB2      ALA  27  -0.810  -2.159   1.033
  224    HB3  ALA  27           HB3      ALA  27  -1.928  -3.139   1.982
  225    H    SER  28           HN       SER  28   0.617  -5.405   0.128
  226    HA   SER  28           HA       SER  28   3.173  -4.131  -0.519
  227    HB2  SER  28           HB2      SER  28   2.085  -6.698  -1.655
  228    HB3  SER  28           HB1      SER  28   3.761  -6.149  -1.502
  229    HG   SER  28           HG       SER  28   3.576  -6.406   0.773
  230    H    ILE  29           HN       ILE  29   3.457  -3.186  -2.544
  231    HA   ILE  29           HA       ILE  29   1.089  -2.478  -4.022
  232    HB   ILE  29           HB       ILE  29   3.970  -1.950  -4.799
  233   HG12  ILE  29          HG12      ILE  29   3.604  -1.045  -2.552
  234   HG13  ILE  29          HG11      ILE  29   3.739   0.258  -3.720
  235   HG21  ILE  29          HG21      ILE  29   2.413  -1.592  -6.612
  236   HG22  ILE  29          HG22      ILE  29   3.025  -0.036  -6.041
  237   HG23  ILE  29          HG23      ILE  29   1.408  -0.570  -5.585
  238   HD11  ILE  29          HD11      ILE  29   2.018   0.767  -2.153
  239   HD12  ILE  29          HD12      ILE  29   1.230  -0.781  -2.431
  240   HD13  ILE  29          HD13      ILE  29   1.259   0.435  -3.714
  241    H    LYS  30           HN       LYS  30   0.249  -3.586  -5.687
  242    HA   LYS  30           HA       LYS  30   1.919  -5.613  -7.022
  243    HB2  LYS  30           HB2      LYS  30  -0.598  -5.851  -6.035
  244    HB3  LYS  30           HB1      LYS  30  -0.960  -5.389  -7.687
  245    HG2  LYS  30           HG2      LYS  30   0.625  -7.804  -6.794
  246    HG3  LYS  30           HG1      LYS  30  -0.999  -7.777  -7.427
  247    HD2  LYS  30           HD2      LYS  30   1.404  -6.919  -9.037
  248    HD3  LYS  30           HD1      LYS  30   0.757  -8.555  -9.047
  249    HE2  LYS  30           HE2      LYS  30  -1.398  -7.650  -9.865
  250    HE3  LYS  30           HE1      LYS  30  -0.682  -6.039  -9.905
  251    HZ1  LYS  30           HZ1      LYS  30   0.997  -6.966 -11.493
  252    HZ2  LYS  30           HZ2      LYS  30  -0.555  -6.950 -12.094
  253    HZ3  LYS  30           HZ3      LYS  30   0.107  -8.391 -11.536
  254    H    SER  31           HN       SER  31  -0.140  -2.789  -7.622
  255    HA   SER  31           HA       SER  31   1.254  -2.157 -10.042
  256    HB2  SER  31           HB2      SER  31  -1.693  -2.899 -10.199
  257    HB3  SER  31           HB1      SER  31  -0.742  -2.178 -11.497
  258    HG   SER  31           HG       SER  31   0.561  -4.279 -10.633
  259    H    THR  32           HN       THR  32   0.306  -0.051 -10.966
  260    HA   THR  32           HA       THR  32  -1.362   1.432  -9.094
  261    HB   THR  32           HB       THR  32   1.014   2.763 -10.348
  262    HG1  THR  32           HG1      THR  32   1.043   0.894  -8.314
  263   HG21  THR  32          HG21      THR  32  -0.529   3.238  -7.832
  264   HG22  THR  32          HG22      THR  32  -0.721   4.084  -9.373
  265   HG23  THR  32          HG23      THR  32   0.786   4.232  -8.456
  266    H    GLU  33           HN       GLU  33  -2.522   3.048 -10.238
  267    HA   GLU  33           HA       GLU  33  -1.752   3.632 -12.904
  268    HB2  GLU  33           HB2      GLU  33  -3.700   3.032 -14.022
  269    HB3  GLU  33           HB1      GLU  33  -3.166   1.631 -13.063
  270    HG2  GLU  33           HG2      GLU  33  -4.938   1.923 -11.514
  271    HG3  GLU  33           HG1      GLU  33  -5.371   3.481 -12.220
  272    H    ILE  34           HN       ILE  34  -3.165   5.300 -13.799
  273    HA   ILE  34           HA       ILE  34  -4.010   7.018 -11.616
  274    HB   ILE  34           HB       ILE  34  -3.136   7.761 -14.406
  275   HG12  ILE  34          HG12      ILE  34  -1.271   9.034 -13.236
  276   HG13  ILE  34          HG11      ILE  34  -1.825   8.297 -11.742
  277   HG21  ILE  34          HG21      ILE  34  -4.019   9.555 -12.142
  278   HG22  ILE  34          HG22      ILE  34  -4.892   9.248 -13.640
  279   HG23  ILE  34          HG23      ILE  34  -3.354  10.119 -13.676
  280   HD11  ILE  34          HD11      ILE  34   0.153   7.181 -12.591
  281   HD12  ILE  34          HD12      ILE  34  -0.704   6.807 -14.106
  282   HD13  ILE  34          HD13      ILE  34  -1.260   6.123 -12.579
  283    H    ASP  35           HN       ASP  35  -6.068   7.076 -11.472
  284    HA   ASP  35           HA       ASP  35  -7.733   6.936 -13.863
  285    HB2  ASP  35           HB2      ASP  35  -7.639   4.631 -12.946
  286    HB3  ASP  35           HB1      ASP  35  -8.231   5.243 -11.403
  287    H    ASP  36           HN       ASP  36  -9.369   8.254 -13.815
  288    HA   ASP  36           HA       ASP  36 -10.731   9.930 -13.256
  289    HB2  ASP  36           HB2      ASP  36 -11.553   8.282 -11.490
  290    HB3  ASP  36           HB1      ASP  36 -10.462   9.066 -10.353
  291    H    GLY  37           HN       GLY  37  -7.834  10.101 -13.260
  292    HA2  GLY  37           HA2      GLY  37  -6.545  12.045 -13.367
  293    HA3  GLY  37           HA1      GLY  37  -7.710  12.836 -12.319
  294    H    GLU  38           HN       GLU  38  -7.159  10.136 -10.650
  295    HA   GLU  38           HA       GLU  38  -4.841  11.306  -9.333
  296    HB2  GLU  38           HB2      GLU  38  -5.811  10.364  -7.210
  297    HB3  GLU  38           HB1      GLU  38  -6.673  11.724  -7.920
  298    HG2  GLU  38           HG2      GLU  38  -8.272  10.093  -8.909
  299    HG3  GLU  38           HG1      GLU  38  -7.455   8.822  -8.000
  300    H    VAL  39           HN       VAL  39  -3.669   9.654  -7.887
  301    HA   VAL  39           HA       VAL  39  -3.251   7.367  -9.665
  302    HB   VAL  39           HB       VAL  39  -1.397   8.061  -7.407
  303   HG11  VAL  39          HG11      VAL  39   0.298   6.990  -8.896
  304   HG12  VAL  39          HG12      VAL  39  -0.997   6.632 -10.032
  305   HG13  VAL  39          HG13      VAL  39  -1.017   5.924  -8.443
  306   HG21  VAL  39          HG21      VAL  39  -1.315   9.319 -10.159
  307   HG22  VAL  39          HG22      VAL  39  -0.022   9.408  -8.969
  308   HG23  VAL  39          HG23      VAL  39  -1.589  10.137  -8.625
  309    H    LEU  40           HN       LEU  40  -4.010   5.560  -9.159
  310    HA   LEU  40           HA       LEU  40  -4.673   4.939  -6.380
  311    HB2  LEU  40           HB2      LEU  40  -5.877   3.876  -8.922
  312    HB3  LEU  40           HB1      LEU  40  -6.384   3.482  -7.293
  313    HG   LEU  40           HG       LEU  40  -6.635   6.176  -8.621
  314   HD11  LEU  40          HD11      LEU  40  -8.154   4.483  -9.491
  315   HD12  LEU  40          HD12      LEU  40  -9.009   5.733  -8.592
  316   HD13  LEU  40          HD13      LEU  40  -8.719   4.155  -7.852
  317   HD21  LEU  40          HD21      LEU  40  -6.250   6.409  -6.240
  318   HD22  LEU  40          HD22      LEU  40  -7.519   5.238  -5.890
  319   HD23  LEU  40          HD23      LEU  40  -7.929   6.795  -6.620
  320    H    TYR  41           HN       TYR  41  -3.878   3.196  -5.609
  321    HA   TYR  41           HA       TYR  41  -2.022   1.571  -7.206
  322    HB2  TYR  41           HB2      TYR  41  -2.151   2.144  -4.240
  323    HB3  TYR  41           HB1      TYR  41  -1.069   0.967  -4.963
  324    HD1  TYR  41           HD1      TYR  41  -1.936   4.626  -5.162
  325    HD2  TYR  41           HD2      TYR  41   1.070   1.625  -5.528
  326    HE1  TYR  41           HE1      TYR  41  -0.249   6.347  -5.440
  327    HE2  TYR  41           HE2      TYR  41   2.766   3.377  -5.817
  328    HH   TYR  41           HH       TYR  41   2.882   5.702  -6.521
  329    H    LEU  42           HN       LEU  42  -2.185  -0.628  -7.070
  330    HA   LEU  42           HA       LEU  42  -4.575  -1.655  -5.721
  331    HB2  LEU  42           HB2      LEU  42  -4.555  -2.081  -8.142
  332    HB3  LEU  42           HB1      LEU  42  -2.970  -2.818  -8.009
  333    HG   LEU  42           HG       LEU  42  -3.915  -4.651  -6.690
  334   HD11  LEU  42          HD11      LEU  42  -5.762  -3.496  -5.593
  335   HD12  LEU  42          HD12      LEU  42  -6.349  -4.904  -6.465
  336   HD13  LEU  42          HD13      LEU  42  -6.569  -3.296  -7.144
  337   HD21  LEU  42          HD21      LEU  42  -5.199  -5.711  -8.478
  338   HD22  LEU  42          HD22      LEU  42  -3.779  -4.877  -9.109
  339   HD23  LEU  42          HD23      LEU  42  -5.378  -4.152  -9.279
  340    H    VAL  43           HN       VAL  43  -4.068  -2.398  -3.861
  341    HA   VAL  43           HA       VAL  43  -1.413  -3.571  -3.465
  342    HB   VAL  43           HB       VAL  43  -1.299  -2.512  -1.297
  343   HG11  VAL  43          HG11      VAL  43  -2.201  -0.484  -3.290
  344   HG12  VAL  43          HG12      VAL  43  -0.598  -1.194  -3.187
  345   HG13  VAL  43          HG13      VAL  43  -1.203  -0.192  -1.862
  346   HG21  VAL  43          HG21      VAL  43  -4.062  -1.388  -1.839
  347   HG22  VAL  43          HG22      VAL  43  -3.057  -1.023  -0.438
  348   HG23  VAL  43          HG23      VAL  43  -3.691  -2.654  -0.670
  349    H    HIS  44           HN       HIS  44  -1.329  -5.307  -2.117
  350    HA   HIS  44           HA       HIS  44  -3.892  -6.331  -1.114
  351    HB2  HIS  44           HB2      HIS  44  -3.076  -7.875  -2.850
  352    HB3  HIS  44           HB1      HIS  44  -1.492  -7.929  -2.097
  353    HD1  HIS  44           HD1      HIS  44  -1.859 -10.559  -2.065
  354    HD2  HIS  44           HD2      HIS  44  -4.471  -8.470   0.370
  355    HE1  HIS  44           HE1      HIS  44  -2.753 -12.241  -0.430
  356    HE2  HIS  44           HE2      HIS  44  -4.600 -11.015   0.717
  357    H    TYR  45           HN       TYR  45  -3.987  -6.439   0.960
  358    HA   TYR  45           HA       TYR  45  -1.884  -5.555   2.576
  359    HB2  TYR  45           HB2      TYR  45  -4.431  -7.003   3.388
  360    HB3  TYR  45           HB1      TYR  45  -3.440  -5.961   4.422
  361    HD1  TYR  45           HD2      TYR  45  -3.044  -3.563   3.574
  362    HD2  TYR  45           HD1      TYR  45  -6.220  -6.009   2.183
  363    HE1  TYR  45           HE2      TYR  45  -4.165  -1.578   2.674
  364    HE2  TYR  45           HE1      TYR  45  -7.356  -4.018   1.262
  365    HH   TYR  45           HH       TYR  45  -7.390  -1.555   1.485
  366    H    TYR  46           HN       TYR  46  -0.141  -6.634   2.648
  367    HA   TYR  46           HA       TYR  46   1.397  -8.155   2.618
  368    HB2  TYR  46           HB2      TYR  46  -0.484  -9.393   4.551
  369    HB3  TYR  46           HB1      TYR  46   0.980 -10.267   4.068
  370    HD1  TYR  46           HD2      TYR  46   3.169  -9.201   4.373
  371    HD2  TYR  46           HD1      TYR  46  -0.354  -7.567   6.082
  372    HE1  TYR  46           HE2      TYR  46   4.545  -7.836   5.849
  373    HE2  TYR  46           HE1      TYR  46   1.022  -6.175   7.574
  374    HH   TYR  46           HH       TYR  46   3.293  -6.190   8.495
  375    H    GLY  47           HN       GLY  47   1.519  -8.514   0.514
  376    HA2  GLY  47           HA2      GLY  47   1.981 -10.717  -0.625
  377    HA3  GLY  47           HA1      GLY  47   0.259 -10.992  -0.416
  378    H    TRP  48           HN       TRP  48   0.906 -11.216  -2.834
  379    HA   TRP  48           HA       TRP  48   0.615  -8.663  -4.210
  380    HB2  TRP  48           HB2      TRP  48   1.238 -11.447  -5.264
  381    HB3  TRP  48           HB1      TRP  48   1.110 -10.008  -6.268
  382    HD1  TRP  48           HD1      TRP  48   3.333 -11.412  -3.410
  383    HE1  TRP  48           HE1      TRP  48   5.666 -10.379  -3.606
  384    HE3  TRP  48           HE3      TRP  48   2.480  -8.188  -7.310
  385    HZ2  TRP  48           HZ2      TRP  48   6.989  -8.455  -5.216
  386    HZ3  TRP  48           HZ3      TRP  48   4.335  -6.803  -8.107
  387    HH2  TRP  48           HH2      TRP  48   6.543  -6.936  -7.081
  388    H    ASN  49           HN       ASN  49  -0.897  -9.006  -6.271
  389    HA   ASN  49           HA       ASN  49  -3.500  -8.999  -5.189
  390    HB2  ASN  49           HB2      ASN  49  -3.014  -7.598  -7.087
  391    HB3  ASN  49           HB1      ASN  49  -2.638  -9.000  -8.085
  392   HD21  ASN  49          HD21      ASN  49  -5.162  -7.144  -6.587
  393   HD22  ASN  49          HD22      ASN  49  -6.457  -7.775  -7.515
  394    H    VAL  50           HN       VAL  50  -4.470 -10.621  -4.475
  395    HA   VAL  50           HA       VAL  50  -4.230 -13.156  -5.845
  396    HB   VAL  50           HB       VAL  50  -5.407 -14.198  -3.862
  397   HG11  VAL  50          HG11      VAL  50  -2.830 -12.728  -3.330
  398   HG12  VAL  50          HG12      VAL  50  -2.992 -14.291  -4.130
  399   HG13  VAL  50          HG13      VAL  50  -3.426 -14.121  -2.427
  400   HG21  VAL  50          HG21      VAL  50  -4.913 -11.486  -2.612
  401   HG22  VAL  50          HG22      VAL  50  -5.445 -12.934  -1.755
  402   HG23  VAL  50          HG23      VAL  50  -6.494 -12.187  -2.958
  403    H    ARG  51           HN       ARG  51  -6.936 -11.262  -4.536
  404    HA   ARG  51           HA       ARG  51  -8.694 -12.870  -6.286
  405    HB2  ARG  51           HB2      ARG  51  -9.365 -11.263  -3.832
  406    HB3  ARG  51           HB1      ARG  51 -10.517 -12.155  -4.801
  407    HG2  ARG  51           HG2      ARG  51  -9.503 -14.241  -4.190
  408    HG3  ARG  51           HG1      ARG  51  -8.196 -13.411  -3.345
  409    HD2  ARG  51           HD2      ARG  51  -9.904 -14.238  -1.779
  410    HD3  ARG  51           HD1      ARG  51  -9.784 -12.478  -1.761
  411    HE   ARG  51           HE       ARG  51 -11.809 -13.808  -3.386
  412   HH11  ARG  51          HH11      ARG  51 -11.059 -11.727  -0.607
  413   HH12  ARG  51          HH12      ARG  51 -12.618 -11.065  -0.489
  414   HH21  ARG  51          HH21      ARG  51 -14.014 -12.931  -3.167
  415   HH22  ARG  51          HH22      ARG  51 -14.333 -11.805  -1.920
  416    H    TYR  52           HN       TYR  52  -8.493  -9.620  -4.998
  417    HA   TYR  52           HA       TYR  52  -9.152  -8.405  -7.551
  418    HB2  TYR  52           HB2      TYR  52 -10.944  -7.983  -5.123
  419    HB3  TYR  52           HB1      TYR  52 -11.025  -7.070  -6.614
  420    HD1  TYR  52           HD1      TYR  52 -11.777  -8.295  -8.715
  421    HD2  TYR  52           HD2      TYR  52 -12.148  -9.960  -4.815
  422    HE1  TYR  52           HE1      TYR  52 -13.474  -9.860  -9.548
  423    HE2  TYR  52           HE2      TYR  52 -13.839 -11.533  -5.640
  424    HH   TYR  52           HH       TYR  52 -15.449 -11.613  -7.487
  425    H    ASP  53           HN       ASP  53  -8.981  -8.151  -4.114
  426    HA   ASP  53           HA       ASP  53  -7.928  -6.958  -2.676
  427    HB2  ASP  53           HB2      ASP  53  -5.952  -6.657  -4.907
  428    HB3  ASP  53           HB1      ASP  53  -5.666  -5.928  -3.322
  429    H    GLU  54           HN       GLU  54  -6.565  -4.413  -2.786
  430    HA   GLU  54           HA       GLU  54  -9.015  -2.934  -3.343
  431    HB2  GLU  54           HB2      GLU  54  -8.892  -3.713  -0.950
  432    HB3  GLU  54           HB1      GLU  54  -7.450  -2.744  -0.760
  433    HG2  GLU  54           HG2      GLU  54  -8.678  -0.724  -1.036
  434    HG3  GLU  54           HG1      GLU  54 -10.121  -1.612  -1.534
  435    H    TRP  55           HN       TRP  55  -8.878  -0.839  -3.708
  436    HA   TRP  55           HA       TRP  55  -6.306   0.033  -4.761
  437    HB2  TRP  55           HB2      TRP  55  -9.114   0.908  -5.300
  438    HB3  TRP  55           HB1      TRP  55  -7.693   1.636  -6.034
  439    HD1  TRP  55           HD1      TRP  55  -9.684  -1.657  -6.050
  440    HE1  TRP  55           HE1      TRP  55  -9.097  -2.949  -8.189
  441    HE3  TRP  55           HE3      TRP  55  -5.936   1.338  -7.810
  442    HZ2  TRP  55           HZ2      TRP  55  -7.273  -2.740 -10.343
  443    HZ3  TRP  55           HZ3      TRP  55  -4.812   0.718  -9.897
  444    HH2  TRP  55           HH2      TRP  55  -5.466  -1.278 -11.146
  445    H    VAL  56           HN       VAL  56  -5.302   1.544  -3.789
  446    HA   VAL  56           HA       VAL  56  -6.785   3.356  -2.040
  447    HB   VAL  56           HB       VAL  56  -4.872   3.406  -0.494
  448   HG11  VAL  56          HG11      VAL  56  -5.033   1.049   0.362
  449   HG12  VAL  56          HG12      VAL  56  -5.948   0.657  -1.091
  450   HG13  VAL  56          HG13      VAL  56  -6.582   1.837   0.054
  451   HG21  VAL  56          HG21      VAL  56  -3.000   1.832  -0.705
  452   HG22  VAL  56          HG22      VAL  56  -3.085   2.901  -2.101
  453   HG23  VAL  56          HG23      VAL  56  -3.665   1.240  -2.231
  454    H    LYS  57           HN       LYS  57  -6.120   5.479  -2.087
  455    HA   LYS  57           HA       LYS  57  -4.818   6.294  -4.527
  456    HB2  LYS  57           HB2      LYS  57  -6.837   7.396  -3.545
  457    HB3  LYS  57           HB1      LYS  57  -5.860   7.897  -2.181
  458    HG2  LYS  57           HG2      LYS  57  -4.494   9.253  -3.681
  459    HG3  LYS  57           HG1      LYS  57  -5.516   8.784  -5.043
  460    HD2  LYS  57           HD2      LYS  57  -7.469   9.755  -3.890
  461    HD3  LYS  57           HD1      LYS  57  -6.442  10.215  -2.537
  462    HE2  LYS  57           HE2      LYS  57  -5.160  11.675  -4.044
  463    HE3  LYS  57           HE1      LYS  57  -6.238  11.231  -5.368
  464    HZ1  LYS  57           HZ1      LYS  57  -8.085  12.182  -4.091
  465    HZ2  LYS  57           HZ2      LYS  57  -6.902  13.331  -4.413
  466    HZ3  LYS  57           HZ3      LYS  57  -7.012  12.645  -2.876
  467    H    ALA  58           HN       ALA  58  -2.927   7.775  -4.491
  468    HA   ALA  58           HA       ALA  58  -0.789   6.846  -2.942
  469    HB1  ALA  58           HB1      ALA  58   0.525   8.596  -3.880
  470    HB2  ALA  58           HB2      ALA  58  -0.886   9.600  -4.122
  471    HB3  ALA  58           HB3      ALA  58  -0.666   8.164  -5.120
  472    H    ASP  59           HN       ASP  59  -2.971   9.447  -2.404
  473    HA   ASP  59           HA       ASP  59  -1.843  10.811  -0.211
  474    HB2  ASP  59           HB2      ASP  59  -3.707  11.721  -1.420
  475    HB3  ASP  59           HB1      ASP  59  -4.697  10.319  -1.062
  476    H    ARG  60           HN       ARG  60  -3.342   7.730  -0.424
  477    HA   ARG  60           HA       ARG  60  -4.173   7.585   2.352
  478    HB2  ARG  60           HB2      ARG  60  -5.102   6.569  -0.032
  479    HB3  ARG  60           HB1      ARG  60  -4.305   5.189   0.697
  480    HG2  ARG  60           HG2      ARG  60  -6.708   5.298   1.196
  481    HG3  ARG  60           HG1      ARG  60  -5.701   5.365   2.642
  482    HD2  ARG  60           HD2      ARG  60  -6.026   7.597   2.959
  483    HD3  ARG  60           HD1      ARG  60  -6.580   7.895   1.296
  484    HE   ARG  60           HE       ARG  60  -8.369   6.200   2.482
  485   HH11  ARG  60          HH11      ARG  60  -7.053   9.386   3.179
  486   HH12  ARG  60          HH12      ARG  60  -8.488  10.054   3.789
  487   HH21  ARG  60          HH21      ARG  60 -10.471   7.148   3.269
  488   HH22  ARG  60          HH22      ARG  60 -10.472   8.722   3.875
  489    H    ILE  61           HN       ILE  61  -1.302   7.146   0.724
  490    HA   ILE  61           HA       ILE  61  -0.640   4.706   2.180
  491    HB   ILE  61           HB       ILE  61   0.667   5.894  -0.278
  492   HG12  ILE  61          HG12      ILE  61  -1.266   3.595   0.037
  493   HG13  ILE  61          HG11      ILE  61  -1.554   5.109  -0.805
  494   HG21  ILE  61          HG21      ILE  61   2.196   4.566   1.093
  495   HG22  ILE  61          HG22      ILE  61   1.817   3.759  -0.437
  496   HG23  ILE  61          HG23      ILE  61   1.035   3.231   1.056
  497   HD11  ILE  61          HD11      ILE  61   0.154   4.509  -2.452
  498   HD12  ILE  61          HD12      ILE  61  -1.136   3.306  -2.356
  499   HD13  ILE  61          HD13      ILE  61   0.415   2.990  -1.589
  500    H    ILE  62           HN       ILE  62   1.185   4.570   3.337
  501    HA   ILE  62           HA       ILE  62   2.673   7.006   4.002
  502    HB   ILE  62           HB       ILE  62   2.429   4.340   5.467
  503   HG12  ILE  62          HG12      ILE  62   1.463   5.551   7.337
  504   HG13  ILE  62          HG11      ILE  62   1.465   7.068   6.441
  505   HG21  ILE  62          HG21      ILE  62   4.658   5.182   5.747
  506   HG22  ILE  62          HG22      ILE  62   3.783   5.330   7.269
  507   HG23  ILE  62          HG23      ILE  62   4.041   6.754   6.258
  508   HD11  ILE  62          HD11      ILE  62  -0.195   6.021   4.901
  509   HD12  ILE  62          HD12      ILE  62  -0.753   6.134   6.570
  510   HD13  ILE  62          HD13      ILE  62  -0.186   4.590   5.931
  511    H    TRP  63           HN       TRP  63   4.428   7.052   2.732
  512    HA   TRP  63           HA       TRP  63   5.683   4.579   1.873
  513    HB2  TRP  63           HB2      TRP  63   6.117   7.453   1.043
  514    HB3  TRP  63           HB1      TRP  63   7.046   6.093   0.423
  515    HD1  TRP  63           HD1      TRP  63   3.687   7.810   0.105
  516    HE1  TRP  63           HE1      TRP  63   2.397   6.766  -1.844
  517    HE3  TRP  63           HE3      TRP  63   6.774   3.873  -0.853
  518    HZ2  TRP  63           HZ2      TRP  63   2.656   4.532  -3.562
  519    HZ3  TRP  63           HZ3      TRP  63   6.185   2.318  -2.673
  520    HH2  TRP  63           HH2      TRP  63   4.173   2.635  -3.988
  521    HA   PRO  64           HA       PRO  64   8.770   5.404   5.044
  522    HB2  PRO  64           HB2      PRO  64  10.181   3.111   3.850
  523    HB3  PRO  64           HB1      PRO  64   9.574   3.293   5.500
  524    HG2  PRO  64           HG2      PRO  64   8.416   1.584   3.784
  525    HG3  PRO  64           HG1      PRO  64   7.478   2.532   4.963
  526    HD2  PRO  64           HD2      PRO  64   7.881   3.060   2.033
  527    HD3  PRO  64           HD1      PRO  64   6.386   3.113   3.003
  528    H    LEU  65           HN       LEU  65  10.047   6.936   4.693
  529    HA   LEU  65           HA       LEU  65  12.258   7.172   3.042
  530    HB2  LEU  65           HB2      LEU  65  10.307   6.944   1.329
  531    HB3  LEU  65           HB1      LEU  65   9.814   8.518   1.889
  532    HG   LEU  65           HG       LEU  65  12.446   7.920   0.535
  533   HD11  LEU  65          HD11      LEU  65  10.538   7.510  -0.893
  534   HD12  LEU  65          HD12      LEU  65  11.403   8.968  -1.410
  535   HD13  LEU  65          HD13      LEU  65   9.888   9.101  -0.506
  536   HD21  LEU  65          HD21      LEU  65  12.554  10.356   0.258
  537   HD22  LEU  65          HD22      LEU  65  12.490   9.890   1.966
  538   HD23  LEU  65          HD23      LEU  65  11.045  10.508   1.174
  539    H    ASP  66           HN       ASP  66  12.909   8.122   4.940
  540    HA   ASP  66           HA       ASP  66  13.356   9.821   6.409
  541    HB2  ASP  66           HB2      ASP  66  12.419  11.250   3.980
  542    HB3  ASP  66           HB1      ASP  66  12.909  12.184   5.406
  543    H    LYS  67           HN       LYS  67  10.810   8.606   6.738
  544    HA   LYS  67           HA       LYS  67   8.900  10.665   7.226
  545    HB2  LYS  67           HB2      LYS  67   8.171   8.416   6.572
  546    HB3  LYS  67           HB1      LYS  67   8.889   7.747   8.017
  547    HG2  LYS  67           HG2      LYS  67   6.557   7.769   8.385
  548    HG3  LYS  67           HG1      LYS  67   7.208   9.081   9.349
  549    HD2  LYS  67           HD2      LYS  67   6.049   9.562   6.600
  550    HD3  LYS  67           HD1      LYS  67   5.021   9.469   8.020
  551    HE2  LYS  67           HE2      LYS  67   6.233  11.366   9.012
  552    HE3  LYS  67           HE1      LYS  67   7.273  11.463   7.598
  553    HZ1  LYS  67           HZ1      LYS  67   5.321  11.930   6.252
  554    HZ2  LYS  67           HZ2      LYS  67   5.487  13.068   7.486
  555    HZ3  LYS  67           HZ3      LYS  67   4.339  11.861   7.623
  556    H    GLY  68           HN       GLY  68  10.512   8.344   9.337
  557    HA2  GLY  68           HA2      GLY  68  11.414   8.562  11.448
  558    HA3  GLY  68           HA1      GLY  68  11.127  10.297  11.339
  559    H    LEU  69           HN       LEU  69   8.911  10.966  11.532
  560    HA   LEU  69           HA       LEU  69   7.545   9.327  13.434
  561    HB2  LEU  69           HB2      LEU  69   6.493  11.644  14.198
  562    HB3  LEU  69           HB1      LEU  69   7.980  11.025  14.853
  563    HG   LEU  69           HG       LEU  69   8.004  13.460  14.469
  564   HD11  LEU  69          HD11      LEU  69  10.087  12.402  14.584
  565   HD12  LEU  69          HD12      LEU  69  10.182  13.578  13.258
  566   HD13  LEU  69          HD13      LEU  69   9.966  11.850  12.924
  567   HD21  LEU  69          HD21      LEU  69   8.225  14.361  12.179
  568   HD22  LEU  69          HD22      LEU  69   6.642  13.645  12.475
  569   HD23  LEU  69          HD23      LEU  69   7.842  12.758  11.542
  570    H    GLU  70           HN       GLU  70   5.626   8.599  12.873
  571    HA   GLU  70           HA       GLU  70   4.442   9.571  10.408
  572    HB2  GLU  70           HB2      GLU  70   3.575   7.408  12.308
  573    HB3  GLU  70           HB1      GLU  70   2.761   7.801  10.810
  574    HG2  GLU  70           HG2      GLU  70   4.771   7.185   9.573
  575    HG3  GLU  70           HG1      GLU  70   5.556   6.756  11.100
  576    H    HIS  71           HN       HIS  71   3.334   9.025  13.686
  577    HA   HIS  71           HA       HIS  71   1.120  10.806  13.141
  578    HB2  HIS  71           HB2      HIS  71   1.419   8.870  15.460
  579    HB3  HIS  71           HB1      HIS  71  -0.025   9.788  15.048
  580    HD1  HIS  71           HD1      HIS  71   1.225   6.491  14.742
  581    HD2  HIS  71           HD2      HIS  71  -0.776   9.050  12.155
  582    HE1  HIS  71           HE1      HIS  71   0.317   5.040  12.932
  583    HE2  HIS  71           HE2      HIS  71  -0.448   6.685  11.229
  584    H    HIS  72           HN       HIS  72   2.566  12.560  13.278
  585    HA   HIS  72           HA       HIS  72   3.561  13.145  15.957
  586    HB2  HIS  72           HB2      HIS  72   5.097  13.426  13.989
  587    HB3  HIS  72           HB1      HIS  72   4.036  14.690  13.393
  588    HD1  HIS  72           HD1      HIS  72   6.668  14.000  15.966
  589    HD2  HIS  72           HD2      HIS  72   4.247  17.167  14.801
  590    HE1  HIS  72           HE1      HIS  72   7.595  15.996  17.108
  591    HE2  HIS  72           HE2      HIS  72   6.283  17.921  16.208
  592    H    HIS  73           HN       HIS  73   1.122  14.069  13.675
  593    HA   HIS  73           HA       HIS  73   0.607  16.484  15.123
  594    HB2  HIS  73           HB2      HIS  73  -1.183  17.000  13.546
  595    HB3  HIS  73           HB1      HIS  73   0.267  16.549  12.684
  596    HD1  HIS  73           HD1      HIS  73  -0.050  14.797  10.865
  597    HD2  HIS  73           HD2      HIS  73  -3.278  14.966  13.476
  598    HE1  HIS  73           HE1      HIS  73  -1.878  13.445   9.800
  599    HE2  HIS  73           HE2      HIS  73  -3.863  13.793  11.275
  600    H    HIS  74           HN       HIS  74  -0.263  16.477  16.969
  601    HA   HIS  74           HA       HIS  74  -2.429  14.560  17.485
  602    HB2  HIS  74           HB2      HIS  74  -0.752  16.129  19.459
  603    HB3  HIS  74           HB1      HIS  74  -2.075  15.058  19.902
  604    HD1  HIS  74           HD1      HIS  74   1.489  15.043  19.501
  605    HD2  HIS  74           HD2      HIS  74  -1.559  12.291  18.909
  606    HE1  HIS  74           HE1      HIS  74   2.616  12.805  19.342
  607    HE2  HIS  74           HE2      HIS  74   0.778  11.214  18.747
  608    H    HIS  75           HN       HIS  75  -2.052  17.411  16.346
  609    HA   HIS  75           HA       HIS  75  -4.041  18.930  17.743
  610    HB2  HIS  75           HB2      HIS  75  -2.205  20.055  16.512
  611    HB3  HIS  75           HB1      HIS  75  -2.765  19.332  15.015
  612    HD1  HIS  75           HD1      HIS  75  -3.612  22.034  17.488
  613    HD2  HIS  75           HD2      HIS  75  -4.917  20.632  13.806
  614    HE1  HIS  75           HE1      HIS  75  -5.166  23.792  16.608
  615    HE2  HIS  75           HE2      HIS  75  -6.159  22.749  14.542
  616    H    HIS  76           HN       HIS  76  -5.953  18.000  17.755
  617    HA   HIS  76           HA       HIS  76  -7.630  17.943  15.551
  618    HB2  HIS  76           HB2      HIS  76  -6.425  15.860  14.920
  619    HB3  HIS  76           HB1      HIS  76  -6.742  15.192  16.517
  620    HD1  HIS  76           HD1      HIS  76  -8.748  13.734  16.642
  621    HD2  HIS  76           HD2      HIS  76  -8.996  16.410  13.481
  622    HE1  HIS  76           HE1      HIS  76 -10.850  13.142  15.432
  623    HE2  HIS  76           HE2      HIS  76 -11.149  15.082  13.885
  Start of MODEL    7
    1    H1   GLU   1           HT1      GLU   1   1.507   1.561 -23.024
    2    H2   GLU   1           HT2      GLU   1   2.786   2.694 -23.045
    3    H3   GLU   1           HT3      GLU   1   1.266   3.108 -22.434
    4    HA   GLU   1           HA       GLU   1   2.917   1.030 -21.245
    5    HB2  GLU   1           HB2      GLU   1   2.787   3.975 -20.737
    6    HB3  GLU   1           HB1      GLU   1   3.042   2.885 -19.388
    7    HG2  GLU   1           HG2      GLU   1   5.107   3.890 -20.414
    8    HG3  GLU   1           HG1      GLU   1   5.102   2.143 -20.232
    9    H    ASP   2           HN       ASP   2   1.349  -0.322 -20.660
   10    HA   ASP   2           HA       ASP   2  -1.087   0.598 -19.405
   11    HB2  ASP   2           HB2      ASP   2  -0.992  -1.559 -20.687
   12    HB3  ASP   2           HB1      ASP   2   0.118  -2.198 -19.487
   13    H    MET   3           HN       MET   3   1.640  -1.408 -18.421
   14    HA   MET   3           HA       MET   3   2.753  -0.076 -16.412
   15    HB2  MET   3           HB2      MET   3   0.581  -0.124 -15.141
   16    HB3  MET   3           HB1      MET   3   0.651  -1.882 -15.180
   17    HG2  MET   3           HG2      MET   3   2.806  -1.796 -13.976
   18    HG3  MET   3           HG1      MET   3   2.640  -0.051 -13.863
   19    HE1  MET   3           HE1      MET   3   3.210  -1.904 -11.394
   20    HE2  MET   3           HE2      MET   3   2.140  -1.142 -10.208
   21    HE3  MET   3           HE3      MET   3   3.044  -0.153 -11.351
   22    H    GLU   4           HN       GLU   4   4.516  -1.120 -16.006
   23    HA   GLU   4           HA       GLU   4   4.586  -4.033 -16.212
   24    HB2  GLU   4           HB2      GLU   4   6.724  -1.920 -16.670
   25    HB3  GLU   4           HB1      GLU   4   7.026  -3.657 -16.705
   26    HG2  GLU   4           HG2      GLU   4   5.710  -3.962 -18.623
   27    HG3  GLU   4           HG1      GLU   4   4.990  -2.364 -18.479
   28    HA   PRO   5           HA       PRO   5   5.431  -4.299 -11.885
   29    HB2  PRO   5           HB2      PRO   5   8.151  -5.379 -12.469
   30    HB3  PRO   5           HB1      PRO   5   6.895  -6.016 -11.393
   31    HG2  PRO   5           HG2      PRO   5   7.306  -7.142 -13.763
   32    HG3  PRO   5           HG1      PRO   5   5.658  -6.905 -13.153
   33    HD2  PRO   5           HD2      PRO   5   7.138  -5.372 -15.247
   34    HD3  PRO   5           HD1      PRO   5   5.421  -5.802 -15.161
   35    H    CYS   6           HN       CYS   6   5.579  -2.214 -11.247
   36    HA   CYS   6           HA       CYS   6   8.207  -1.197 -10.621
   37    HB2  CYS   6           HB2      CYS   6   7.361  -0.190 -12.827
   38    HB3  CYS   6           HB1      CYS   6   6.039   0.503 -11.904
   39    HG   CYS   6           HG       CYS   6   8.138   2.306 -12.619
   40    H    LEU   7           HN       LEU   7   8.120  -0.270  -8.615
   41    HA   LEU   7           HA       LEU   7   7.437   0.141  -6.523
   42    HB2  LEU   7           HB2      LEU   7   4.673   0.581  -7.710
   43    HB3  LEU   7           HB1      LEU   7   5.039   0.797  -6.020
   44    HG   LEU   7           HG       LEU   7   4.948   2.936  -6.876
   45   HD11  LEU   7          HD11      LEU   7   7.859   2.261  -6.845
   46   HD12  LEU   7          HD12      LEU   7   6.842   2.692  -5.472
   47   HD13  LEU   7          HD13      LEU   7   7.168   3.879  -6.732
   48   HD21  LEU   7          HD21      LEU   7   4.901   2.490  -9.237
   49   HD22  LEU   7          HD22      LEU   7   6.616   2.065  -9.230
   50   HD23  LEU   7          HD23      LEU   7   6.113   3.725  -8.904
   51    H    THR   8           HN       THR   8   6.354  -2.409  -8.281
   52    HA   THR   8           HA       THR   8   4.606  -3.738  -6.589
   53    HB   THR   8           HB       THR   8   5.425  -5.741  -7.986
   54    HG1  THR   8           HG1      THR   8   7.433  -4.796  -8.571
   55   HG21  THR   8          HG21      THR   8   4.207  -4.929  -9.962
   56   HG22  THR   8          HG22      THR   8   4.332  -3.277  -9.361
   57   HG23  THR   8          HG23      THR   8   3.377  -4.465  -8.478
   58    H    GLY   9           HN       GLY   9   4.894  -4.975  -4.885
   59    HA2  GLY   9           HA2      GLY   9   6.022  -6.505  -3.501
   60    HA3  GLY   9           HA1      GLY   9   7.527  -6.099  -4.313
   61    H    THR  10           HN       THR  10   6.451  -3.167  -3.852
   62    HA   THR  10           HA       THR  10   8.024  -2.744  -1.532
   63    HB   THR  10           HB       THR  10   6.083  -0.806  -2.782
   64    HG1  THR  10           HG1      THR  10   7.449  -1.245  -4.408
   65   HG21  THR  10          HG21      THR  10   6.922  -0.124  -0.589
   66   HG22  THR  10          HG22      THR  10   7.616   0.904  -1.846
   67   HG23  THR  10          HG23      THR  10   8.581  -0.381  -1.126
   68    H    LYS  11           HN       LYS  11   7.438  -2.916   0.404
   69    HA   LYS  11           HA       LYS  11   4.671  -3.474   1.082
   70    HB2  LYS  11           HB2      LYS  11   7.162  -3.677   2.791
   71    HB3  LYS  11           HB1      LYS  11   5.570  -4.353   3.138
   72    HG2  LYS  11           HG2      LYS  11   5.734  -5.889   1.317
   73    HG3  LYS  11           HG1      LYS  11   7.219  -5.139   0.749
   74    HD2  LYS  11           HD2      LYS  11   7.762  -7.180   1.863
   75    HD3  LYS  11           HD1      LYS  11   8.313  -5.846   2.863
   76    HE2  LYS  11           HE2      LYS  11   6.405  -6.079   4.309
   77    HE3  LYS  11           HE1      LYS  11   5.728  -7.328   3.267
   78    HZ1  LYS  11           HZ1      LYS  11   7.623  -8.738   3.794
   79    HZ2  LYS  11           HZ2      LYS  11   6.841  -8.263   5.198
   80    HZ3  LYS  11           HZ3      LYS  11   8.288  -7.530   4.768
   81    H    VAL  12           HN       VAL  12   3.544  -1.754   1.505
   82    HA   VAL  12           HA       VAL  12   4.841   0.523   2.817
   83    HB   VAL  12           HB       VAL  12   3.146   1.945   1.745
   84   HG11  VAL  12          HG11      VAL  12   5.296   1.629   0.649
   85   HG12  VAL  12          HG12      VAL  12   4.008   1.822  -0.539
   86   HG13  VAL  12          HG13      VAL  12   4.666   0.221  -0.204
   87   HG21  VAL  12          HG21      VAL  12   1.697   1.061  -0.016
   88   HG22  VAL  12          HG22      VAL  12   1.370   0.267   1.526
   89   HG23  VAL  12          HG23      VAL  12   2.307  -0.566   0.289
   90    H    LYS  13           HN       LYS  13   3.022   1.961   3.748
   91    HA   LYS  13           HA       LYS  13   1.325   0.306   5.455
   92    HB2  LYS  13           HB2      LYS  13   3.156   2.410   5.950
   93    HB3  LYS  13           HB1      LYS  13   1.548   3.053   6.219
   94    HG2  LYS  13           HG2      LYS  13   2.617   0.568   7.458
   95    HG3  LYS  13           HG1      LYS  13   2.613   2.165   8.259
   96    HD2  LYS  13           HD2      LYS  13   0.072   2.029   7.756
   97    HD3  LYS  13           HD1      LYS  13   0.374   0.300   7.552
   98    HE2  LYS  13           HE2      LYS  13   0.827   2.005   9.972
   99    HE3  LYS  13           HE1      LYS  13  -0.276   0.649   9.813
  100    HZ1  LYS  13           HZ1      LYS  13   1.657   0.003  11.056
  101    HZ2  LYS  13           HZ2      LYS  13   2.693   0.477   9.831
  102    HZ3  LYS  13           HZ3      LYS  13   1.648  -0.840   9.610
  103    H    VAL  14           HN       VAL  14  -0.884   0.879   5.466
  104    HA   VAL  14           HA       VAL  14  -1.659   2.938   3.563
  105    HB   VAL  14           HB       VAL  14  -2.853   0.158   3.852
  106   HG11  VAL  14          HG11      VAL  14  -4.574   1.902   3.528
  107   HG12  VAL  14          HG12      VAL  14  -4.458   0.761   2.199
  108   HG13  VAL  14          HG13      VAL  14  -3.766   2.382   2.026
  109   HG21  VAL  14          HG21      VAL  14  -2.240  -0.132   1.507
  110   HG22  VAL  14          HG22      VAL  14  -0.818   0.214   2.488
  111   HG23  VAL  14          HG23      VAL  14  -1.518   1.474   1.473
  112    H    LYS  15           HN       LYS  15  -3.109   4.241   4.306
  113    HA   LYS  15           HA       LYS  15  -4.469   3.695   6.852
  114    HB2  LYS  15           HB2      LYS  15  -2.611   5.214   7.128
  115    HB3  LYS  15           HB1      LYS  15  -3.146   6.199   5.769
  116    HG2  LYS  15           HG2      LYS  15  -4.995   6.985   7.094
  117    HG3  LYS  15           HG1      LYS  15  -4.566   5.892   8.416
  118    HD2  LYS  15           HD2      LYS  15  -2.364   6.975   8.589
  119    HD3  LYS  15           HD1      LYS  15  -2.809   8.072   7.291
  120    HE2  LYS  15           HE2      LYS  15  -4.537   9.048   8.656
  121    HE3  LYS  15           HE1      LYS  15  -4.236   7.863   9.932
  122    HZ1  LYS  15           HZ1      LYS  15  -2.269   9.876   8.975
  123    HZ2  LYS  15           HZ2      LYS  15  -2.048   8.775  10.238
  124    HZ3  LYS  15           HZ3      LYS  15  -3.172   9.997  10.389
  125    H    TYR  16           HN       TYR  16  -6.521   3.370   6.212
  126    HA   TYR  16           HA       TYR  16  -7.704   5.027   4.120
  127    HB2  TYR  16           HB2      TYR  16  -6.493   2.832   3.372
  128    HB3  TYR  16           HB1      TYR  16  -7.836   2.020   4.139
  129    HD1  TYR  16           HD1      TYR  16  -7.267   4.757   1.692
  130    HD2  TYR  16           HD2      TYR  16  -9.472   1.308   2.724
  131    HE1  TYR  16           HE1      TYR  16  -8.409   4.853  -0.502
  132    HE2  TYR  16           HE2      TYR  16 -10.643   1.399   0.527
  133    HH   TYR  16           HH       TYR  16  -9.521   3.134  -1.992
  134    H    GLY  17           HN       GLY  17  -9.353   5.836   5.468
  135    HA2  GLY  17           HA2      GLY  17 -11.397   4.167   6.297
  136    HA3  GLY  17           HA1      GLY  17 -10.344   4.443   7.671
  137    H    ARG  18           HN       ARG  18 -12.803   5.233   7.994
  138    HA   ARG  18           HA       ARG  18 -12.728   8.131   7.605
  139    HB2  ARG  18           HB2      ARG  18 -15.253   8.137   7.734
  140    HB3  ARG  18           HB1      ARG  18 -14.590   7.424   6.279
  141    HG2  ARG  18           HG2      ARG  18 -15.275   5.589   8.532
  142    HG3  ARG  18           HG1      ARG  18 -16.599   6.301   7.604
  143    HD2  ARG  18           HD2      ARG  18 -14.268   4.851   6.395
  144    HD3  ARG  18           HD1      ARG  18 -15.789   4.055   6.831
  145    HE   ARG  18           HE       ARG  18 -16.455   6.204   5.265
  146   HH11  ARG  18          HH11      ARG  18 -14.406   3.357   4.792
  147   HH12  ARG  18          HH12      ARG  18 -14.814   3.150   3.162
  148   HH21  ARG  18          HH21      ARG  18 -17.037   5.927   3.024
  149   HH22  ARG  18          HH22      ARG  18 -16.350   4.677   2.113
  150    H    GLY  19           HN       GLY  19 -12.084   8.998   9.438
  151    HA2  GLY  19           HA2      GLY  19 -12.118   9.717  11.587
  152    HA3  GLY  19           HA1      GLY  19 -13.766   9.128  11.661
  153    H    LYS  20           HN       LYS  20 -14.162   7.627  13.048
  154    HA   LYS  20           HA       LYS  20 -12.092   6.407  14.616
  155    HB2  LYS  20           HB2      LYS  20 -14.241   7.146  15.576
  156    HB3  LYS  20           HB1      LYS  20 -15.068   5.983  14.562
  157    HG2  LYS  20           HG2      LYS  20 -14.015   4.146  15.747
  158    HG3  LYS  20           HG1      LYS  20 -13.106   5.289  16.735
  159    HD2  LYS  20           HD2      LYS  20 -15.065   4.426  17.923
  160    HD3  LYS  20           HD1      LYS  20 -15.181   6.165  17.662
  161    HE2  LYS  20           HE2      LYS  20 -16.667   5.787  15.754
  162    HE3  LYS  20           HE1      LYS  20 -16.530   4.045  15.979
  163    HZ1  LYS  20           HZ1      LYS  20 -18.550   4.863  16.932
  164    HZ2  LYS  20           HZ2      LYS  20 -17.730   6.009  17.842
  165    HZ3  LYS  20           HZ3      LYS  20 -17.543   4.375  18.194
  166    H    THR  21           HN       THR  21 -14.149   5.507  11.992
  167    HA   THR  21           HA       THR  21 -13.431   2.706  12.106
  168    HB   THR  21           HB       THR  21 -15.064   4.305  10.098
  169    HG1  THR  21           HG1      THR  21 -15.678   2.938  12.495
  170   HG21  THR  21          HG21      THR  21 -14.235   2.136   9.225
  171   HG22  THR  21          HG22      THR  21 -15.982   2.184   9.386
  172   HG23  THR  21          HG23      THR  21 -15.010   1.302  10.580
  173    H    GLN  22           HN       GLN  22 -11.258   3.750  12.079
  174    HA   GLN  22           HA       GLN  22 -10.140   4.511   9.498
  175    HB2  GLN  22           HB2      GLN  22  -9.804   5.933  11.435
  176    HB3  GLN  22           HB1      GLN  22  -9.129   4.592  12.337
  177    HG2  GLN  22           HG2      GLN  22  -7.359   6.023  11.666
  178    HG3  GLN  22           HG1      GLN  22  -7.252   4.544  10.718
  179   HE21  GLN  22          HE21      GLN  22  -6.318   7.306  10.300
  180   HE22  GLN  22          HE22      GLN  22  -6.890   7.725   8.707
  181    H    LYS  23           HN       LYS  23  -8.937   2.911   8.379
  182    HA   LYS  23           HA       LYS  23  -7.932   0.754  10.075
  183    HB2  LYS  23           HB2      LYS  23  -8.662   0.562   7.154
  184    HB3  LYS  23           HB1      LYS  23  -7.945  -0.723   8.099
  185    HG2  LYS  23           HG2      LYS  23 -10.039  -1.440   8.404
  186    HG3  LYS  23           HG1      LYS  23 -10.182  -0.112   9.550
  187    HD2  LYS  23           HD2      LYS  23 -12.062  -0.051   8.031
  188    HD3  LYS  23           HD1      LYS  23 -11.008   1.330   7.712
  189    HE2  LYS  23           HE2      LYS  23 -10.061   0.226   5.774
  190    HE3  LYS  23           HE1      LYS  23 -10.929  -1.257   6.150
  191    HZ1  LYS  23           HZ1      LYS  23 -12.999  -0.052   5.747
  192    HZ2  LYS  23           HZ2      LYS  23 -11.995  -0.076   4.399
  193    HZ3  LYS  23           HZ3      LYS  23 -12.122   1.329   5.309
  194    H    ILE  24           HN       ILE  24  -5.863   1.079  10.422
  195    HA   ILE  24           HA       ILE  24  -4.270   1.933   8.133
  196    HB   ILE  24           HB       ILE  24  -3.349   1.839  11.021
  197   HG12  ILE  24          HG12      ILE  24  -4.356   4.273   9.559
  198   HG13  ILE  24          HG11      ILE  24  -5.395   3.323  10.618
  199   HG21  ILE  24          HG21      ILE  24  -1.620   3.360  10.176
  200   HG22  ILE  24          HG22      ILE  24  -2.443   3.445   8.619
  201   HG23  ILE  24          HG23      ILE  24  -1.691   1.948   9.108
  202   HD11  ILE  24          HD11      ILE  24  -2.856   4.726  11.428
  203   HD12  ILE  24          HD12      ILE  24  -3.915   3.759  12.464
  204   HD13  ILE  24          HD13      ILE  24  -4.508   5.268  11.765
  205    H    TYR  25           HN       TYR  25  -3.601   0.248   7.125
  206    HA   TYR  25           HA       TYR  25  -2.565  -2.028   8.585
  207    HB2  TYR  25           HB2      TYR  25  -3.570  -3.412   6.507
  208    HB3  TYR  25           HB1      TYR  25  -4.432  -3.172   8.006
  209    HD1  TYR  25           HD1      TYR  25  -4.240  -0.417   5.457
  210    HD2  TYR  25           HD2      TYR  25  -6.541  -3.667   6.986
  211    HE1  TYR  25           HE1      TYR  25  -6.225   0.356   4.162
  212    HE2  TYR  25           HE2      TYR  25  -8.488  -2.901   5.709
  213    HH   TYR  25           HH       TYR  25  -8.376  -0.805   3.201
  214    H    GLU  26           HN       GLU  26  -1.234  -3.556   7.074
  215    HA   GLU  26           HA       GLU  26   0.461  -1.715   5.555
  216    HB2  GLU  26           HB2      GLU  26   1.137  -4.290   6.972
  217    HB3  GLU  26           HB1      GLU  26   2.264  -3.377   5.984
  218    HG2  GLU  26           HG2      GLU  26   2.021  -1.469   7.479
  219    HG3  GLU  26           HG1      GLU  26   0.908  -2.402   8.475
  220    H    ALA  27           HN       ALA  27   0.956  -2.229   3.444
  221    HA   ALA  27           HA       ALA  27  -0.096  -4.739   2.348
  222    HB1  ALA  27           HB1      ALA  27  -1.841  -3.042   2.100
  223    HB2  ALA  27           HB2      ALA  27  -1.201  -3.582   0.550
  224    HB3  ALA  27           HB3      ALA  27  -0.706  -2.021   1.216
  225    H    SER  28           HN       SER  28   0.499  -4.890   0.002
  226    HA   SER  28           HA       SER  28   3.091  -3.613  -0.511
  227    HB2  SER  28           HB2      SER  28   2.191  -6.384  -1.302
  228    HB3  SER  28           HB1      SER  28   3.755  -5.653  -1.684
  229    HG   SER  28           HG       SER  28   3.048  -5.589   0.955
  230    H    ILE  29           HN       ILE  29   3.315  -2.697  -2.493
  231    HA   ILE  29           HA       ILE  29   0.946  -2.142  -3.967
  232    HB   ILE  29           HB       ILE  29   3.774  -1.686  -4.959
  233   HG12  ILE  29          HG12      ILE  29   3.669  -0.705  -2.724
  234   HG13  ILE  29          HG11      ILE  29   3.660   0.572  -3.928
  235   HG21  ILE  29          HG21      ILE  29   2.751   0.221  -6.178
  236   HG22  ILE  29          HG22      ILE  29   1.177  -0.246  -5.551
  237   HG23  ILE  29          HG23      ILE  29   2.047  -1.328  -6.633
  238   HD11  ILE  29          HD11      ILE  29   2.135   1.103  -2.163
  239   HD12  ILE  29          HD12      ILE  29   1.304  -0.439  -2.350
  240   HD13  ILE  29          HD13      ILE  29   1.206   0.771  -3.625
  241    H    LYS  30           HN       LYS  30   0.055  -3.277  -5.481
  242    HA   LYS  30           HA       LYS  30   1.511  -5.518  -6.700
  243    HB2  LYS  30           HB2      LYS  30  -0.526  -5.902  -5.216
  244    HB3  LYS  30           HB1      LYS  30  -1.474  -5.073  -6.431
  245    HG2  LYS  30           HG2      LYS  30   0.103  -7.576  -7.000
  246    HG3  LYS  30           HG1      LYS  30  -1.560  -7.585  -6.429
  247    HD2  LYS  30           HD2      LYS  30  -2.215  -6.296  -8.407
  248    HD3  LYS  30           HD1      LYS  30  -0.527  -6.322  -8.936
  249    HE2  LYS  30           HE2      LYS  30  -0.574  -8.715  -9.147
  250    HE3  LYS  30           HE1      LYS  30  -2.190  -8.769  -8.435
  251    HZ1  LYS  30           HZ1      LYS  30  -2.208  -8.974 -10.856
  252    HZ2  LYS  30           HZ2      LYS  30  -1.529  -7.450 -11.003
  253    HZ3  LYS  30           HZ3      LYS  30  -3.062  -7.626 -10.327
  254    H    SER  31           HN       SER  31  -0.662  -2.785  -7.367
  255    HA   SER  31           HA       SER  31   0.558  -2.478  -9.954
  256    HB2  SER  31           HB2      SER  31  -2.461  -2.892  -9.739
  257    HB3  SER  31           HB1      SER  31  -1.573  -2.482 -11.202
  258    HG   SER  31           HG       SER  31  -0.381  -4.572 -10.230
  259    H    THR  32           HN       THR  32  -0.261  -0.326 -10.975
  260    HA   THR  32           HA       THR  32  -1.555   1.507  -9.131
  261    HB   THR  32           HB       THR  32   0.912   2.521 -10.449
  262    HG1  THR  32           HG1      THR  32   0.811   0.618  -8.390
  263   HG21  THR  32          HG21      THR  32  -0.596   3.944  -9.202
  264   HG22  THR  32          HG22      THR  32   1.025   3.876  -8.484
  265   HG23  THR  32          HG23      THR  32  -0.290   2.966  -7.754
  266    H    GLU  33           HN       GLU  33  -2.585   3.126 -10.352
  267    HA   GLU  33           HA       GLU  33  -1.832   3.513 -13.085
  268    HB2  GLU  33           HB2      GLU  33  -3.823   2.958 -14.136
  269    HB3  GLU  33           HB1      GLU  33  -3.353   1.586 -13.096
  270    HG2  GLU  33           HG2      GLU  33  -5.072   2.050 -11.553
  271    HG3  GLU  33           HG1      GLU  33  -5.403   3.616 -12.289
  272    H    ILE  34           HN       ILE  34  -3.232   5.154 -14.114
  273    HA   ILE  34           HA       ILE  34  -3.923   7.149 -12.106
  274    HB   ILE  34           HB       ILE  34  -3.069   7.477 -14.982
  275   HG12  ILE  34          HG12      ILE  34  -1.167   8.823 -14.068
  276   HG13  ILE  34          HG11      ILE  34  -1.732   8.454 -12.450
  277   HG21  ILE  34          HG21      ILE  34  -3.935   9.620 -13.042
  278   HG22  ILE  34          HG22      ILE  34  -4.789   9.108 -14.498
  279   HG23  ILE  34          HG23      ILE  34  -3.234   9.928 -14.631
  280   HD11  ILE  34          HD11      ILE  34   0.207   7.092 -13.056
  281   HD12  ILE  34          HD12      ILE  34  -0.693   6.434 -14.442
  282   HD13  ILE  34          HD13      ILE  34  -1.245   6.119 -12.802
  283    H    ASP  35           HN       ASP  35  -5.946   7.484 -11.969
  284    HA   ASP  35           HA       ASP  35  -7.714   7.082 -14.283
  285    HB2  ASP  35           HB2      ASP  35  -7.989   5.103 -12.874
  286    HB3  ASP  35           HB1      ASP  35  -8.310   6.128 -11.479
  287    H    ASP  36           HN       ASP  36  -8.829   8.799 -14.667
  288    HA   ASP  36           HA       ASP  36  -9.996  10.722 -14.475
  289    HB2  ASP  36           HB2      ASP  36 -11.268   9.270 -12.799
  290    HB3  ASP  36           HB1      ASP  36 -10.337  10.057 -11.532
  291    H    GLY  37           HN       GLY  37  -7.128  10.499 -13.849
  292    HA2  GLY  37           HA2      GLY  37  -5.582  12.262 -13.790
  293    HA3  GLY  37           HA1      GLY  37  -6.809  13.276 -13.055
  294    H    GLU  38           HN       GLU  38  -6.656  10.318 -11.409
  295    HA   GLU  38           HA       GLU  38  -4.640  11.386  -9.579
  296    HB2  GLU  38           HB2      GLU  38  -5.936  10.511  -7.697
  297    HB3  GLU  38           HB1      GLU  38  -6.841  11.727  -8.586
  298    HG2  GLU  38           HG2      GLU  38  -8.054   9.870  -9.733
  299    HG3  GLU  38           HG1      GLU  38  -7.240   8.742  -8.655
  300    H    VAL  39           HN       VAL  39  -3.545   9.708  -8.273
  301    HA   VAL  39           HA       VAL  39  -3.255   7.334  -9.951
  302    HB   VAL  39           HB       VAL  39  -1.342   8.132  -7.763
  303   HG11  VAL  39          HG11      VAL  39  -1.149   5.823  -8.480
  304   HG12  VAL  39          HG12      VAL  39   0.261   6.702  -9.046
  305   HG13  VAL  39          HG13      VAL  39  -1.030   6.304 -10.160
  306   HG21  VAL  39          HG21      VAL  39   0.092   9.151  -9.466
  307   HG22  VAL  39          HG22      VAL  39  -1.464   9.984  -9.359
  308   HG23  VAL  39          HG23      VAL  39  -1.153   8.857 -10.679
  309    H    LEU  40           HN       LEU  40  -4.045   5.593  -9.407
  310    HA   LEU  40           HA       LEU  40  -4.787   5.123  -6.625
  311    HB2  LEU  40           HB2      LEU  40  -5.898   3.908  -9.147
  312    HB3  LEU  40           HB1      LEU  40  -6.448   3.576  -7.518
  313    HG   LEU  40           HG       LEU  40  -6.715   6.176  -9.011
  314   HD11  LEU  40          HD11      LEU  40  -8.764   4.178  -8.091
  315   HD12  LEU  40          HD12      LEU  40  -8.254   4.468  -9.753
  316   HD13  LEU  40          HD13      LEU  40  -9.108   5.728  -8.856
  317   HD21  LEU  40          HD21      LEU  40  -7.554   5.479  -6.190
  318   HD22  LEU  40          HD22      LEU  40  -7.981   6.957  -7.055
  319   HD23  LEU  40          HD23      LEU  40  -6.293   6.622  -6.666
  320    H    TYR  41           HN       TYR  41  -4.139   3.360  -5.721
  321    HA   TYR  41           HA       TYR  41  -2.126   1.738  -7.099
  322    HB2  TYR  41           HB2      TYR  41  -2.399   2.536  -4.203
  323    HB3  TYR  41           HB1      TYR  41  -1.301   1.293  -4.763
  324    HD1  TYR  41           HD2      TYR  41  -2.104   4.906  -5.358
  325    HD2  TYR  41           HD1      TYR  41   0.870   1.876  -5.242
  326    HE1  TYR  41           HE2      TYR  41  -0.352   6.609  -5.690
  327    HE2  TYR  41           HE1      TYR  41   2.618   3.563  -5.571
  328    HH   TYR  41           HH       TYR  41   2.067   6.851  -5.191
  329    H    LEU  42           HN       LEU  42  -2.292  -0.399  -6.929
  330    HA   LEU  42           HA       LEU  42  -4.649  -1.496  -5.587
  331    HB2  LEU  42           HB2      LEU  42  -4.523  -1.903  -8.024
  332    HB3  LEU  42           HB1      LEU  42  -2.914  -2.570  -7.810
  333    HG   LEU  42           HG       LEU  42  -3.838  -4.445  -6.554
  334   HD11  LEU  42          HD11      LEU  42  -6.252  -4.797  -6.446
  335   HD12  LEU  42          HD12      LEU  42  -6.515  -3.191  -7.131
  336   HD13  LEU  42          HD13      LEU  42  -5.757  -3.363  -5.549
  337   HD21  LEU  42          HD21      LEU  42  -5.023  -5.533  -8.413
  338   HD22  LEU  42          HD22      LEU  42  -3.575  -4.695  -8.943
  339   HD23  LEU  42          HD23      LEU  42  -5.163  -3.973  -9.224
  340    H    VAL  43           HN       VAL  43  -4.097  -2.307  -3.716
  341    HA   VAL  43           HA       VAL  43  -1.369  -3.352  -3.327
  342    HB   VAL  43           HB       VAL  43  -1.225  -2.225  -1.182
  343   HG11  VAL  43          HG11      VAL  43  -0.550  -0.926  -3.074
  344   HG12  VAL  43          HG12      VAL  43  -1.200   0.085  -1.782
  345   HG13  VAL  43          HG13      VAL  43  -2.176  -0.260  -3.210
  346   HG21  VAL  43          HG21      VAL  43  -2.989  -0.723  -0.342
  347   HG22  VAL  43          HG22      VAL  43  -3.580  -2.376  -0.479
  348   HG23  VAL  43          HG23      VAL  43  -4.021  -1.180  -1.696
  349    H    HIS  44           HN       HIS  44  -1.285  -5.168  -2.093
  350    HA   HIS  44           HA       HIS  44  -3.789  -5.952  -0.825
  351    HB2  HIS  44           HB2      HIS  44  -3.243  -8.389  -1.104
  352    HB3  HIS  44           HB1      HIS  44  -3.618  -7.560  -2.596
  353    HD1  HIS  44           HD1      HIS  44  -2.127  -7.943  -4.390
  354    HD2  HIS  44           HD2      HIS  44  -0.333  -8.828  -0.772
  355    HE1  HIS  44           HE1      HIS  44   0.150  -8.968  -4.972
  356    HE2  HIS  44           HE2      HIS  44   1.137  -9.599  -2.754
  357    H    TYR  45           HN       TYR  45  -3.738  -6.964   1.060
  358    HA   TYR  45           HA       TYR  45  -1.567  -5.879   2.626
  359    HB2  TYR  45           HB2      TYR  45  -4.230  -6.998   3.510
  360    HB3  TYR  45           HB1      TYR  45  -3.105  -6.040   4.478
  361    HD1  TYR  45           HD1      TYR  45  -2.822  -3.640   4.037
  362    HD2  TYR  45           HD2      TYR  45  -5.617  -5.943   1.840
  363    HE1  TYR  45           HE1      TYR  45  -3.838  -1.583   3.161
  364    HE2  TYR  45           HE2      TYR  45  -6.656  -3.899   0.980
  365    HH   TYR  45           HH       TYR  45  -6.841  -1.503   1.522
  366    H    TYR  46           HN       TYR  46  -0.536  -7.011   4.227
  367    HA   TYR  46           HA       TYR  46  -0.559  -9.859   3.731
  368    HB2  TYR  46           HB2      TYR  46   1.843  -9.794   4.724
  369    HB3  TYR  46           HB1      TYR  46   1.575  -9.309   3.063
  370    HD1  TYR  46           HD1      TYR  46   2.269  -8.039   6.475
  371    HD2  TYR  46           HD2      TYR  46   2.094  -7.130   2.333
  372    HE1  TYR  46           HE1      TYR  46   3.493  -5.937   6.879
  373    HE2  TYR  46           HE2      TYR  46   3.299  -5.038   2.730
  374    HH   TYR  46           HH       TYR  46   3.689  -3.451   4.608
  375    H    GLY  47           HN       GLY  47  -0.688 -11.292   5.248
  376    HA2  GLY  47           HA2      GLY  47  -0.533 -11.331   7.872
  377    HA3  GLY  47           HA1      GLY  47  -2.018 -10.391   7.636
  378    H    TRP  48           HN       TRP  48  -3.755 -11.640   7.767
  379    HA   TRP  48           HA       TRP  48  -3.474 -14.413   6.984
  380    HB2  TRP  48           HB2      TRP  48  -4.528 -14.107   9.135
  381    HB3  TRP  48           HB1      TRP  48  -5.700 -12.986   8.453
  382    HD1  TRP  48           HD1      TRP  48  -7.974 -14.122   8.454
  383    HE1  TRP  48           HE1      TRP  48  -8.898 -16.424   7.836
  384    HE3  TRP  48           HE3      TRP  48  -3.578 -16.497   7.298
  385    HZ2  TRP  48           HZ2      TRP  48  -7.922 -18.913   6.945
  386    HZ3  TRP  48           HZ3      TRP  48  -3.676 -18.830   6.557
  387    HH2  TRP  48           HH2      TRP  48  -5.800 -20.017   6.389
  388    H    ASN  49           HN       ASN  49  -5.454 -11.590   6.181
  389    HA   ASN  49           HA       ASN  49  -6.562 -13.127   3.961
  390    HB2  ASN  49           HB2      ASN  49  -8.072 -11.715   5.440
  391    HB3  ASN  49           HB1      ASN  49  -7.287 -10.298   4.750
  392   HD21  ASN  49          HD21      ASN  49 -10.034 -11.001   4.620
  393   HD22  ASN  49          HD22      ASN  49 -10.451 -11.157   2.951
  394    H    VAL  50           HN       VAL  50  -4.864 -13.240   2.637
  395    HA   VAL  50           HA       VAL  50  -3.515 -10.827   1.731
  396    HB   VAL  50           HB       VAL  50  -3.112 -13.695   0.781
  397   HG11  VAL  50          HG11      VAL  50  -0.907 -12.937   0.034
  398   HG12  VAL  50          HG12      VAL  50  -1.302 -11.291   0.537
  399   HG13  VAL  50          HG13      VAL  50  -2.203 -12.053  -0.773
  400   HG21  VAL  50          HG21      VAL  50  -1.199 -13.783   2.310
  401   HG22  VAL  50          HG22      VAL  50  -2.715 -13.529   3.180
  402   HG23  VAL  50          HG23      VAL  50  -1.613 -12.180   2.914
  403    H    ARG  51           HN       ARG  51  -6.306 -12.480   0.970
  404    HA   ARG  51           HA       ARG  51  -6.232 -12.061  -1.904
  405    HB2  ARG  51           HB2      ARG  51  -8.383 -13.113  -0.071
  406    HB3  ARG  51           HB1      ARG  51  -8.707 -12.771  -1.755
  407    HG2  ARG  51           HG2      ARG  51  -8.360 -15.135  -1.462
  408    HG3  ARG  51           HG1      ARG  51  -7.008 -14.477  -2.377
  409    HD2  ARG  51           HD2      ARG  51  -6.274 -16.100  -0.699
  410    HD3  ARG  51           HD1      ARG  51  -5.635 -14.490  -0.377
  411    HE   ARG  51           HE       ARG  51  -8.051 -14.903   1.031
  412   HH11  ARG  51          HH11      ARG  51  -4.646 -15.885   1.075
  413   HH12  ARG  51          HH12      ARG  51  -4.575 -16.095   2.764
  414   HH21  ARG  51          HH21      ARG  51  -7.949 -15.178   3.395
  415   HH22  ARG  51          HH22      ARG  51  -6.492 -15.638   4.108
  416    H    TYR  52           HN       TYR  52  -6.749 -10.198   0.735
  417    HA   TYR  52           HA       TYR  52  -8.808  -8.549  -0.380
  418    HB2  TYR  52           HB2      TYR  52  -8.414  -8.990   2.137
  419    HB3  TYR  52           HB1      TYR  52  -7.048  -7.897   1.995
  420    HD1  TYR  52           HD1      TYR  52 -10.654  -7.959   1.040
  421    HD2  TYR  52           HD2      TYR  52  -7.446  -5.714   2.678
  422    HE1  TYR  52           HE1      TYR  52 -12.176  -6.077   1.447
  423    HE2  TYR  52           HE2      TYR  52  -8.960  -3.830   3.081
  424    HH   TYR  52           HH       TYR  52 -11.094  -3.044   2.015
  425    H    ASP  53           HN       ASP  53  -7.859  -8.146  -2.283
  426    HA   ASP  53           HA       ASP  53  -5.472  -6.444  -2.449
  427    HB2  ASP  53           HB2      ASP  53  -5.884  -8.651  -3.792
  428    HB3  ASP  53           HB1      ASP  53  -7.088  -7.743  -4.676
  429    H    GLU  54           HN       GLU  54  -5.949  -4.303  -2.466
  430    HA   GLU  54           HA       GLU  54  -8.655  -3.385  -3.265
  431    HB2  GLU  54           HB2      GLU  54  -8.637  -3.824  -0.851
  432    HB3  GLU  54           HB1      GLU  54  -7.171  -2.883  -0.687
  433    HG2  GLU  54           HG2      GLU  54  -8.345  -0.853  -1.112
  434    HG3  GLU  54           HG1      GLU  54  -9.813  -1.729  -1.543
  435    H    TRP  55           HN       TRP  55  -8.835  -1.144  -3.554
  436    HA   TRP  55           HA       TRP  55  -6.443  -0.006  -4.779
  437    HB2  TRP  55           HB2      TRP  55  -9.361   0.514  -5.176
  438    HB3  TRP  55           HB1      TRP  55  -8.080   1.423  -5.969
  439    HD1  TRP  55           HD1      TRP  55  -9.654  -2.082  -5.903
  440    HE1  TRP  55           HE1      TRP  55  -9.062  -3.273  -8.104
  441    HE3  TRP  55           HE3      TRP  55  -6.391   1.355  -7.793
  442    HZ2  TRP  55           HZ2      TRP  55  -7.380  -2.805 -10.353
  443    HZ3  TRP  55           HZ3      TRP  55  -5.312   0.911  -9.941
  444    HH2  TRP  55           HH2      TRP  55  -5.795  -1.120 -11.204
  445    H    VAL  56           HN       VAL  56  -5.511   1.493  -3.693
  446    HA   VAL  56           HA       VAL  56  -7.124   3.307  -2.062
  447    HB   VAL  56           HB       VAL  56  -5.277   3.543  -0.461
  448   HG11  VAL  56          HG11      VAL  56  -6.911   1.838   0.018
  449   HG12  VAL  56          HG12      VAL  56  -5.311   1.306   0.546
  450   HG13  VAL  56          HG13      VAL  56  -6.007   0.666  -0.942
  451   HG21  VAL  56          HG21      VAL  56  -3.839   1.430  -2.087
  452   HG22  VAL  56          HG22      VAL  56  -3.270   2.127  -0.566
  453   HG23  VAL  56          HG23      VAL  56  -3.411   3.134  -2.001
  454    H    LYS  57           HN       LYS  57  -5.947   5.422  -1.781
  455    HA   LYS  57           HA       LYS  57  -4.845   6.142  -4.396
  456    HB2  LYS  57           HB2      LYS  57  -6.976   7.177  -3.455
  457    HB3  LYS  57           HB1      LYS  57  -5.949   7.965  -2.270
  458    HG2  LYS  57           HG2      LYS  57  -4.739   9.061  -4.110
  459    HG3  LYS  57           HG1      LYS  57  -5.846   8.348  -5.261
  460    HD2  LYS  57           HD2      LYS  57  -7.749   9.400  -4.066
  461    HD3  LYS  57           HD1      LYS  57  -6.605  10.167  -2.971
  462    HE2  LYS  57           HE2      LYS  57  -5.620  11.374  -4.861
  463    HE3  LYS  57           HE1      LYS  57  -6.763  10.559  -5.935
  464    HZ1  LYS  57           HZ1      LYS  57  -7.499  12.387  -3.729
  465    HZ2  LYS  57           HZ2      LYS  57  -8.572  11.615  -4.790
  466    HZ3  LYS  57           HZ3      LYS  57  -7.512  12.765  -5.371
  467    H    ALA  58           HN       ALA  58  -3.188   7.972  -4.253
  468    HA   ALA  58           HA       ALA  58  -0.932   7.022  -2.922
  469    HB1  ALA  58           HB1      ALA  58  -1.286   9.788  -4.048
  470    HB2  ALA  58           HB2      ALA  58  -1.007   8.357  -5.014
  471    HB3  ALA  58           HB3      ALA  58   0.222   8.883  -3.854
  472    H    ASP  59           HN       ASP  59  -3.132   9.572  -2.052
  473    HA   ASP  59           HA       ASP  59  -1.550  10.521   0.152
  474    HB2  ASP  59           HB2      ASP  59  -4.429  11.057  -0.553
  475    HB3  ASP  59           HB1      ASP  59  -3.701  11.676   0.920
  476    H    ARG  60           HN       ARG  60  -3.213   7.730  -0.161
  477    HA   ARG  60           HA       ARG  60  -3.885   7.617   2.684
  478    HB2  ARG  60           HB2      ARG  60  -4.829   6.009   0.326
  479    HB3  ARG  60           HB1      ARG  60  -5.105   5.489   1.977
  480    HG2  ARG  60           HG2      ARG  60  -6.103   8.026   0.697
  481    HG3  ARG  60           HG1      ARG  60  -7.085   6.627   1.125
  482    HD2  ARG  60           HD2      ARG  60  -5.976   7.087   3.488
  483    HD3  ARG  60           HD1      ARG  60  -5.888   8.731   2.852
  484    HE   ARG  60           HE       ARG  60  -8.310   7.130   3.228
  485   HH11  ARG  60          HH11      ARG  60  -6.747  10.345   3.105
  486   HH12  ARG  60          HH12      ARG  60  -8.185  11.187   3.405
  487   HH21  ARG  60          HH21      ARG  60 -10.287   8.381   3.661
  488   HH22  ARG  60          HH22      ARG  60 -10.193  10.083   3.723
  489    H    ILE  61           HN       ILE  61  -1.234   7.166   1.084
  490    HA   ILE  61           HA       ILE  61  -0.643   4.577   2.295
  491    HB   ILE  61           HB       ILE  61   0.539   5.829  -0.200
  492   HG12  ILE  61          HG12      ILE  61  -1.280   3.450   0.159
  493   HG13  ILE  61          HG11      ILE  61  -1.724   4.998  -0.547
  494   HG21  ILE  61          HG21      ILE  61   1.734   3.720  -0.467
  495   HG22  ILE  61          HG22      ILE  61   1.043   3.151   1.054
  496   HG23  ILE  61          HG23      ILE  61   2.174   4.517   1.056
  497   HD11  ILE  61          HD11      ILE  61  -0.168   4.600  -2.379
  498   HD12  ILE  61          HD12      ILE  61  -1.372   3.315  -2.226
  499   HD13  ILE  61          HD13      ILE  61   0.269   3.049  -1.641
  500    H    ILE  62           HN       ILE  62   1.096   4.490   3.582
  501    HA   ILE  62           HA       ILE  62   2.717   6.923   3.881
  502    HB   ILE  62           HB       ILE  62   2.653   4.593   5.839
  503   HG12  ILE  62          HG12      ILE  62   1.482   6.293   7.395
  504   HG13  ILE  62          HG11      ILE  62   0.985   7.111   5.907
  505   HG21  ILE  62          HG21      ILE  62   3.753   6.150   7.383
  506   HG22  ILE  62          HG22      ILE  62   3.751   7.375   6.122
  507   HG23  ILE  62          HG23      ILE  62   4.675   5.892   5.906
  508   HD11  ILE  62          HD11      ILE  62   0.270   4.360   6.890
  509   HD12  ILE  62          HD12      ILE  62  -0.076   4.923   5.250
  510   HD13  ILE  62          HD13      ILE  62  -0.791   5.748   6.636
  511    H    TRP  63           HN       TRP  63   4.526   6.706   2.794
  512    HA   TRP  63           HA       TRP  63   5.461   4.098   2.049
  513    HB2  TRP  63           HB2      TRP  63   6.469   6.880   1.437
  514    HB3  TRP  63           HB1      TRP  63   7.216   5.412   0.810
  515    HD1  TRP  63           HD1      TRP  63   4.048   7.556   0.432
  516    HE1  TRP  63           HE1      TRP  63   2.858   6.879  -1.741
  517    HE3  TRP  63           HE3      TRP  63   6.895   3.516  -0.818
  518    HZ2  TRP  63           HZ2      TRP  63   3.088   4.888  -3.720
  519    HZ3  TRP  63           HZ3      TRP  63   6.343   2.270  -2.879
  520    HH2  TRP  63           HH2      TRP  63   4.483   2.938  -4.287
  521    HA   PRO  64           HA       PRO  64   7.892   3.972   5.821
  522    HB2  PRO  64           HB2      PRO  64   9.093   1.596   4.519
  523    HB3  PRO  64           HB1      PRO  64   8.311   1.728   6.098
  524    HG2  PRO  64           HG2      PRO  64   7.093   0.496   4.078
  525    HG3  PRO  64           HG1      PRO  64   6.182   1.512   5.212
  526    HD2  PRO  64           HD2      PRO  64   7.121   2.149   2.438
  527    HD3  PRO  64           HD1      PRO  64   5.567   2.512   3.235
  528    H    LEU  65           HN       LEU  65   9.473   5.287   6.001
  529    HA   LEU  65           HA       LEU  65  11.982   4.932   4.689
  530    HB2  LEU  65           HB2      LEU  65  10.373   6.319   3.128
  531    HB3  LEU  65           HB1      LEU  65  10.579   7.574   4.326
  532    HG   LEU  65           HG       LEU  65  12.005   7.954   2.383
  533   HD11  LEU  65          HD11      LEU  65  13.629   7.228   4.803
  534   HD12  LEU  65          HD12      LEU  65  12.839   8.773   4.495
  535   HD13  LEU  65          HD13      LEU  65  14.163   8.236   3.457
  536   HD21  LEU  65          HD21      LEU  65  12.283   5.667   1.658
  537   HD22  LEU  65          HD22      LEU  65  13.270   5.312   3.072
  538   HD23  LEU  65          HD23      LEU  65  13.855   6.443   1.850
  539    H    ASP  66           HN       ASP  66  12.821   4.747   6.615
  540    HA   ASP  66           HA       ASP  66  13.736   5.235   8.567
  541    HB2  ASP  66           HB2      ASP  66  14.656   7.176   7.461
  542    HB3  ASP  66           HB1      ASP  66  13.203   8.104   7.788
  543    H    LYS  67           HN       LYS  67  11.342   7.792   8.630
  544    HA   LYS  67           HA       LYS  67   9.729   8.355  10.022
  545    HB2  LYS  67           HB2      LYS  67   9.594   5.437  10.510
  546    HB3  LYS  67           HB1      LYS  67   8.663   6.554  11.502
  547    HG2  LYS  67           HG2      LYS  67   7.823   7.508   9.391
  548    HG3  LYS  67           HG1      LYS  67   8.501   6.078   8.570
  549    HD2  LYS  67           HD2      LYS  67   7.267   4.640  10.110
  550    HD3  LYS  67           HD1      LYS  67   6.663   6.101  10.903
  551    HE2  LYS  67           HE2      LYS  67   5.483   6.730   8.893
  552    HE3  LYS  67           HE1      LYS  67   6.054   5.268   8.079
  553    HZ1  LYS  67           HZ1      LYS  67   4.339   5.388  10.486
  554    HZ2  LYS  67           HZ2      LYS  67   4.900   3.970   9.830
  555    HZ3  LYS  67           HZ3      LYS  67   3.807   4.929   8.962
  556    H    GLY  68           HN       GLY  68  10.662   9.755  11.198
  557    HA2  GLY  68           HA2      GLY  68  11.743   8.881  13.744
  558    HA3  GLY  68           HA1      GLY  68  11.764  10.544  13.111
  559    H    LEU  69           HN       LEU  69   8.957  10.023  12.280
  560    HA   LEU  69           HA       LEU  69   7.552  11.167  14.515
  561    HB2  LEU  69           HB2      LEU  69   6.449   9.942  11.987
  562    HB3  LEU  69           HB1      LEU  69   5.612  11.035  13.064
  563    HG   LEU  69           HG       LEU  69   8.030  11.790  11.424
  564   HD11  LEU  69          HD11      LEU  69   5.107  12.334  10.936
  565   HD12  LEU  69          HD12      LEU  69   6.123  11.232  10.013
  566   HD13  LEU  69          HD13      LEU  69   6.454  12.967   9.986
  567   HD21  LEU  69          HD21      LEU  69   7.734  13.140  13.447
  568   HD22  LEU  69          HD22      LEU  69   6.061  13.461  12.993
  569   HD23  LEU  69          HD23      LEU  69   7.380  14.081  12.000
  570    H    GLU  70           HN       GLU  70   8.397   8.085  13.608
  571    HA   GLU  70           HA       GLU  70   6.626   6.781  15.479
  572    HB2  GLU  70           HB2      GLU  70   5.787   6.830  12.927
  573    HB3  GLU  70           HB1      GLU  70   7.044   5.614  12.754
  574    HG2  GLU  70           HG2      GLU  70   5.523   4.829  14.966
  575    HG3  GLU  70           HG1      GLU  70   4.377   5.318  13.720
  576    H    HIS  71           HN       HIS  71   7.835   4.135  14.319
  577    HA   HIS  71           HA       HIS  71  10.622   4.825  14.757
  578    HB2  HIS  71           HB2      HIS  71   9.217   3.955  16.859
  579    HB3  HIS  71           HB1      HIS  71   9.600   2.391  16.152
  580    HD1  HIS  71           HD1      HIS  71  11.571   1.426  17.241
  581    HD2  HIS  71           HD2      HIS  71  11.834   5.553  17.045
  582    HE1  HIS  71           HE1      HIS  71  13.758   2.013  18.337
  583    HE2  HIS  71           HE2      HIS  71  13.646   4.496  18.545
  584    H    HIS  72           HN       HIS  72  12.103   3.351  13.785
  585    HA   HIS  72           HA       HIS  72  11.433   2.165  11.345
  586    HB2  HIS  72           HB2      HIS  72  13.720   1.334  13.172
  587    HB3  HIS  72           HB1      HIS  72  13.573   0.877  11.492
  588    HD1  HIS  72           HD1      HIS  72  15.224   3.252  13.621
  589    HD2  HIS  72           HD2      HIS  72  13.758   3.329   9.739
  590    HE1  HIS  72           HE1      HIS  72  16.405   5.120  12.509
  591    HE2  HIS  72           HE2      HIS  72  15.249   5.393  10.358
  592    H    HIS  73           HN       HIS  73  12.077   0.517  14.387
  593    HA   HIS  73           HA       HIS  73  10.060  -1.473  14.016
  594    HB2  HIS  73           HB2      HIS  73  13.018  -2.222  14.180
  595    HB3  HIS  73           HB1      HIS  73  11.726  -3.349  14.551
  596    HD1  HIS  73           HD1      HIS  73  13.926  -2.499  11.957
  597    HD2  HIS  73           HD2      HIS  73   9.923  -3.580  12.107
  598    HE1  HIS  73           HE1      HIS  73  13.331  -3.221   9.630
  599    HE2  HIS  73           HE2      HIS  73  10.882  -3.794   9.724
  600    H    HIS  74           HN       HIS  74  10.985  -3.062  16.228
  601    HA   HIS  74           HA       HIS  74  10.379  -1.227  18.272
  602    HB2  HIS  74           HB2      HIS  74   9.843  -3.645  18.438
  603    HB3  HIS  74           HB1      HIS  74  11.556  -3.998  18.638
  604    HD1  HIS  74           HD1      HIS  74  12.194  -4.271  21.051
  605    HD2  HIS  74           HD2      HIS  74   8.981  -1.692  20.560
  606    HE1  HIS  74           HE1      HIS  74  11.530  -3.558  23.363
  607    HE2  HIS  74           HE2      HIS  74   9.366  -2.370  22.999
  608    H    HIS  75           HN       HIS  75  13.438  -2.620  17.219
  609    HA   HIS  75           HA       HIS  75  14.780  -0.457  18.687
  610    HB2  HIS  75           HB2      HIS  75  15.678  -3.296  18.279
  611    HB3  HIS  75           HB1      HIS  75  16.870  -2.023  18.478
  612    HD1  HIS  75           HD1      HIS  75  17.722  -2.925  20.704
  613    HD2  HIS  75           HD2      HIS  75  13.657  -2.132  20.710
  614    HE1  HIS  75           HE1      HIS  75  17.018  -3.068  23.091
  615    HE2  HIS  75           HE2      HIS  75  14.707  -2.115  23.036
  616    H    HIS  76           HN       HIS  76  15.811  -2.757  16.206
  617    HA   HIS  76           HA       HIS  76  16.219  -0.580  14.345
  618    HB2  HIS  76           HB2      HIS  76  18.362  -0.922  15.566
  619    HB3  HIS  76           HB1      HIS  76  18.320  -2.623  15.113
  620    HD1  HIS  76           HD1      HIS  76  19.193  -3.223  12.817
  621    HD2  HIS  76           HD2      HIS  76  18.809   0.860  13.396
  622    HE1  HIS  76           HE1      HIS  76  20.305  -2.162  10.837
  623    HE2  HIS  76           HE2      HIS  76  19.780   0.298  11.096
  Start of MODEL    8
    1    H1   GLU   1           HT1      GLU   1  12.231  -4.545   0.779
    2    H2   GLU   1           HT2      GLU   1  13.059  -3.952   2.129
    3    H3   GLU   1           HT3      GLU   1  12.752  -5.619   1.945
    4    HA   GLU   1           HA       GLU   1  14.409  -4.123   0.030
    5    HB2  GLU   1           HB2      GLU   1  16.348  -5.154   1.183
    6    HB3  GLU   1           HB1      GLU   1  15.479  -4.079   2.263
    7    HG2  GLU   1           HG2      GLU   1  14.327  -6.119   3.185
    8    HG3  GLU   1           HG1      GLU   1  15.455  -7.078   2.234
    9    H    ASP   2           HN       ASP   2  12.203  -5.776  -0.534
   10    HA   ASP   2           HA       ASP   2  13.414  -8.381  -1.106
   11    HB2  ASP   2           HB2      ASP   2  10.585  -7.884  -0.154
   12    HB3  ASP   2           HB1      ASP   2  11.370  -9.439  -0.412
   13    H    MET   3           HN       MET   3  13.728  -7.176  -3.175
   14    HA   MET   3           HA       MET   3  13.277  -6.708  -5.308
   15    HB2  MET   3           HB2      MET   3  12.637  -9.127  -5.342
   16    HB3  MET   3           HB1      MET   3  10.974  -8.662  -5.022
   17    HG2  MET   3           HG2      MET   3  11.257  -9.110  -7.370
   18    HG3  MET   3           HG1      MET   3  10.947  -7.389  -7.123
   19    HE1  MET   3           HE1      MET   3  11.830  -6.734  -9.485
   20    HE2  MET   3           HE2      MET   3  12.062  -8.450  -9.830
   21    HE3  MET   3           HE3      MET   3  13.354  -7.300 -10.174
   22    H    GLU   4           HN       GLU   4  12.764  -4.586  -4.676
   23    HA   GLU   4           HA       GLU   4   9.996  -3.936  -5.198
   24    HB2  GLU   4           HB2      GLU   4  10.067  -2.309  -3.246
   25    HB3  GLU   4           HB1      GLU   4   9.905  -4.026  -2.888
   26    HG2  GLU   4           HG2      GLU   4  12.321  -4.094  -2.795
   27    HG3  GLU   4           HG1      GLU   4  12.327  -2.333  -2.740
   28    HA   PRO   5           HA       PRO   5  12.616  -0.965  -7.498
   29    HB2  PRO   5           HB2      PRO   5  10.583  -1.503  -9.573
   30    HB3  PRO   5           HB1      PRO   5  12.344  -1.578  -9.698
   31    HG2  PRO   5           HG2      PRO   5  10.866  -3.810  -9.694
   32    HG3  PRO   5           HG1      PRO   5  12.445  -3.740  -8.885
   33    HD2  PRO   5           HD2      PRO   5   9.702  -3.527  -7.638
   34    HD3  PRO   5           HD1      PRO   5  11.118  -4.445  -7.080
   35    H    CYS   6           HN       CYS   6  11.864   0.616  -6.107
   36    HA   CYS   6           HA       CYS   6  10.849   2.481  -5.436
   37    HB2  CYS   6           HB2      CYS   6   9.670   2.491  -8.220
   38    HB3  CYS   6           HB1      CYS   6   9.561   3.834  -7.092
   39    HG   CYS   6           HG       CYS   6  12.395   4.073  -6.944
   40    H    LEU   7           HN       LEU   7   8.216   1.201  -7.380
   41    HA   LEU   7           HA       LEU   7   6.419   1.772  -5.126
   42    HB2  LEU   7           HB2      LEU   7   5.694   1.146  -7.979
   43    HB3  LEU   7           HB1      LEU   7   4.633   1.759  -6.734
   44    HG   LEU   7           HG       LEU   7   6.924   3.266  -7.987
   45   HD11  LEU   7          HD11      LEU   7   5.218   4.609  -9.038
   46   HD12  LEU   7          HD12      LEU   7   3.954   3.635  -8.291
   47   HD13  LEU   7          HD13      LEU   7   5.029   2.917  -9.490
   48   HD21  LEU   7          HD21      LEU   7   4.864   4.175  -5.965
   49   HD22  LEU   7          HD22      LEU   7   6.033   5.211  -6.775
   50   HD23  LEU   7          HD23      LEU   7   6.589   3.953  -5.672
   51    H    THR   8           HN       THR   8   6.520  -0.608  -7.753
   52    HA   THR   8           HA       THR   8   4.833  -2.469  -6.563
   53    HB   THR   8           HB       THR   8   5.855  -4.004  -8.305
   54    HG1  THR   8           HG1      THR   8   7.832  -2.547  -8.185
   55   HG21  THR   8          HG21      THR   8   3.845  -2.689  -8.728
   56   HG22  THR   8          HG22      THR   8   4.859  -2.729 -10.171
   57   HG23  THR   8          HG23      THR   8   4.825  -1.284  -9.152
   58    H    GLY   9           HN       GLY   9   5.162  -4.079  -5.149
   59    HA2  GLY   9           HA2      GLY   9   6.372  -5.851  -4.210
   60    HA3  GLY   9           HA1      GLY   9   7.870  -5.091  -4.742
   61    H    THR  10           HN       THR  10   7.111  -2.487  -3.691
   62    HA   THR  10           HA       THR  10   8.263  -2.671  -1.166
   63    HB   THR  10           HB       THR  10   6.571  -0.472  -2.321
   64    HG1  THR  10           HG1      THR  10   8.348   0.212  -3.400
   65   HG21  THR  10          HG21      THR  10   7.982   1.017  -0.940
   66   HG22  THR  10          HG22      THR  10   8.783  -0.406  -0.256
   67   HG23  THR  10          HG23      THR  10   7.061  -0.135   0.023
   68    H    LYS  11           HN       LYS  11   7.363  -2.958   0.780
   69    HA   LYS  11           HA       LYS  11   4.489  -3.093   0.888
   70    HB2  LYS  11           HB2      LYS  11   4.701  -4.251   3.083
   71    HB3  LYS  11           HB1      LYS  11   5.503  -5.089   1.787
   72    HG2  LYS  11           HG2      LYS  11   6.915  -5.320   3.638
   73    HG3  LYS  11           HG1      LYS  11   7.676  -4.086   2.645
   74    HD2  LYS  11           HD2      LYS  11   7.757  -3.499   5.023
   75    HD3  LYS  11           HD1      LYS  11   6.765  -2.352   4.123
   76    HE2  LYS  11           HE2      LYS  11   4.729  -3.437   4.927
   77    HE3  LYS  11           HE1      LYS  11   5.684  -4.674   5.742
   78    HZ1  LYS  11           HZ1      LYS  11   5.753  -1.778   6.375
   79    HZ2  LYS  11           HZ2      LYS  11   6.559  -3.004   7.200
   80    HZ3  LYS  11           HZ3      LYS  11   4.873  -2.953   7.218
   81    H    VAL  12           HN       VAL  12   3.265  -1.852   2.000
   82    HA   VAL  12           HA       VAL  12   4.478   0.549   3.195
   83    HB   VAL  12           HB       VAL  12   2.773   1.891   2.043
   84   HG11  VAL  12          HG11      VAL  12   3.714   1.798  -0.210
   85   HG12  VAL  12          HG12      VAL  12   4.400   0.212   0.139
   86   HG13  VAL  12          HG13      VAL  12   4.982   1.628   1.005
   87   HG21  VAL  12          HG21      VAL  12   1.073   0.139   1.792
   88   HG22  VAL  12          HG22      VAL  12   2.071  -0.668   0.585
   89   HG23  VAL  12          HG23      VAL  12   1.407   0.941   0.260
   90    H    LYS  13           HN       LYS  13   2.532   1.889   4.101
   91    HA   LYS  13           HA       LYS  13   0.667   0.075   5.450
   92    HB2  LYS  13           HB2      LYS  13   1.766   2.745   6.388
   93    HB3  LYS  13           HB1      LYS  13   0.501   1.850   7.185
   94    HG2  LYS  13           HG2      LYS  13   3.101   0.550   6.637
   95    HG3  LYS  13           HG1      LYS  13   2.874   1.627   8.064
   96    HD2  LYS  13           HD2      LYS  13   1.120  -0.710   7.389
   97    HD3  LYS  13           HD1      LYS  13   2.590  -0.893   8.345
   98    HE2  LYS  13           HE2      LYS  13   1.723   0.686   9.971
   99    HE3  LYS  13           HE1      LYS  13   0.264   0.896   9.003
  100    HZ1  LYS  13           HZ1      LYS  13   1.196  -1.646  10.187
  101    HZ2  LYS  13           HZ2      LYS  13  -0.300  -1.422   9.437
  102    HZ3  LYS  13           HZ3      LYS  13   0.042  -0.662  10.910
  103    H    VAL  14           HN       VAL  14  -1.416   0.507   5.239
  104    HA   VAL  14           HA       VAL  14  -2.097   2.787   3.505
  105    HB   VAL  14           HB       VAL  14  -3.426   0.066   3.620
  106   HG11  VAL  14          HG11      VAL  14  -4.854   0.878   1.794
  107   HG12  VAL  14          HG12      VAL  14  -4.087   2.461   1.904
  108   HG13  VAL  14          HG13      VAL  14  -5.061   1.863   3.243
  109   HG21  VAL  14          HG21      VAL  14  -1.270   0.115   2.440
  110   HG22  VAL  14          HG22      VAL  14  -1.880   1.378   1.363
  111   HG23  VAL  14          HG23      VAL  14  -2.618  -0.225   1.371
  112    H    LYS  15           HN       LYS  15  -3.629   4.115   4.160
  113    HA   LYS  15           HA       LYS  15  -4.820   3.634   6.793
  114    HB2  LYS  15           HB2      LYS  15  -3.321   5.497   6.725
  115    HB3  LYS  15           HB1      LYS  15  -4.055   6.103   5.259
  116    HG2  LYS  15           HG2      LYS  15  -6.100   6.620   6.531
  117    HG3  LYS  15           HG1      LYS  15  -5.290   6.066   8.003
  118    HD2  LYS  15           HD2      LYS  15  -3.610   7.761   7.801
  119    HD3  LYS  15           HD1      LYS  15  -4.209   8.232   6.214
  120    HE2  LYS  15           HE2      LYS  15  -6.319   8.956   7.254
  121    HE3  LYS  15           HE1      LYS  15  -5.668   8.525   8.837
  122    HZ1  LYS  15           HZ1      LYS  15  -3.955  10.180   8.568
  123    HZ2  LYS  15           HZ2      LYS  15  -5.456  10.920   8.303
  124    HZ3  LYS  15           HZ3      LYS  15  -4.473  10.508   7.004
  125    H    TYR  16           HN       TYR  16  -6.928   2.975   6.632
  126    HA   TYR  16           HA       TYR  16  -8.693   4.667   5.091
  127    HB2  TYR  16           HB2      TYR  16  -8.385   1.756   4.579
  128    HB3  TYR  16           HB1      TYR  16 -10.025   2.364   4.654
  129    HD1  TYR  16           HD1      TYR  16  -9.584   5.038   3.307
  130    HD2  TYR  16           HD2      TYR  16  -8.190   1.141   2.323
  131    HE1  TYR  16           HE1      TYR  16  -9.508   5.671   0.948
  132    HE2  TYR  16           HE2      TYR  16  -8.112   1.781  -0.055
  133    HH   TYR  16           HH       TYR  16  -8.919   3.356  -1.557
  134    H    GLY  17           HN       GLY  17 -10.394   5.270   6.221
  135    HA2  GLY  17           HA2      GLY  17 -11.834   3.519   7.821
  136    HA3  GLY  17           HA1      GLY  17 -10.692   4.438   8.799
  137    H    ARG  18           HN       ARG  18 -13.326   4.601   9.205
  138    HA   ARG  18           HA       ARG  18 -13.573   7.425   8.724
  139    HB2  ARG  18           HB2      ARG  18 -16.085   7.145   8.740
  140    HB3  ARG  18           HB1      ARG  18 -15.286   6.541   7.304
  141    HG2  ARG  18           HG2      ARG  18 -15.527   4.252   8.122
  142    HG3  ARG  18           HG1      ARG  18 -16.269   4.847   9.603
  143    HD2  ARG  18           HD2      ARG  18 -18.101   5.806   8.339
  144    HD3  ARG  18           HD1      ARG  18 -17.347   5.317   6.825
  145    HE   ARG  18           HE       ARG  18 -17.569   2.984   7.895
  146   HH11  ARG  18          HH11      ARG  18 -19.965   5.595   8.120
  147   HH12  ARG  18          HH12      ARG  18 -21.297   4.548   8.212
  148   HH21  ARG  18          HH21      ARG  18 -19.385   1.575   8.023
  149   HH22  ARG  18          HH22      ARG  18 -20.963   2.194   8.185
  150    H    GLY  19           HN       GLY  19 -13.112   8.274  10.546
  151    HA2  GLY  19           HA2      GLY  19 -13.284   8.868  12.755
  152    HA3  GLY  19           HA1      GLY  19 -14.699   7.827  12.847
  153    H    LYS  20           HN       LYS  20 -14.512   6.310  14.282
  154    HA   LYS  20           HA       LYS  20 -11.895   5.493  15.221
  155    HB2  LYS  20           HB2      LYS  20 -13.642   6.135  16.845
  156    HB3  LYS  20           HB1      LYS  20 -14.665   4.832  16.288
  157    HG2  LYS  20           HG2      LYS  20 -13.610   4.253  18.380
  158    HG3  LYS  20           HG1      LYS  20 -12.989   3.216  17.092
  159    HD2  LYS  20           HD2      LYS  20 -10.994   4.619  16.922
  160    HD3  LYS  20           HD1      LYS  20 -11.620   5.667  18.197
  161    HE2  LYS  20           HE2      LYS  20 -11.537   3.816  19.770
  162    HE3  LYS  20           HE1      LYS  20 -10.988   2.736  18.491
  163    HZ1  LYS  20           HZ1      LYS  20  -9.178   3.493  19.862
  164    HZ2  LYS  20           HZ2      LYS  20  -9.497   5.108  19.491
  165    HZ3  LYS  20           HZ3      LYS  20  -8.986   4.038  18.286
  166    H    THR  21           HN       THR  21 -14.151   4.466  12.965
  167    HA   THR  21           HA       THR  21 -13.717   1.618  13.150
  168    HB   THR  21           HB       THR  21 -14.903   3.288  10.890
  169    HG1  THR  21           HG1      THR  21 -15.758   2.898  13.367
  170   HG21  THR  21          HG21      THR  21 -14.406   0.929  10.279
  171   HG22  THR  21          HG22      THR  21 -16.128   1.288  10.285
  172   HG23  THR  21          HG23      THR  21 -15.412   0.391  11.631
  173    H    GLN  22           HN       GLN  22 -11.613   3.868  12.553
  174    HA   GLN  22           HA       GLN  22 -10.506   3.063  10.000
  175    HB2  GLN  22           HB2      GLN  22 -10.552   5.454  10.583
  176    HB3  GLN  22           HB1      GLN  22  -9.571   5.118  11.995
  177    HG2  GLN  22           HG2      GLN  22  -7.747   4.352  10.545
  178    HG3  GLN  22           HG1      GLN  22  -8.706   4.754   9.129
  179   HE21  GLN  22          HE21      GLN  22  -6.174   5.723   9.958
  180   HE22  GLN  22          HE22      GLN  22  -6.311   7.428  10.190
  181    H    LYS  23           HN       LYS  23  -8.646   2.060   9.639
  182    HA   LYS  23           HA       LYS  23  -6.869   1.456  11.806
  183    HB2  LYS  23           HB2      LYS  23  -6.730  -0.925  11.281
  184    HB3  LYS  23           HB1      LYS  23  -8.382  -0.538  11.712
  185    HG2  LYS  23           HG2      LYS  23  -7.477  -0.692   8.849
  186    HG3  LYS  23           HG1      LYS  23  -7.985  -2.116   9.739
  187    HD2  LYS  23           HD2      LYS  23  -9.723   0.329   9.457
  188    HD3  LYS  23           HD1      LYS  23  -9.729  -0.981   8.273
  189    HE2  LYS  23           HE2      LYS  23 -10.331  -2.554  10.021
  190    HE3  LYS  23           HE1      LYS  23 -10.325  -1.262  11.218
  191    HZ1  LYS  23           HZ1      LYS  23 -12.126  -1.406   8.858
  192    HZ2  LYS  23           HZ2      LYS  23 -12.153  -0.201  10.050
  193    HZ3  LYS  23           HZ3      LYS  23 -12.562  -1.794  10.436
  194    H    ILE  24           HN       ILE  24  -4.784   0.901  10.977
  195    HA   ILE  24           HA       ILE  24  -4.489   1.553   8.151
  196    HB   ILE  24           HB       ILE  24  -2.469   1.976  10.410
  197   HG12  ILE  24          HG12      ILE  24  -2.500   4.386   9.606
  198   HG13  ILE  24          HG11      ILE  24  -3.863   3.971   8.597
  199   HG21  ILE  24          HG21      ILE  24  -0.856   2.737   8.794
  200   HG22  ILE  24          HG22      ILE  24  -2.050   2.605   7.511
  201   HG23  ILE  24          HG23      ILE  24  -1.457   1.147   8.287
  202   HD11  ILE  24          HD11      ILE  24  -5.200   3.497  10.579
  203   HD12  ILE  24          HD12      ILE  24  -4.524   5.127  10.657
  204   HD13  ILE  24          HD13      ILE  24  -3.810   3.826  11.603
  205    H    TYR  25           HN       TYR  25  -3.443   0.116   6.905
  206    HA   TYR  25           HA       TYR  25  -3.076  -2.568   8.109
  207    HB2  TYR  25           HB2      TYR  25  -3.406  -1.989   5.185
  208    HB3  TYR  25           HB1      TYR  25  -3.670  -3.500   6.030
  209    HD1  TYR  25           HD2      TYR  25  -5.859  -3.871   7.240
  210    HD2  TYR  25           HD1      TYR  25  -5.058  -0.307   5.046
  211    HE1  TYR  25           HE2      TYR  25  -8.253  -3.348   7.188
  212    HE2  TYR  25           HE1      TYR  25  -7.429   0.203   4.992
  213    HH   TYR  25           HH       TYR  25  -9.519  -0.954   5.138
  214    H    GLU  26           HN       GLU  26  -1.442  -3.930   6.963
  215    HA   GLU  26           HA       GLU  26   0.969  -2.459   6.065
  216    HB2  GLU  26           HB2      GLU  26   0.553  -5.367   6.926
  217    HB3  GLU  26           HB1      GLU  26   2.089  -4.636   6.531
  218    HG2  GLU  26           HG2      GLU  26   0.531  -3.503   8.793
  219    HG3  GLU  26           HG1      GLU  26   1.355  -5.059   9.029
  220    H    ALA  27           HN       ALA  27   1.051  -2.571   3.766
  221    HA   ALA  27           HA       ALA  27  -0.235  -4.878   2.449
  222    HB1  ALA  27           HB1      ALA  27  -1.794  -2.985   2.438
  223    HB2  ALA  27           HB2      ALA  27  -1.261  -3.418   0.813
  224    HB3  ALA  27           HB3      ALA  27  -0.578  -2.003   1.617
  225    H    SER  28           HN       SER  28   0.401  -5.033   0.138
  226    HA   SER  28           HA       SER  28   3.071  -3.880  -0.357
  227    HB2  SER  28           HB2      SER  28   2.015  -6.555  -1.313
  228    HB3  SER  28           HB1      SER  28   3.609  -5.876  -1.657
  229    HG   SER  28           HG       SER  28   4.273  -6.551   0.151
  230    H    ILE  29           HN       ILE  29   3.443  -2.946  -2.350
  231    HA   ILE  29           HA       ILE  29   1.138  -2.137  -3.858
  232    HB   ILE  29           HB       ILE  29   4.049  -1.664  -4.513
  233   HG12  ILE  29          HG12      ILE  29   3.635  -0.850  -2.231
  234   HG13  ILE  29          HG11      ILE  29   3.870   0.488  -3.327
  235   HG21  ILE  29          HG21      ILE  29   3.201   0.334  -5.691
  236   HG22  ILE  29          HG22      ILE  29   1.553  -0.189  -5.327
  237   HG23  ILE  29          HG23      ILE  29   2.580  -1.176  -6.360
  238   HD11  ILE  29          HD11      ILE  29   1.393   0.755  -3.426
  239   HD12  ILE  29          HD12      ILE  29   2.119   1.041  -1.857
  240   HD13  ILE  29          HD13      ILE  29   1.268  -0.476  -2.157
  241    H    LYS  30           HN       LYS  30   0.375  -3.028  -5.633
  242    HA   LYS  30           HA       LYS  30   1.773  -5.216  -7.016
  243    HB2  LYS  30           HB2      LYS  30  -1.071  -4.266  -6.931
  244    HB3  LYS  30           HB1      LYS  30  -0.522  -5.463  -8.087
  245    HG2  LYS  30           HG2      LYS  30  -0.100  -5.840  -5.153
  246    HG3  LYS  30           HG1      LYS  30  -1.644  -6.232  -5.907
  247    HD2  LYS  30           HD2      LYS  30   1.012  -7.340  -6.824
  248    HD3  LYS  30           HD1      LYS  30  -0.080  -8.160  -5.705
  249    HE2  LYS  30           HE2      LYS  30  -1.849  -8.095  -7.414
  250    HE3  LYS  30           HE1      LYS  30  -0.725  -7.368  -8.549
  251    HZ1  LYS  30           HZ1      LYS  30  -0.364 -10.005  -7.261
  252    HZ2  LYS  30           HZ2      LYS  30   0.632  -9.367  -8.454
  253    HZ3  LYS  30           HZ3      LYS  30  -0.970  -9.784  -8.811
  254    H    SER  31           HN       SER  31  -0.248  -2.401  -7.924
  255    HA   SER  31           HA       SER  31   1.495  -1.804 -10.118
  256    HB2  SER  31           HB2      SER  31  -0.095  -3.642 -10.928
  257    HB3  SER  31           HB1      SER  31  -1.414  -2.528 -10.603
  258    HG   SER  31           HG       SER  31   0.664  -2.324 -12.487
  259    H    THR  32           HN       THR  32   0.566   0.215 -11.186
  260    HA   THR  32           HA       THR  32  -1.184   1.713  -9.386
  261    HB   THR  32           HB       THR  32   0.956   3.119 -10.881
  262    HG1  THR  32           HG1      THR  32   2.030   1.437  -9.673
  263   HG21  THR  32          HG21      THR  32  -0.334   3.527  -8.210
  264   HG22  THR  32          HG22      THR  32  -0.795   4.284  -9.729
  265   HG23  THR  32          HG23      THR  32   0.777   4.648  -9.006
  266    H    GLU  33           HN       GLU  33  -2.585   2.946 -10.483
  267    HA   GLU  33           HA       GLU  33  -2.348   3.228 -13.357
  268    HB2  GLU  33           HB2      GLU  33  -4.673   1.877 -12.010
  269    HB3  GLU  33           HB1      GLU  33  -4.756   2.604 -13.606
  270    HG2  GLU  33           HG2      GLU  33  -3.114   1.130 -14.462
  271    HG3  GLU  33           HG1      GLU  33  -2.798   0.441 -12.872
  272    H    ILE  34           HN       ILE  34  -3.783   4.754 -14.180
  273    HA   ILE  34           HA       ILE  34  -4.527   6.695 -12.135
  274    HB   ILE  34           HB       ILE  34  -3.776   7.150 -15.022
  275   HG12  ILE  34          HG12      ILE  34  -1.986   8.669 -14.032
  276   HG13  ILE  34          HG11      ILE  34  -2.471   8.059 -12.461
  277   HG21  ILE  34          HG21      ILE  34  -4.746   9.197 -13.028
  278   HG22  ILE  34          HG22      ILE  34  -5.598   8.648 -14.469
  279   HG23  ILE  34          HG23      ILE  34  -4.099   9.571 -14.628
  280   HD11  ILE  34          HD11      ILE  34  -1.279   6.415 -14.684
  281   HD12  ILE  34          HD12      ILE  34  -1.794   5.838 -13.097
  282   HD13  ILE  34          HD13      ILE  34  -0.448   6.974 -13.216
  283    H    ASP  35           HN       ASP  35  -6.573   6.972 -11.916
  284    HA   ASP  35           HA       ASP  35  -8.455   6.364 -14.077
  285    HB2  ASP  35           HB2      ASP  35  -8.247   4.308 -12.674
  286    HB3  ASP  35           HB1      ASP  35  -8.679   5.257 -11.260
  287    H    ASP  36           HN       ASP  36 -10.007   7.826 -14.159
  288    HA   ASP  36           HA       ASP  36 -11.293   9.663 -13.769
  289    HB2  ASP  36           HB2      ASP  36 -11.997   8.284 -11.741
  290    HB3  ASP  36           HB1      ASP  36 -10.795   9.155 -10.808
  291    H    GLY  37           HN       GLY  37  -8.316   9.704 -13.892
  292    HA2  GLY  37           HA2      GLY  37  -6.883  11.494 -14.251
  293    HA3  GLY  37           HA1      GLY  37  -7.995  12.543 -13.387
  294    H    GLU  38           HN       GLU  38  -7.583   9.937 -11.414
  295    HA   GLU  38           HA       GLU  38  -5.306  11.174 -10.127
  296    HB2  GLU  38           HB2      GLU  38  -6.408  10.310  -7.979
  297    HB3  GLU  38           HB1      GLU  38  -7.062  11.739  -8.774
  298    HG2  GLU  38           HG2      GLU  38  -8.801  10.322  -9.791
  299    HG3  GLU  38           HG1      GLU  38  -8.187   8.961  -8.850
  300    H    VAL  39           HN       VAL  39  -4.119   9.722  -8.613
  301    HA   VAL  39           HA       VAL  39  -3.641   7.324 -10.209
  302    HB   VAL  39           HB       VAL  39  -1.703   8.388  -8.186
  303   HG11  VAL  39          HG11      VAL  39  -0.052   7.273  -9.682
  304   HG12  VAL  39          HG12      VAL  39  -1.404   6.699 -10.660
  305   HG13  VAL  39          HG13      VAL  39  -1.251   6.183  -9.000
  306   HG21  VAL  39          HG21      VAL  39  -2.139  10.287  -9.603
  307   HG22  VAL  39          HG22      VAL  39  -1.949   9.310 -11.048
  308   HG23  VAL  39          HG23      VAL  39  -0.556   9.624 -10.008
  309    H    LEU  40           HN       LEU  40  -4.250   5.538  -9.542
  310    HA   LEU  40           HA       LEU  40  -4.627   5.117  -6.679
  311    HB2  LEU  40           HB2      LEU  40  -6.009   3.763  -8.991
  312    HB3  LEU  40           HB1      LEU  40  -6.316   3.506  -7.283
  313    HG   LEU  40           HG       LEU  40  -6.872   6.046  -8.801
  314   HD11  LEU  40          HD11      LEU  40  -8.370   4.221  -9.387
  315   HD12  LEU  40          HD12      LEU  40  -9.205   5.481  -8.477
  316   HD13  LEU  40          HD13      LEU  40  -8.747   3.971  -7.681
  317   HD21  LEU  40          HD21      LEU  40  -6.261   6.484  -6.497
  318   HD22  LEU  40          HD22      LEU  40  -7.427   5.308  -5.919
  319   HD23  LEU  40          HD23      LEU  40  -7.975   6.780  -6.737
  320    H    TYR  41           HN       TYR  41  -3.766   3.372  -5.839
  321    HA   TYR  41           HA       TYR  41  -1.933   1.771  -7.470
  322    HB2  TYR  41           HB2      TYR  41  -1.982   2.419  -4.518
  323    HB3  TYR  41           HB1      TYR  41  -0.937   1.205  -5.222
  324    HD1  TYR  41           HD2      TYR  41  -1.735   4.879  -5.509
  325    HD2  TYR  41           HD1      TYR  41   1.186   1.797  -5.876
  326    HE1  TYR  41           HE2      TYR  41  -0.058   6.531  -5.895
  327    HE2  TYR  41           HE1      TYR  41   2.915   3.494  -6.252
  328    HH   TYR  41           HH       TYR  41   3.024   5.877  -7.081
  329    H    LEU  42           HN       LEU  42  -1.873  -0.419  -7.027
  330    HA   LEU  42           HA       LEU  42  -4.275  -1.556  -5.790
  331    HB2  LEU  42           HB2      LEU  42  -2.407  -2.468  -7.925
  332    HB3  LEU  42           HB1      LEU  42  -3.152  -3.674  -6.903
  333    HG   LEU  42           HG       LEU  42  -4.674  -1.683  -8.570
  334   HD11  LEU  42          HD11      LEU  42  -5.151  -3.637  -9.972
  335   HD12  LEU  42          HD12      LEU  42  -4.051  -4.609  -8.982
  336   HD13  LEU  42          HD13      LEU  42  -3.427  -3.275  -9.942
  337   HD21  LEU  42          HD21      LEU  42  -6.553  -3.180  -8.036
  338   HD22  LEU  42          HD22      LEU  42  -5.895  -2.405  -6.604
  339   HD23  LEU  42          HD23      LEU  42  -5.501  -4.092  -6.955
  340    H    VAL  43           HN       VAL  43  -3.949  -2.157  -3.830
  341    HA   VAL  43           HA       VAL  43  -1.309  -3.197  -3.135
  342    HB   VAL  43           HB       VAL  43  -1.331  -1.998  -1.017
  343   HG11  VAL  43          HG11      VAL  43  -2.079  -0.072  -3.162
  344   HG12  VAL  43          HG12      VAL  43  -0.503  -0.808  -2.948
  345   HG13  VAL  43          HG13      VAL  43  -1.145   0.269  -1.701
  346   HG21  VAL  43          HG21      VAL  43  -4.066  -1.003  -1.834
  347   HG22  VAL  43          HG22      VAL  43  -3.151  -0.371  -0.485
  348   HG23  VAL  43          HG23      VAL  43  -3.706  -2.052  -0.460
  349    H    HIS  44           HN       HIS  44  -1.377  -4.938  -1.808
  350    HA   HIS  44           HA       HIS  44  -4.055  -5.674  -0.914
  351    HB2  HIS  44           HB2      HIS  44  -3.477  -8.105  -1.000
  352    HB3  HIS  44           HB1      HIS  44  -3.533  -7.341  -2.572
  353    HD1  HIS  44           HD1      HIS  44  -1.704  -7.846  -4.022
  354    HD2  HIS  44           HD2      HIS  44  -0.668  -8.541  -0.067
  355    HE1  HIS  44           HE1      HIS  44   0.613  -8.987  -4.073
  356    HE2  HIS  44           HE2      HIS  44   1.117  -9.499  -1.686
  357    H    TYR  45           HN       TYR  45  -4.409  -5.929   1.002
  358    HA   TYR  45           HA       TYR  45  -2.445  -5.241   2.953
  359    HB2  TYR  45           HB2      TYR  45  -5.221  -6.373   3.416
  360    HB3  TYR  45           HB1      TYR  45  -4.317  -5.280   4.461
  361    HD1  TYR  45           HD1      TYR  45  -3.656  -2.992   3.299
  362    HD2  TYR  45           HD2      TYR  45  -6.920  -5.435   2.106
  363    HE1  TYR  45           HE1      TYR  45  -4.684  -1.068   2.214
  364    HE2  TYR  45           HE2      TYR  45  -7.975  -3.496   1.017
  365    HH   TYR  45           HH       TYR  45  -7.914  -1.050   0.986
  366    H    TYR  46           HN       TYR  46  -0.976  -6.759   3.624
  367    HA   TYR  46           HA       TYR  46  -1.597  -9.423   2.814
  368    HB2  TYR  46           HB2      TYR  46   0.701 -10.098   3.252
  369    HB3  TYR  46           HB1      TYR  46   0.612  -8.691   2.223
  370    HD1  TYR  46           HD1      TYR  46   1.594  -9.966   5.527
  371    HD2  TYR  46           HD2      TYR  46   1.602  -6.585   2.943
  372    HE1  TYR  46           HE1      TYR  46   3.313  -8.911   6.927
  373    HE2  TYR  46           HE2      TYR  46   3.317  -5.512   4.348
  374    HH   TYR  46           HH       TYR  46   5.104  -7.226   6.582
  375    H    GLY  47           HN       GLY  47  -2.422  -7.966   5.472
  376    HA2  GLY  47           HA2      GLY  47  -1.986 -10.214   7.238
  377    HA3  GLY  47           HA1      GLY  47  -2.916  -8.758   7.602
  378    H    TRP  48           HN       TRP  48  -2.960 -11.858   5.989
  379    HA   TRP  48           HA       TRP  48  -4.566 -13.431   5.783
  380    HB2  TRP  48           HB2      TRP  48  -5.541 -12.841   7.900
  381    HB3  TRP  48           HB1      TRP  48  -6.330 -11.431   7.215
  382    HD1  TRP  48           HD1      TRP  48  -8.759 -11.764   6.383
  383    HE1  TRP  48           HE1      TRP  48 -10.339 -13.784   6.168
  384    HE3  TRP  48           HE3      TRP  48  -5.432 -15.531   7.351
  385    HZ2  TRP  48           HZ2      TRP  48 -10.204 -16.575   6.364
  386    HZ3  TRP  48           HZ3      TRP  48  -6.252 -17.852   7.318
  387    HH2  TRP  48           HH2      TRP  48  -8.585 -18.359   6.837
  388    H    ASN  49           HN       ASN  49  -5.095 -10.317   4.524
  389    HA   ASN  49           HA       ASN  49  -7.229 -11.058   2.745
  390    HB2  ASN  49           HB2      ASN  49  -5.612  -8.560   3.088
  391    HB3  ASN  49           HB1      ASN  49  -6.793  -8.729   1.814
  392   HD21  ASN  49          HD21      ASN  49  -8.006  -7.010   2.675
  393   HD22  ASN  49          HD22      ASN  49  -8.918  -7.147   4.130
  394    H    VAL  50           HN       VAL  50  -6.635 -12.501   1.239
  395    HA   VAL  50           HA       VAL  50  -4.164 -12.053  -0.187
  396    HB   VAL  50           HB       VAL  50  -4.653 -14.230  -1.374
  397   HG11  VAL  50          HG11      VAL  50  -3.161 -14.109   0.523
  398   HG12  VAL  50          HG12      VAL  50  -4.095 -15.605   0.584
  399   HG13  VAL  50          HG13      VAL  50  -4.525 -14.252   1.629
  400   HG21  VAL  50          HG21      VAL  50  -7.093 -14.293  -1.075
  401   HG22  VAL  50          HG22      VAL  50  -6.877 -14.406   0.672
  402   HG23  VAL  50          HG23      VAL  50  -6.339 -15.722  -0.366
  403    H    ARG  51           HN       ARG  51  -7.601 -12.227  -1.002
  404    HA   ARG  51           HA       ARG  51  -6.896 -11.195  -3.645
  405    HB2  ARG  51           HB2      ARG  51  -8.346 -13.247  -3.496
  406    HB3  ARG  51           HB1      ARG  51  -9.593 -12.255  -2.760
  407    HG2  ARG  51           HG2      ARG  51  -9.719 -10.887  -4.789
  408    HG3  ARG  51           HG1      ARG  51  -8.459 -11.859  -5.535
  409    HD2  ARG  51           HD2      ARG  51 -10.629 -12.544  -6.333
  410    HD3  ARG  51           HD1      ARG  51  -9.920 -13.835  -5.370
  411    HE   ARG  51           HE       ARG  51 -11.538 -12.185  -3.765
  412   HH11  ARG  51          HH11      ARG  51 -11.898 -14.545  -6.373
  413   HH12  ARG  51          HH12      ARG  51 -13.331 -15.237  -5.762
  414   HH21  ARG  51          HH21      ARG  51 -13.577 -13.068  -2.953
  415   HH22  ARG  51          HH22      ARG  51 -14.323 -14.338  -3.793
  416    H    TYR  52           HN       TYR  52  -7.653  -9.960  -0.725
  417    HA   TYR  52           HA       TYR  52  -9.210  -7.837  -1.905
  418    HB2  TYR  52           HB2      TYR  52  -8.246  -8.013   0.973
  419    HB3  TYR  52           HB1      TYR  52  -9.218  -6.715   0.315
  420    HD1  TYR  52           HD2      TYR  52 -11.498  -7.278  -0.623
  421    HD2  TYR  52           HD1      TYR  52  -9.257  -9.970   1.775
  422    HE1  TYR  52           HE2      TYR  52 -13.542  -8.550  -0.149
  423    HE2  TYR  52           HE1      TYR  52 -11.297 -11.254   2.249
  424    HH   TYR  52           HH       TYR  52 -13.714 -10.868   2.277
  425    H    ASP  53           HN       ASP  53  -7.827  -7.452  -3.385
  426    HA   ASP  53           HA       ASP  53  -5.372  -5.961  -2.814
  427    HB2  ASP  53           HB2      ASP  53  -5.647  -8.067  -4.356
  428    HB3  ASP  53           HB1      ASP  53  -6.482  -6.982  -5.435
  429    H    GLU  54           HN       GLU  54  -5.978  -3.856  -2.625
  430    HA   GLU  54           HA       GLU  54  -8.490  -2.991  -3.931
  431    HB2  GLU  54           HB2      GLU  54  -8.607  -3.595  -1.498
  432    HB3  GLU  54           HB1      GLU  54  -7.469  -2.305  -1.179
  433    HG2  GLU  54           HG2      GLU  54  -9.076  -0.668  -1.885
  434    HG3  GLU  54           HG1      GLU  54 -10.207  -1.930  -2.375
  435    H    TRP  55           HN       TRP  55  -8.724  -0.651  -3.928
  436    HA   TRP  55           HA       TRP  55  -6.346   0.489  -5.166
  437    HB2  TRP  55           HB2      TRP  55  -9.260   1.196  -5.390
  438    HB3  TRP  55           HB1      TRP  55  -7.957   1.980  -6.275
  439    HD1  TRP  55           HD1      TRP  55  -9.879  -1.353  -6.122
  440    HE1  TRP  55           HE1      TRP  55  -9.455  -2.628  -8.328
  441    HE3  TRP  55           HE3      TRP  55  -6.316   1.687  -8.145
  442    HZ2  TRP  55           HZ2      TRP  55  -7.822  -2.370 -10.604
  443    HZ3  TRP  55           HZ3      TRP  55  -5.356   1.109 -10.315
  444    HH2  TRP  55           HH2      TRP  55  -6.085  -0.880 -11.532
  445    H    VAL  56           HN       VAL  56  -5.351   2.091  -4.300
  446    HA   VAL  56           HA       VAL  56  -6.639   3.890  -2.352
  447    HB   VAL  56           HB       VAL  56  -4.583   3.867  -0.985
  448   HG11  VAL  56          HG11      VAL  56  -6.289   2.390  -0.270
  449   HG12  VAL  56          HG12      VAL  56  -4.735   1.560  -0.093
  450   HG13  VAL  56          HG13      VAL  56  -5.801   1.163  -1.440
  451   HG21  VAL  56          HG21      VAL  56  -3.662   1.653  -2.807
  452   HG22  VAL  56          HG22      VAL  56  -2.837   2.209  -1.347
  453   HG23  VAL  56          HG23      VAL  56  -3.005   3.286  -2.734
  454    H    LYS  57           HN       LYS  57  -5.348   5.948  -2.175
  455    HA   LYS  57           HA       LYS  57  -3.909   6.524  -4.675
  456    HB2  LYS  57           HB2      LYS  57  -5.000   8.366  -2.539
  457    HB3  LYS  57           HB1      LYS  57  -4.122   8.910  -3.963
  458    HG2  LYS  57           HG2      LYS  57  -5.779   8.148  -5.409
  459    HG3  LYS  57           HG1      LYS  57  -6.622   7.272  -4.133
  460    HD2  LYS  57           HD2      LYS  57  -6.969   9.520  -3.015
  461    HD3  LYS  57           HD1      LYS  57  -6.386  10.249  -4.516
  462    HE2  LYS  57           HE2      LYS  57  -8.129   9.052  -5.754
  463    HE3  LYS  57           HE1      LYS  57  -8.731   8.386  -4.237
  464    HZ1  LYS  57           HZ1      LYS  57  -9.296  10.628  -3.523
  465    HZ2  LYS  57           HZ2      LYS  57  -9.988  10.268  -5.034
  466    HZ3  LYS  57           HZ3      LYS  57  -8.657  11.257  -4.969
  467    H    ALA  58           HN       ALA  58  -1.971   7.992  -4.410
  468    HA   ALA  58           HA       ALA  58  -0.031   6.702  -2.857
  469    HB1  ALA  58           HB1      ALA  58   0.123   9.474  -4.018
  470    HB2  ALA  58           HB2      ALA  58   0.381   7.987  -4.910
  471    HB3  ALA  58           HB3      ALA  58   1.486   8.423  -3.598
  472    H    ASP  59           HN       ASP  59  -1.988   9.494  -2.293
  473    HA   ASP  59           HA       ASP  59  -0.644  10.569  -0.005
  474    HB2  ASP  59           HB2      ASP  59  -3.520  10.941  -0.843
  475    HB3  ASP  59           HB1      ASP  59  -2.612  11.966   0.256
  476    H    ARG  60           HN       ARG  60  -2.661   7.907  -0.489
  477    HA   ARG  60           HA       ARG  60  -3.892   8.011   2.167
  478    HB2  ARG  60           HB2      ARG  60  -5.092   7.434  -0.128
  479    HB3  ARG  60           HB1      ARG  60  -4.360   5.874   0.103
  480    HG2  ARG  60           HG2      ARG  60  -6.612   5.851   0.944
  481    HG3  ARG  60           HG1      ARG  60  -5.475   5.675   2.286
  482    HD2  ARG  60           HD2      ARG  60  -5.690   8.042   2.812
  483    HD3  ARG  60           HD1      ARG  60  -6.761   8.262   1.433
  484    HE   ARG  60           HE       ARG  60  -7.682   6.309   3.236
  485   HH11  ARG  60          HH11      ARG  60  -7.327   9.795   2.820
  486   HH12  ARG  60          HH12      ARG  60  -8.721  10.221   3.695
  487   HH21  ARG  60          HH21      ARG  60  -9.697   6.894   4.443
  488   HH22  ARG  60          HH22      ARG  60 -10.094   8.536   4.603
  489    H    ILE  61           HN       ILE  61  -1.111   7.082   0.915
  490    HA   ILE  61           HA       ILE  61  -0.901   4.596   2.434
  491    HB   ILE  61           HB       ILE  61   0.729   5.612   0.079
  492   HG12  ILE  61          HG12      ILE  61  -1.298   3.385   0.241
  493   HG13  ILE  61          HG11      ILE  61  -1.497   4.918  -0.599
  494   HG21  ILE  61          HG21      ILE  61   2.083   4.250   1.578
  495   HG22  ILE  61          HG22      ILE  61   1.759   3.413   0.054
  496   HG23  ILE  61          HG23      ILE  61   0.861   2.975   1.505
  497   HD11  ILE  61          HD11      ILE  61  -1.001   3.133  -2.148
  498   HD12  ILE  61          HD12      ILE  61   0.471   2.757  -1.267
  499   HD13  ILE  61          HD13      ILE  61   0.326   4.301  -2.127
  500    H    ILE  62           HN       ILE  62   0.876   4.403   3.788
  501    HA   ILE  62           HA       ILE  62   2.463   6.831   4.235
  502    HB   ILE  62           HB       ILE  62   2.403   4.371   5.993
  503   HG12  ILE  62          HG12      ILE  62   1.230   5.788   7.719
  504   HG13  ILE  62          HG11      ILE  62   0.822   6.933   6.429
  505   HG21  ILE  62          HG21      ILE  62   3.556   5.754   7.649
  506   HG22  ILE  62          HG22      ILE  62   3.530   7.098   6.506
  507   HG23  ILE  62          HG23      ILE  62   4.428   5.637   6.114
  508   HD11  ILE  62          HD11      ILE  62  -1.052   5.510   6.943
  509   HD12  ILE  62          HD12      ILE  62  -0.052   4.070   6.771
  510   HD13  ILE  62          HD13      ILE  62  -0.436   5.058   5.349
  511    H    TRP  63           HN       TRP  63   4.086   6.635   2.868
  512    HA   TRP  63           HA       TRP  63   5.089   4.130   2.087
  513    HB2  TRP  63           HB2      TRP  63   6.030   6.946   1.495
  514    HB3  TRP  63           HB1      TRP  63   6.781   5.507   0.802
  515    HD1  TRP  63           HD1      TRP  63   3.591   7.605   0.590
  516    HE1  TRP  63           HE1      TRP  63   2.254   6.869  -1.465
  517    HE3  TRP  63           HE3      TRP  63   6.380   3.541  -0.743
  518    HZ2  TRP  63           HZ2      TRP  63   2.374   4.809  -3.427
  519    HZ3  TRP  63           HZ3      TRP  63   5.709   2.238  -2.719
  520    HH2  TRP  63           HH2      TRP  63   3.755   2.846  -4.024
  521    HA   PRO  64           HA       PRO  64   8.195   3.748   5.165
  522    HB2  PRO  64           HB2      PRO  64   9.925   2.246   3.337
  523    HB3  PRO  64           HB1      PRO  64   9.010   1.670   4.734
  524    HG2  PRO  64           HG2      PRO  64   8.311   0.995   2.226
  525    HG3  PRO  64           HG1      PRO  64   7.127   1.273   3.527
  526    HD2  PRO  64           HD2      PRO  64   8.003   3.159   1.365
  527    HD3  PRO  64           HD1      PRO  64   6.357   2.715   1.868
  528    H    LEU  65           HN       LEU  65  10.737   3.778   5.279
  529    HA   LEU  65           HA       LEU  65  12.463   5.010   5.467
  530    HB2  LEU  65           HB2      LEU  65  13.756   5.744   3.473
  531    HB3  LEU  65           HB1      LEU  65  13.396   4.042   3.622
  532    HG   LEU  65           HG       LEU  65  11.579   5.666   1.944
  533   HD11  LEU  65          HD11      LEU  65  13.842   6.443   1.423
  534   HD12  LEU  65          HD12      LEU  65  13.144   5.516   0.080
  535   HD13  LEU  65          HD13      LEU  65  14.350   4.774   1.149
  536   HD21  LEU  65          HD21      LEU  65  12.884   3.004   1.588
  537   HD22  LEU  65          HD22      LEU  65  11.369   3.599   0.825
  538   HD23  LEU  65          HD23      LEU  65  11.492   3.330   2.593
  539    H    ASP  66           HN       ASP  66  12.246   6.749   6.585
  540    HA   ASP  66           HA       ASP  66  12.598   8.964   7.065
  541    HB2  ASP  66           HB2      ASP  66  13.667   9.029   4.689
  542    HB3  ASP  66           HB1      ASP  66  12.114   9.677   4.205
  543    H    LYS  67           HN       LYS  67  10.065   8.184   4.875
  544    HA   LYS  67           HA       LYS  67   8.270  10.280   5.581
  545    HB2  LYS  67           HB2      LYS  67   8.399   8.741   3.452
  546    HB3  LYS  67           HB1      LYS  67   7.519   7.588   4.425
  547    HG2  LYS  67           HG2      LYS  67   6.534  10.344   3.671
  548    HG3  LYS  67           HG1      LYS  67   6.101   8.857   2.853
  549    HD2  LYS  67           HD2      LYS  67   5.096   8.043   4.970
  550    HD3  LYS  67           HD1      LYS  67   5.447   9.603   5.710
  551    HE2  LYS  67           HE2      LYS  67   3.642   9.062   3.343
  552    HE3  LYS  67           HE1      LYS  67   3.142   9.556   4.955
  553    HZ1  LYS  67           HZ1      LYS  67   4.292  11.707   4.570
  554    HZ2  LYS  67           HZ2      LYS  67   3.084  11.407   3.466
  555    HZ3  LYS  67           HZ3      LYS  67   4.673  11.210   3.001
  556    H    GLY  68           HN       GLY  68   7.926  10.332   7.745
  557    HA2  GLY  68           HA2      GLY  68   6.662   7.992   8.984
  558    HA3  GLY  68           HA1      GLY  68   7.997   8.809   9.795
  559    H    LEU  69           HN       LEU  69   5.630  10.355   7.859
  560    HA   LEU  69           HA       LEU  69   3.945  11.721   8.164
  561    HB2  LEU  69           HB2      LEU  69   4.054  10.542  10.831
  562    HB3  LEU  69           HB1      LEU  69   2.956  11.913  10.590
  563    HG   LEU  69           HG       LEU  69   1.631   9.946  10.468
  564   HD11  LEU  69          HD11      LEU  69   2.226  10.696   7.625
  565   HD12  LEU  69          HD12      LEU  69   1.097  11.494   8.715
  566   HD13  LEU  69          HD13      LEU  69   0.800   9.834   8.203
  567   HD21  LEU  69          HD21      LEU  69   3.386   8.273  10.292
  568   HD22  LEU  69          HD22      LEU  69   3.682   8.733   8.615
  569   HD23  LEU  69          HD23      LEU  69   2.150   7.990   9.064
  570    H    GLU  70           HN       GLU  70   4.562  13.544   7.692
  571    HA   GLU  70           HA       GLU  70   6.569  15.039   8.720
  572    HB2  GLU  70           HB2      GLU  70   5.535  16.947   7.461
  573    HB3  GLU  70           HB1      GLU  70   5.805  15.476   6.540
  574    HG2  GLU  70           HG2      GLU  70   3.509  14.852   7.023
  575    HG3  GLU  70           HG1      GLU  70   3.258  16.462   7.701
  576    H    HIS  71           HN       HIS  71   6.744  15.555  10.763
  577    HA   HIS  71           HA       HIS  71   4.910  17.464  11.942
  578    HB2  HIS  71           HB2      HIS  71   5.767  14.889  13.320
  579    HB3  HIS  71           HB1      HIS  71   5.062  16.250  14.168
  580    HD1  HIS  71           HD1      HIS  71   4.184  13.111  12.922
  581    HD2  HIS  71           HD2      HIS  71   2.315  16.810  12.922
  582    HE1  HIS  71           HE1      HIS  71   1.744  12.630  12.535
  583    HE2  HIS  71           HE2      HIS  71   0.632  14.834  12.886
  584    H    HIS  72           HN       HIS  72   6.044  18.782  13.474
  585    HA   HIS  72           HA       HIS  72   8.834  18.896  12.811
  586    HB2  HIS  72           HB2      HIS  72   7.568  20.995  12.984
  587    HB3  HIS  72           HB1      HIS  72   7.258  20.680  14.686
  588    HD1  HIS  72           HD1      HIS  72  10.339  21.049  12.439
  589    HD2  HIS  72           HD2      HIS  72   9.084  21.911  16.310
  590    HE1  HIS  72           HE1      HIS  72  12.252  22.206  13.532
  591    HE2  HIS  72           HE2      HIS  72  11.589  22.417  15.909
  592    H    HIS  73           HN       HIS  73   7.001  17.670  15.438
  593    HA   HIS  73           HA       HIS  73   9.321  17.421  17.145
  594    HB2  HIS  73           HB2      HIS  73   6.939  17.659  18.029
  595    HB3  HIS  73           HB1      HIS  73   6.653  16.012  17.474
  596    HD1  HIS  73           HD1      HIS  73   7.077  14.241  19.170
  597    HD2  HIS  73           HD2      HIS  73   9.107  17.750  20.047
  598    HE1  HIS  73           HE1      HIS  73   8.194  13.840  21.382
  599    HE2  HIS  73           HE2      HIS  73   9.223  16.051  21.981
  600    H    HIS  74           HN       HIS  74   8.608  16.066  14.388
  601    HA   HIS  74           HA       HIS  74   9.753  13.472  15.074
  602    HB2  HIS  74           HB2      HIS  74   7.501  13.334  13.990
  603    HB3  HIS  74           HB1      HIS  74   8.124  14.256  12.631
  604    HD1  HIS  74           HD1      HIS  74   8.312  10.873  14.228
  605    HD2  HIS  74           HD2      HIS  74   9.539  12.780  10.752
  606    HE1  HIS  74           HE1      HIS  74   9.074   9.043  12.679
  607    HE2  HIS  74           HE2      HIS  74  10.152  10.284  10.796
  608    H    HIS  75           HN       HIS  75  11.784  14.480  15.185
  609    HA   HIS  75           HA       HIS  75  12.733  15.388  12.594
  610    HB2  HIS  75           HB2      HIS  75  12.787  17.182  14.288
  611    HB3  HIS  75           HB1      HIS  75  13.854  16.195  15.282
  612    HD1  HIS  75           HD1      HIS  75  13.833  17.672  11.771
  613    HD2  HIS  75           HD2      HIS  75  16.502  16.648  14.795
  614    HE1  HIS  75           HE1      HIS  75  16.078  18.313  10.918
  615    HE2  HIS  75           HE2      HIS  75  17.705  17.624  12.717
  616    H    HIS  76           HN       HIS  76  13.778  14.033  11.592
  617    HA   HIS  76           HA       HIS  76  15.849  12.529  12.951
  618    HB2  HIS  76           HB2      HIS  76  14.030  10.973  12.450
  619    HB3  HIS  76           HB1      HIS  76  13.957  11.555  10.795
  620    HD1  HIS  76           HD1      HIS  76  15.352  10.310   9.144
  621    HD2  HIS  76           HD2      HIS  76  16.525   9.545  13.041
  622    HE1  HIS  76           HE1      HIS  76  17.041   8.459   8.987
  623    HE2  HIS  76           HE2      HIS  76  18.007   8.400  11.288
  Start of MODEL    9
    1    H1   GLU   1           HT1      GLU   1  21.609  -0.173  -9.253
    2    H2   GLU   1           HT2      GLU   1  22.402   0.711 -10.466
    3    H3   GLU   1           HT3      GLU   1  21.636  -0.772 -10.824
    4    HA   GLU   1           HA       GLU   1  20.265   1.612  -9.793
    5    HB2  GLU   1           HB2      GLU   1  20.480   0.586 -12.639
    6    HB3  GLU   1           HB1      GLU   1  19.228   1.699 -12.119
    7    HG2  GLU   1           HG2      GLU   1  20.933   2.965 -13.206
    8    HG3  GLU   1           HG1      GLU   1  21.024   3.315 -11.488
    9    H    ASP   2           HN       ASP   2  18.060   1.371  -9.525
   10    HA   ASP   2           HA       ASP   2  17.068  -1.389  -9.782
   11    HB2  ASP   2           HB2      ASP   2  16.623   0.531  -7.492
   12    HB3  ASP   2           HB1      ASP   2  15.665  -0.914  -7.745
   13    H    MET   3           HN       MET   3  15.001  -1.581 -10.472
   14    HA   MET   3           HA       MET   3  13.383   0.829 -10.707
   15    HB2  MET   3           HB2      MET   3  12.630   0.257 -12.952
   16    HB3  MET   3           HB1      MET   3  14.378   0.418 -12.968
   17    HG2  MET   3           HG2      MET   3  14.654  -1.981 -13.039
   18    HG3  MET   3           HG1      MET   3  12.927  -2.218 -12.790
   19    HE1  MET   3           HE1      MET   3  14.682  -0.381 -16.660
   20    HE2  MET   3           HE2      MET   3  15.681  -0.920 -15.316
   21    HE3  MET   3           HE3      MET   3  14.612   0.472 -15.118
   22    H    GLU   4           HN       GLU   4  11.322   0.448 -10.122
   23    HA   GLU   4           HA       GLU   4  10.675  -2.230  -9.298
   24    HB2  GLU   4           HB2      GLU   4   8.999   0.294  -9.194
   25    HB3  GLU   4           HB1      GLU   4   8.583  -1.240  -8.457
   26    HG2  GLU   4           HG2      GLU   4   9.338   0.078  -6.680
   27    HG3  GLU   4           HG1      GLU   4  10.711  -0.950  -7.092
   28    HA   PRO   5           HA       PRO   5   8.806  -3.375 -13.173
   29    HB2  PRO   5           HB2      PRO   5   6.585  -4.514 -11.536
   30    HB3  PRO   5           HB1      PRO   5   7.582  -5.286 -12.780
   31    HG2  PRO   5           HG2      PRO   5   7.977  -5.823 -10.200
   32    HG3  PRO   5           HG1      PRO   5   9.333  -5.692 -11.327
   33    HD2  PRO   5           HD2      PRO   5   8.391  -3.756  -9.260
   34    HD3  PRO   5           HD1      PRO   5  10.042  -4.123  -9.802
   35    H    CYS   6           HN       CYS   6   6.245  -2.681 -10.873
   36    HA   CYS   6           HA       CYS   6   5.620  -0.208 -12.190
   37    HB2  CYS   6           HB2      CYS   6   3.136  -0.792 -12.247
   38    HB3  CYS   6           HB1      CYS   6   4.123  -1.551 -13.487
   39    HG   CYS   6           HG       CYS   6   4.204  -3.766 -11.257
   40    H    LEU   7           HN       LEU   7   6.890  -0.430 -10.028
   41    HA   LEU   7           HA       LEU   7   7.132   0.275  -7.930
   42    HB2  LEU   7           HB2      LEU   7   4.197   1.020  -8.108
   43    HB3  LEU   7           HB1      LEU   7   5.153   1.320  -6.674
   44    HG   LEU   7           HG       LEU   7   6.657   2.777  -8.107
   45   HD11  LEU   7          HD11      LEU   7   5.756   3.677 -10.193
   46   HD12  LEU   7          HD12      LEU   7   4.433   2.510 -10.120
   47   HD13  LEU   7          HD13      LEU   7   6.087   1.948 -10.309
   48   HD21  LEU   7          HD21      LEU   7   3.779   3.601  -7.882
   49   HD22  LEU   7          HD22      LEU   7   5.158   4.683  -8.074
   50   HD23  LEU   7          HD23      LEU   7   4.993   3.719  -6.606
   51    H    THR   8           HN       THR   8   5.904  -2.308  -8.827
   52    HA   THR   8           HA       THR   8   4.456  -3.607  -6.874
   53    HB   THR   8           HB       THR   8   6.446  -4.930  -8.662
   54    HG1  THR   8           HG1      THR   8   3.923  -3.889  -9.415
   55   HG21  THR   8          HG21      THR   8   4.552  -6.504  -8.908
   56   HG22  THR   8          HG22      THR   8   3.588  -5.398  -7.914
   57   HG23  THR   8          HG23      THR   8   4.945  -6.256  -7.190
   58    H    GLY   9           HN       GLY   9   5.038  -4.706  -5.071
   59    HA2  GLY   9           HA2      GLY   9   6.476  -6.194  -3.890
   60    HA3  GLY   9           HA1      GLY   9   7.855  -5.446  -4.682
   61    H    THR  10           HN       THR  10   6.600  -2.785  -4.087
   62    HA   THR  10           HA       THR  10   8.029  -2.215  -1.739
   63    HB   THR  10           HB       THR  10   5.761  -0.606  -2.832
   64    HG1  THR  10           HG1      THR  10   6.912  -0.658  -4.663
   65   HG21  THR  10          HG21      THR  10   8.374   0.167  -1.505
   66   HG22  THR  10          HG22      THR  10   6.773   0.231  -0.773
   67   HG23  THR  10          HG23      THR  10   7.175   1.310  -2.110
   68    H    LYS  11           HN       LYS  11   7.435  -2.711   0.240
   69    HA   LYS  11           HA       LYS  11   4.640  -3.278   0.836
   70    HB2  LYS  11           HB2      LYS  11   6.948  -3.552   2.779
   71    HB3  LYS  11           HB1      LYS  11   5.355  -4.298   2.865
   72    HG2  LYS  11           HG2      LYS  11   5.912  -5.645   0.865
   73    HG3  LYS  11           HG1      LYS  11   7.532  -4.958   0.892
   74    HD2  LYS  11           HD2      LYS  11   7.644  -5.857   3.315
   75    HD3  LYS  11           HD1      LYS  11   6.231  -6.812   2.854
   76    HE2  LYS  11           HE2      LYS  11   8.905  -6.859   1.478
   77    HE3  LYS  11           HE1      LYS  11   8.285  -8.094   2.569
   78    HZ1  LYS  11           HZ1      LYS  11   7.112  -7.354  -0.064
   79    HZ2  LYS  11           HZ2      LYS  11   6.525  -8.559   0.954
   80    HZ3  LYS  11           HZ3      LYS  11   8.042  -8.696   0.263
   81    H    VAL  12           HN       VAL  12   3.430  -1.789   1.581
   82    HA   VAL  12           HA       VAL  12   4.634   0.611   2.761
   83    HB   VAL  12           HB       VAL  12   2.811   1.907   1.677
   84   HG11  VAL  12          HG11      VAL  12   3.743   1.873  -0.592
   85   HG12  VAL  12          HG12      VAL  12   4.535   0.341  -0.234
   86   HG13  VAL  12          HG13      VAL  12   5.011   1.800   0.633
   87   HG21  VAL  12          HG21      VAL  12   2.239  -0.680   0.212
   88   HG22  VAL  12          HG22      VAL  12   1.519   0.886  -0.156
   89   HG23  VAL  12          HG23      VAL  12   1.181   0.100   1.385
   90    H    LYS  13           HN       LYS  13   2.689   1.945   3.708
   91    HA   LYS  13           HA       LYS  13   1.073   0.118   5.324
   92    HB2  LYS  13           HB2      LYS  13   3.033   1.339   6.409
   93    HB3  LYS  13           HB1      LYS  13   2.153   2.809   6.035
   94    HG2  LYS  13           HG2      LYS  13   0.354   2.142   7.484
   95    HG3  LYS  13           HG1      LYS  13   1.185   0.636   7.875
   96    HD2  LYS  13           HD2      LYS  13   3.111   1.982   8.615
   97    HD3  LYS  13           HD1      LYS  13   2.115   3.439   8.444
   98    HE2  LYS  13           HE2      LYS  13   1.768   2.952  10.672
   99    HE3  LYS  13           HE1      LYS  13   0.479   2.028   9.883
  100    HZ1  LYS  13           HZ1      LYS  13   3.062   0.965  10.826
  101    HZ2  LYS  13           HZ2      LYS  13   1.967   0.021  10.002
  102    HZ3  LYS  13           HZ3      LYS  13   1.573   0.670  11.516
  103    H    VAL  14           HN       VAL  14  -1.070   0.786   5.462
  104    HA   VAL  14           HA       VAL  14  -1.792   3.035   3.713
  105    HB   VAL  14           HB       VAL  14  -3.300   0.414   3.993
  106   HG11  VAL  14          HG11      VAL  14  -4.627   1.210   2.090
  107   HG12  VAL  14          HG12      VAL  14  -3.738   2.737   2.150
  108   HG13  VAL  14          HG13      VAL  14  -4.767   2.270   3.499
  109   HG21  VAL  14          HG21      VAL  14  -1.606   1.379   1.688
  110   HG22  VAL  14          HG22      VAL  14  -2.599  -0.081   1.703
  111   HG23  VAL  14          HG23      VAL  14  -1.216   0.056   2.786
  112    H    LYS  15           HN       LYS  15  -3.396   4.329   4.425
  113    HA   LYS  15           HA       LYS  15  -4.597   3.778   7.057
  114    HB2  LYS  15           HB2      LYS  15  -2.822   5.474   7.170
  115    HB3  LYS  15           HB1      LYS  15  -3.604   6.361   5.863
  116    HG2  LYS  15           HG2      LYS  15  -5.529   6.776   7.318
  117    HG3  LYS  15           HG1      LYS  15  -4.740   5.909   8.627
  118    HD2  LYS  15           HD2      LYS  15  -3.646   8.379   7.282
  119    HD3  LYS  15           HD1      LYS  15  -4.516   8.367   8.813
  120    HE2  LYS  15           HE2      LYS  15  -2.760   6.941   9.785
  121    HE3  LYS  15           HE1      LYS  15  -1.901   6.962   8.249
  122    HZ1  LYS  15           HZ1      LYS  15  -2.478   9.358   9.902
  123    HZ2  LYS  15           HZ2      LYS  15  -1.598   9.324   8.452
  124    HZ3  LYS  15           HZ3      LYS  15  -1.009   8.558   9.812
  125    H    TYR  16           HN       TYR  16  -6.713   3.318   6.423
  126    HA   TYR  16           HA       TYR  16  -7.909   5.119   4.412
  127    HB2  TYR  16           HB2      TYR  16  -6.956   2.790   3.620
  128    HB3  TYR  16           HB1      TYR  16  -8.427   2.175   4.346
  129    HD1  TYR  16           HD1      TYR  16 -10.282   4.465   3.506
  130    HD2  TYR  16           HD2      TYR  16  -7.320   2.268   1.418
  131    HE1  TYR  16           HE1      TYR  16 -11.445   4.934   1.385
  132    HE2  TYR  16           HE2      TYR  16  -8.472   2.728  -0.720
  133    HH   TYR  16           HH       TYR  16 -10.727   3.299  -1.456
  134    H    GLY  17           HN       GLY  17  -9.718   5.968   5.445
  135    HA2  GLY  17           HA2      GLY  17 -11.802   4.325   6.120
  136    HA3  GLY  17           HA1      GLY  17 -11.057   4.751   7.635
  137    H    ARG  18           HN       ARG  18 -13.506   5.467   7.409
  138    HA   ARG  18           HA       ARG  18 -13.426   8.309   6.755
  139    HB2  ARG  18           HB2      ARG  18 -15.828   8.207   6.220
  140    HB3  ARG  18           HB1      ARG  18 -14.915   7.114   5.205
  141    HG2  ARG  18           HG2      ARG  18 -15.636   5.234   6.698
  142    HG3  ARG  18           HG1      ARG  18 -16.643   6.366   7.568
  143    HD2  ARG  18           HD2      ARG  18 -17.764   6.919   5.400
  144    HD3  ARG  18           HD1      ARG  18 -16.861   5.594   4.664
  145    HE   ARG  18           HE       ARG  18 -18.852   5.339   6.807
  146   HH11  ARG  18          HH11      ARG  18 -17.028   3.807   4.148
  147   HH12  ARG  18          HH12      ARG  18 -18.003   2.427   4.119
  148   HH21  ARG  18          HH21      ARG  18 -20.163   3.409   6.740
  149   HH22  ARG  18          HH22      ARG  18 -19.800   2.190   5.619
  150    H    GLY  19           HN       GLY  19 -13.168   9.333   8.585
  151    HA2  GLY  19           HA2      GLY  19 -13.814  10.238  10.595
  152    HA3  GLY  19           HA1      GLY  19 -15.141   9.085  10.661
  153    H    LYS  20           HN       LYS  20 -14.988   7.477  12.054
  154    HA   LYS  20           HA       LYS  20 -12.470   7.192  13.472
  155    HB2  LYS  20           HB2      LYS  20 -14.563   7.613  14.751
  156    HB3  LYS  20           HB1      LYS  20 -15.208   6.096  14.154
  157    HG2  LYS  20           HG2      LYS  20 -13.492   4.864  15.320
  158    HG3  LYS  20           HG1      LYS  20 -12.743   6.366  15.852
  159    HD2  LYS  20           HD2      LYS  20 -14.788   6.926  17.087
  160    HD3  LYS  20           HD1      LYS  20 -15.502   5.401  16.570
  161    HE2  LYS  20           HE2      LYS  20 -14.603   5.237  18.839
  162    HE3  LYS  20           HE1      LYS  20 -13.741   4.170  17.732
  163    HZ1  LYS  20           HZ1      LYS  20 -12.280   5.392  19.269
  164    HZ2  LYS  20           HZ2      LYS  20 -12.781   6.848  18.587
  165    HZ3  LYS  20           HZ3      LYS  20 -11.928   5.740  17.657
  166    H    THR  21           HN       THR  21 -14.132   5.701  10.982
  167    HA   THR  21           HA       THR  21 -13.345   2.970  11.550
  168    HB   THR  21           HB       THR  21 -14.220   2.496   9.270
  169    HG1  THR  21           HG1      THR  21 -15.107   5.166   9.109
  170   HG21  THR  21          HG21      THR  21 -16.023   4.220  10.954
  171   HG22  THR  21          HG22      THR  21 -15.827   2.462  11.100
  172   HG23  THR  21          HG23      THR  21 -16.544   3.173   9.645
  173    H    GLN  22           HN       GLN  22 -11.249   4.909  11.476
  174    HA   GLN  22           HA       GLN  22  -9.841   4.615   8.953
  175    HB2  GLN  22           HB2      GLN  22  -9.887   6.696  10.536
  176    HB3  GLN  22           HB1      GLN  22  -8.694   5.787  11.451
  177    HG2  GLN  22           HG2      GLN  22  -7.293   5.634   9.447
  178    HG3  GLN  22           HG1      GLN  22  -8.468   6.604   8.566
  179   HE21  GLN  22          HE21      GLN  22  -7.154   8.294   8.169
  180   HE22  GLN  22          HE22      GLN  22  -6.554   9.350   9.403
  181    H    LYS  23           HN       LYS  23  -9.215   2.653   8.635
  182    HA   LYS  23           HA       LYS  23  -7.791   1.385  10.811
  183    HB2  LYS  23           HB2      LYS  23  -8.006  -0.789   9.512
  184    HB3  LYS  23           HB1      LYS  23  -9.522  -0.119  10.058
  185    HG2  LYS  23           HG2      LYS  23  -8.617   0.396   7.275
  186    HG3  LYS  23           HG1      LYS  23  -9.310  -1.164   7.716
  187    HD2  LYS  23           HD2      LYS  23 -11.260   0.057   8.667
  188    HD3  LYS  23           HD1      LYS  23 -10.592   1.547   8.001
  189    HE2  LYS  23           HE2      LYS  23 -11.256  -0.901   6.452
  190    HE3  LYS  23           HE1      LYS  23 -12.353   0.478   6.606
  191    HZ1  LYS  23           HZ1      LYS  23 -11.243   0.737   4.549
  192    HZ2  LYS  23           HZ2      LYS  23  -9.748   0.335   5.144
  193    HZ3  LYS  23           HZ3      LYS  23 -10.451   1.812   5.582
  194    H    ILE  24           HN       ILE  24  -5.767   1.083  10.773
  195    HA   ILE  24           HA       ILE  24  -4.351   1.810   8.338
  196    HB   ILE  24           HB       ILE  24  -3.396   1.964  11.236
  197   HG12  ILE  24          HG12      ILE  24  -3.028   4.416  10.689
  198   HG13  ILE  24          HG11      ILE  24  -3.885   4.143   9.184
  199   HG21  ILE  24          HG21      ILE  24  -1.309   2.892  10.342
  200   HG22  ILE  24          HG22      ILE  24  -1.865   2.516   8.708
  201   HG23  ILE  24          HG23      ILE  24  -1.584   1.216   9.866
  202   HD11  ILE  24          HD11      ILE  24  -5.912   3.612  10.446
  203   HD12  ILE  24          HD12      ILE  24  -5.306   5.215  10.865
  204   HD13  ILE  24          HD13      ILE  24  -5.044   3.857  11.956
  205    H    TYR  25           HN       TYR  25  -3.530   0.253   7.342
  206    HA   TYR  25           HA       TYR  25  -2.625  -2.126   8.708
  207    HB2  TYR  25           HB2      TYR  25  -3.702  -3.396   6.638
  208    HB3  TYR  25           HB1      TYR  25  -4.603  -3.105   8.110
  209    HD1  TYR  25           HD2      TYR  25  -4.110  -0.345   5.649
  210    HD2  TYR  25           HD1      TYR  25  -6.694  -3.452   6.975
  211    HE1  TYR  25           HE2      TYR  25  -5.976   0.632   4.324
  212    HE2  TYR  25           HE1      TYR  25  -8.530  -2.486   5.688
  213    HH   TYR  25           HH       TYR  25  -8.149  -0.251   3.262
  214    H    GLU  26           HN       GLU  26  -1.328  -3.530   7.227
  215    HA   GLU  26           HA       GLU  26   0.138  -1.735   5.460
  216    HB2  GLU  26           HB2      GLU  26   1.243  -3.826   7.331
  217    HB3  GLU  26           HB1      GLU  26   2.197  -3.096   6.038
  218    HG2  GLU  26           HG2      GLU  26   1.869  -0.924   6.954
  219    HG3  GLU  26           HG1      GLU  26   0.832  -1.555   8.230
  220    H    ALA  27           HN       ALA  27   0.876  -2.385   3.538
  221    HA   ALA  27           HA       ALA  27  -0.032  -4.962   2.548
  222    HB1  ALA  27           HB1      ALA  27  -1.934  -3.390   2.336
  223    HB2  ALA  27           HB2      ALA  27  -1.366  -3.997   0.800
  224    HB3  ALA  27           HB3      ALA  27  -0.971  -2.363   1.276
  225    H    SER  28           HN       SER  28   0.400  -4.782  -0.041
  226    HA   SER  28           HA       SER  28   3.017  -3.570  -0.413
  227    HB2  SER  28           HB2      SER  28   3.804  -5.682  -1.514
  228    HB3  SER  28           HB1      SER  28   3.561  -5.830   0.227
  229    HG   SER  28           HG       SER  28   1.381  -6.638  -0.409
  230    H    ILE  29           HN       ILE  29   3.288  -2.745  -2.359
  231    HA   ILE  29           HA       ILE  29   0.993  -2.244  -3.962
  232    HB   ILE  29           HB       ILE  29   3.891  -1.774  -4.641
  233   HG12  ILE  29          HG12      ILE  29   3.317  -0.630  -2.528
  234   HG13  ILE  29          HG11      ILE  29   3.603   0.525  -3.817
  235   HG21  ILE  29          HG21      ILE  29   1.383  -0.606  -5.771
  236   HG22  ILE  29          HG22      ILE  29   2.522  -1.706  -6.565
  237   HG23  ILE  29          HG23      ILE  29   3.019  -0.048  -6.177
  238   HD11  ILE  29          HD11      ILE  29   1.148   0.786  -4.053
  239   HD12  ILE  29          HD12      ILE  29   1.760   1.232  -2.467
  240   HD13  ILE  29          HD13      ILE  29   0.930  -0.297  -2.679
  241    H    LYS  30           HN       LYS  30   0.218  -3.355  -5.676
  242    HA   LYS  30           HA       LYS  30   1.980  -5.348  -6.850
  243    HB2  LYS  30           HB2      LYS  30  -0.608  -5.668  -6.103
  244    HB3  LYS  30           HB1      LYS  30  -0.852  -5.156  -7.765
  245    HG2  LYS  30           HG2      LYS  30   0.834  -7.516  -6.892
  246    HG3  LYS  30           HG1      LYS  30  -0.797  -7.612  -7.538
  247    HD2  LYS  30           HD2      LYS  30   1.490  -6.395  -9.076
  248    HD3  LYS  30           HD1      LYS  30   1.122  -8.116  -9.129
  249    HE2  LYS  30           HE2      LYS  30  -0.828  -5.921  -9.844
  250    HE3  LYS  30           HE1      LYS  30   0.160  -6.800 -11.011
  251    HZ1  LYS  30           HZ1      LYS  30  -1.854  -8.055  -9.206
  252    HZ2  LYS  30           HZ2      LYS  30  -0.923  -8.840 -10.337
  253    HZ3  LYS  30           HZ3      LYS  30  -2.079  -7.724 -10.837
  254    H    SER  31           HN       SER  31  -0.438  -2.904  -7.949
  255    HA   SER  31           HA       SER  31   1.413  -2.012  -9.987
  256    HB2  SER  31           HB2      SER  31  -1.353  -3.058 -10.665
  257    HB3  SER  31           HB1      SER  31  -0.260  -2.253 -11.792
  258    HG   SER  31           HG       SER  31   1.231  -3.962 -11.400
  259    H    THR  32           HN       THR  32   0.497  -0.016 -11.094
  260    HA   THR  32           HA       THR  32  -1.407   1.408  -9.366
  261    HB   THR  32           HB       THR  32   0.908   2.817 -10.617
  262    HG1  THR  32           HG1      THR  32   1.945   1.229  -9.346
  263   HG21  THR  32          HG21      THR  32  -0.695   3.237  -8.130
  264   HG22  THR  32          HG22      THR  32  -0.920   4.042  -9.682
  265   HG23  THR  32          HG23      THR  32   0.560   4.307  -8.752
  266    H    GLU  33           HN       GLU  33  -2.637   2.949 -10.524
  267    HA   GLU  33           HA       GLU  33  -1.913   3.615 -13.206
  268    HB2  GLU  33           HB2      GLU  33  -3.926   3.027 -14.248
  269    HB3  GLU  33           HB1      GLU  33  -3.204   1.610 -13.431
  270    HG2  GLU  33           HG2      GLU  33  -4.846   1.648 -11.742
  271    HG3  GLU  33           HG1      GLU  33  -5.492   3.189 -12.309
  272    H    ILE  34           HN       ILE  34  -3.459   5.257 -14.086
  273    HA   ILE  34           HA       ILE  34  -4.235   6.966 -11.854
  274    HB   ILE  34           HB       ILE  34  -3.277   7.719 -14.619
  275   HG12  ILE  34          HG12      ILE  34  -1.500   9.020 -13.367
  276   HG13  ILE  34          HG11      ILE  34  -2.129   8.295 -11.892
  277   HG21  ILE  34          HG21      ILE  34  -4.303   9.576 -12.476
  278   HG22  ILE  34          HG22      ILE  34  -5.075   9.223 -14.019
  279   HG23  ILE  34          HG23      ILE  34  -3.539  10.090 -13.982
  280   HD11  ILE  34          HD11      ILE  34  -0.101   7.181 -12.611
  281   HD12  ILE  34          HD12      ILE  34  -0.850   6.812 -14.176
  282   HD13  ILE  34          HD13      ILE  34  -1.496   6.101 -12.706
  283    H    ASP  35           HN       ASP  35  -6.267   7.590 -11.767
  284    HA   ASP  35           HA       ASP  35  -7.964   7.340 -14.134
  285    HB2  ASP  35           HB2      ASP  35  -8.445   5.304 -12.904
  286    HB3  ASP  35           HB1      ASP  35  -8.680   6.215 -11.415
  287    H    ASP  36           HN       ASP  36  -8.697   9.216 -14.519
  288    HA   ASP  36           HA       ASP  36  -9.732  11.198 -14.418
  289    HB2  ASP  36           HB2      ASP  36 -11.408   9.771 -13.101
  290    HB3  ASP  36           HB1      ASP  36 -10.703  10.476 -11.656
  291    H    GLY  37           HN       GLY  37  -7.048  10.804 -13.270
  292    HA2  GLY  37           HA2      GLY  37  -5.608  12.684 -12.869
  293    HA3  GLY  37           HA1      GLY  37  -6.930  13.454 -12.010
  294    H    GLU  38           HN       GLU  38  -7.179  10.524 -10.741
  295    HA   GLU  38           HA       GLU  38  -5.109  11.110  -8.778
  296    HB2  GLU  38           HB2      GLU  38  -6.462   9.865  -7.101
  297    HB3  GLU  38           HB1      GLU  38  -7.294  11.275  -7.723
  298    HG2  GLU  38           HG2      GLU  38  -8.637   9.817  -9.166
  299    HG3  GLU  38           HG1      GLU  38  -7.803   8.411  -8.503
  300    H    VAL  39           HN       VAL  39  -3.911   9.414  -7.887
  301    HA   VAL  39           HA       VAL  39  -3.492   7.312  -9.884
  302    HB   VAL  39           HB       VAL  39  -1.631   7.950  -7.610
  303   HG11  VAL  39          HG11      VAL  39   0.085   7.039  -9.161
  304   HG12  VAL  39          HG12      VAL  39  -1.197   6.683 -10.316
  305   HG13  VAL  39          HG13      VAL  39  -1.172   5.882  -8.769
  306   HG21  VAL  39          HG21      VAL  39  -1.920  10.070  -8.700
  307   HG22  VAL  39          HG22      VAL  39  -1.723   9.345 -10.282
  308   HG23  VAL  39          HG23      VAL  39  -0.352   9.415  -9.173
  309    H    LEU  40           HN       LEU  40  -4.197   5.421  -9.441
  310    HA   LEU  40           HA       LEU  40  -4.837   4.729  -6.689
  311    HB2  LEU  40           HB2      LEU  40  -6.047   3.767  -9.267
  312    HB3  LEU  40           HB1      LEU  40  -6.480   3.190  -7.668
  313    HG   LEU  40           HG       LEU  40  -6.867   5.992  -8.704
  314   HD11  LEU  40          HD11      LEU  40  -9.239   5.462  -8.589
  315   HD12  LEU  40          HD12      LEU  40  -8.849   3.804  -8.118
  316   HD13  LEU  40          HD13      LEU  40  -8.393   4.398  -9.712
  317   HD21  LEU  40          HD21      LEU  40  -6.392   5.988  -6.315
  318   HD22  LEU  40          HD22      LEU  40  -7.612   4.753  -6.049
  319   HD23  LEU  40          HD23      LEU  40  -8.086   6.362  -6.602
  320    H    TYR  41           HN       TYR  41  -3.956   3.138  -5.866
  321    HA   TYR  41           HA       TYR  41  -2.113   1.426  -7.374
  322    HB2  TYR  41           HB2      TYR  41  -2.253   2.194  -4.460
  323    HB3  TYR  41           HB1      TYR  41  -1.184   0.952  -5.087
  324    HD1  TYR  41           HD2      TYR  41  -2.004   4.571  -5.453
  325    HD2  TYR  41           HD1      TYR  41   0.916   1.520  -5.808
  326    HE1  TYR  41           HE2      TYR  41  -0.287   6.261  -5.900
  327    HE2  TYR  41           HE1      TYR  41   2.633   3.191  -6.229
  328    HH   TYR  41           HH       TYR  41   2.816   5.376  -7.014
  329    H    LEU  42           HN       LEU  42  -2.270  -0.729  -7.089
  330    HA   LEU  42           HA       LEU  42  -4.592  -1.688  -5.586
  331    HB2  LEU  42           HB2      LEU  42  -4.609  -2.362  -7.938
  332    HB3  LEU  42           HB1      LEU  42  -2.984  -3.002  -7.786
  333    HG   LEU  42           HG       LEU  42  -3.805  -4.712  -6.221
  334   HD11  LEU  42          HD11      LEU  42  -5.712  -3.547  -5.271
  335   HD12  LEU  42          HD12      LEU  42  -6.214  -5.084  -5.967
  336   HD13  LEU  42          HD13      LEU  42  -6.529  -3.583  -6.831
  337   HD21  LEU  42          HD21      LEU  42  -3.636  -5.219  -8.588
  338   HD22  LEU  42          HD22      LEU  42  -5.273  -4.606  -8.844
  339   HD23  LEU  42          HD23      LEU  42  -5.011  -6.050  -7.860
  340    H    VAL  43           HN       VAL  43  -4.048  -2.367  -3.683
  341    HA   VAL  43           HA       VAL  43  -1.308  -3.340  -3.339
  342    HB   VAL  43           HB       VAL  43  -2.205  -1.067  -2.356
  343   HG11  VAL  43          HG11      VAL  43  -2.873  -1.055  -0.103
  344   HG12  VAL  43          HG12      VAL  43  -3.274  -2.776  -0.257
  345   HG13  VAL  43          HG13      VAL  43  -4.061  -1.589  -1.277
  346   HG21  VAL  43          HG21      VAL  43  -0.368  -2.835  -0.814
  347   HG22  VAL  43          HG22      VAL  43  -0.508  -1.048  -0.683
  348   HG23  VAL  43          HG23      VAL  43  -0.008  -1.811  -2.174
  349    H    HIS  44           HN       HIS  44  -1.020  -5.096  -1.995
  350    HA   HIS  44           HA       HIS  44  -3.484  -6.472  -1.173
  351    HB2  HIS  44           HB2      HIS  44  -0.915  -7.710  -2.181
  352    HB3  HIS  44           HB1      HIS  44  -2.221  -8.625  -1.444
  353    HD1  HIS  44           HD1      HIS  44  -1.022  -7.753  -4.630
  354    HD2  HIS  44           HD2      HIS  44  -4.781  -8.010  -2.935
  355    HE1  HIS  44           HE1      HIS  44  -2.622  -7.910  -6.558
  356    HE2  HIS  44           HE2      HIS  44  -4.906  -7.826  -5.477
  357    H    TYR  45           HN       TYR  45  -3.695  -6.995   0.815
  358    HA   TYR  45           HA       TYR  45  -1.771  -5.937   2.663
  359    HB2  TYR  45           HB2      TYR  45  -4.538  -7.076   3.097
  360    HB3  TYR  45           HB1      TYR  45  -3.550  -6.292   4.329
  361    HD1  TYR  45           HD1      TYR  45  -3.149  -3.908   4.254
  362    HD2  TYR  45           HD2      TYR  45  -5.623  -5.773   1.364
  363    HE1  TYR  45           HE1      TYR  45  -3.967  -1.714   3.549
  364    HE2  TYR  45           HE2      TYR  45  -6.470  -3.573   0.650
  365    HH   TYR  45           HH       TYR  45  -6.659  -1.190   1.578
  366    H    TYR  46           HN       TYR  46  -0.151  -7.184   3.051
  367    HA   TYR  46           HA       TYR  46  -0.385 -10.016   3.280
  368    HB2  TYR  46           HB2      TYR  46   1.850  -8.059   3.543
  369    HB3  TYR  46           HB1      TYR  46   2.051  -9.657   4.244
  370    HD1  TYR  46           HD2      TYR  46   0.216  -8.902   1.086
  371    HD2  TYR  46           HD1      TYR  46   3.749 -10.463   2.861
  372    HE1  TYR  46           HE2      TYR  46   0.902  -9.822  -1.092
  373    HE2  TYR  46           HE1      TYR  46   4.440 -11.384   0.716
  374    HH   TYR  46           HH       TYR  46   3.485 -12.062  -1.345
  375    H    GLY  47           HN       GLY  47  -1.880 -10.293   4.819
  376    HA2  GLY  47           HA2      GLY  47  -0.820 -10.260   7.516
  377    HA3  GLY  47           HA1      GLY  47  -2.339  -9.409   7.234
  378    H    TRP  48           HN       TRP  48  -4.037 -10.582   7.713
  379    HA   TRP  48           HA       TRP  48  -3.780 -13.470   7.600
  380    HB2  TRP  48           HB2      TRP  48  -6.042 -11.766   8.663
  381    HB3  TRP  48           HB1      TRP  48  -5.947 -13.525   8.776
  382    HD1  TRP  48           HD1      TRP  48  -5.026 -10.473  10.623
  383    HE1  TRP  48           HE1      TRP  48  -3.454 -11.034  12.576
  384    HE3  TRP  48           HE3      TRP  48  -3.818 -15.259   9.338
  385    HZ2  TRP  48           HZ2      TRP  48  -1.891 -13.211  13.455
  386    HZ3  TRP  48           HZ3      TRP  48  -2.272 -16.511  10.771
  387    HH2  TRP  48           HH2      TRP  48  -1.327 -15.512  12.794
  388    H    ASN  49           HN       ASN  49  -5.623 -10.884   6.147
  389    HA   ASN  49           HA       ASN  49  -6.429 -12.809   4.099
  390    HB2  ASN  49           HB2      ASN  49  -8.421 -12.148   5.360
  391    HB3  ASN  49           HB1      ASN  49  -8.033 -10.446   5.107
  392   HD21  ASN  49          HD21      ASN  49 -10.022 -10.113   4.103
  393   HD22  ASN  49          HD22      ASN  49 -10.343 -10.633   2.495
  394    H    VAL  50           HN       VAL  50  -5.333 -12.440   2.391
  395    HA   VAL  50           HA       VAL  50  -4.180  -9.836   1.850
  396    HB   VAL  50           HB       VAL  50  -3.940 -12.424   0.276
  397   HG11  VAL  50          HG11      VAL  50  -1.890 -11.462  -0.632
  398   HG12  VAL  50          HG12      VAL  50  -2.185  -9.982   0.279
  399   HG13  VAL  50          HG13      VAL  50  -3.295 -10.459  -1.004
  400   HG21  VAL  50          HG21      VAL  50  -3.173 -12.776   2.558
  401   HG22  VAL  50          HG22      VAL  50  -2.133 -11.355   2.442
  402   HG23  VAL  50          HG23      VAL  50  -1.806 -12.772   1.444
  403    H    ARG  51           HN       ARG  51  -6.837 -11.774   0.961
  404    HA   ARG  51           HA       ARG  51  -7.214 -10.864  -1.703
  405    HB2  ARG  51           HB2      ARG  51  -8.931 -12.516   0.121
  406    HB3  ARG  51           HB1      ARG  51  -9.442 -12.059  -1.494
  407    HG2  ARG  51           HG2      ARG  51  -6.935 -13.608  -0.862
  408    HG3  ARG  51           HG1      ARG  51  -8.464 -14.325  -1.391
  409    HD2  ARG  51           HD2      ARG  51  -8.339 -13.085  -3.485
  410    HD3  ARG  51           HD1      ARG  51  -6.859 -12.296  -2.963
  411    HE   ARG  51           HE       ARG  51  -6.651 -15.120  -2.920
  412   HH11  ARG  51          HH11      ARG  51  -6.560 -12.345  -5.123
  413   HH12  ARG  51          HH12      ARG  51  -5.524 -13.087  -6.242
  414   HH21  ARG  51          HH21      ARG  51  -5.218 -16.122  -4.455
  415   HH22  ARG  51          HH22      ARG  51  -4.720 -15.285  -5.851
  416    H    TYR  52           HN       TYR  52  -7.518  -8.959   0.801
  417    HA   TYR  52           HA       TYR  52 -10.054  -7.766   0.455
  418    HB2  TYR  52           HB2      TYR  52  -7.433  -6.602   1.359
  419    HB3  TYR  52           HB1      TYR  52  -8.842  -5.574   1.150
  420    HD1  TYR  52           HD2      TYR  52 -10.954  -6.258   2.466
  421    HD2  TYR  52           HD1      TYR  52  -7.058  -7.686   3.380
  422    HE1  TYR  52           HE2      TYR  52 -11.699  -6.810   4.742
  423    HE2  TYR  52           HE1      TYR  52  -7.796  -8.238   5.662
  424    HH   TYR  52           HH       TYR  52  -9.488  -7.635   7.212
  425    H    ASP  53           HN       ASP  53  -7.026  -7.386  -1.238
  426    HA   ASP  53           HA       ASP  53  -6.382  -6.344  -3.193
  427    HB2  ASP  53           HB2      ASP  53  -7.760  -8.363  -3.871
  428    HB3  ASP  53           HB1      ASP  53  -9.120  -7.283  -4.095
  429    H    GLU  54           HN       GLU  54  -6.349  -4.137  -2.502
  430    HA   GLU  54           HA       GLU  54  -8.858  -2.705  -3.036
  431    HB2  GLU  54           HB2      GLU  54  -8.359  -3.169  -0.577
  432    HB3  GLU  54           HB1      GLU  54  -6.961  -2.125  -0.794
  433    HG2  GLU  54           HG2      GLU  54  -8.259  -0.214  -1.039
  434    HG3  GLU  54           HG1      GLU  54  -9.735  -1.143  -1.324
  435    H    TRP  55           HN       TRP  55  -8.847  -0.774  -3.818
  436    HA   TRP  55           HA       TRP  55  -6.372   0.127  -5.048
  437    HB2  TRP  55           HB2      TRP  55  -9.269   0.651  -5.706
  438    HB3  TRP  55           HB1      TRP  55  -7.905   1.391  -6.539
  439    HD1  TRP  55           HD1      TRP  55  -9.507  -2.090  -5.989
  440    HE1  TRP  55           HE1      TRP  55  -8.818  -3.586  -8.008
  441    HE3  TRP  55           HE3      TRP  55  -6.259   1.095  -8.293
  442    HZ2  TRP  55           HZ2      TRP  55  -7.113  -3.405 -10.248
  443    HZ3  TRP  55           HZ3      TRP  55  -5.130   0.369 -10.334
  444    HH2  TRP  55           HH2      TRP  55  -5.538  -1.812 -11.294
  445    H    VAL  56           HN       VAL  56  -5.438   1.552  -3.891
  446    HA   VAL  56           HA       VAL  56  -7.031   3.558  -2.487
  447    HB   VAL  56           HB       VAL  56  -6.272   1.993  -0.848
  448   HG11  VAL  56          HG11      VAL  56  -3.537   2.243  -2.050
  449   HG12  VAL  56          HG12      VAL  56  -4.572   0.805  -1.944
  450   HG13  VAL  56          HG13      VAL  56  -3.863   1.494  -0.487
  451   HG21  VAL  56          HG21      VAL  56  -4.456   4.395  -0.743
  452   HG22  VAL  56          HG22      VAL  56  -4.848   3.337   0.616
  453   HG23  VAL  56          HG23      VAL  56  -6.112   4.306  -0.143
  454    H    LYS  57           HN       LYS  57  -6.162   5.646  -2.320
  455    HA   LYS  57           HA       LYS  57  -4.527   6.457  -4.499
  456    HB2  LYS  57           HB2      LYS  57  -6.000   7.849  -2.344
  457    HB3  LYS  57           HB1      LYS  57  -4.695   8.723  -3.130
  458    HG2  LYS  57           HG2      LYS  57  -5.737   8.272  -5.288
  459    HG3  LYS  57           HG1      LYS  57  -7.080   7.483  -4.449
  460    HD2  LYS  57           HD2      LYS  57  -6.276  10.316  -3.849
  461    HD3  LYS  57           HD1      LYS  57  -7.370   9.946  -5.174
  462    HE2  LYS  57           HE2      LYS  57  -7.813   9.246  -2.270
  463    HE3  LYS  57           HE1      LYS  57  -8.572  10.584  -3.135
  464    HZ1  LYS  57           HZ1      LYS  57 -10.158   8.916  -3.233
  465    HZ2  LYS  57           HZ2      LYS  57  -9.026   7.701  -3.422
  466    HZ3  LYS  57           HZ3      LYS  57  -9.372   8.705  -4.728
  467    H    ALA  58           HN       ALA  58  -2.698   7.823  -4.341
  468    HA   ALA  58           HA       ALA  58  -0.541   6.563  -3.093
  469    HB1  ALA  58           HB1      ALA  58  -0.523   7.960  -5.177
  470    HB2  ALA  58           HB2      ALA  58   0.811   8.198  -4.058
  471    HB3  ALA  58           HB3      ALA  58  -0.509   9.374  -4.121
  472    H    ASP  59           HN       ASP  59  -2.278   9.464  -2.226
  473    HA   ASP  59           HA       ASP  59  -0.471  10.030  -0.018
  474    HB2  ASP  59           HB2      ASP  59  -2.976  11.473  -0.903
  475    HB3  ASP  59           HB1      ASP  59  -1.949  11.993   0.424
  476    H    ARG  60           HN       ARG  60  -2.900   7.993  -0.474
  477    HA   ARG  60           HA       ARG  60  -4.022   8.168   2.218
  478    HB2  ARG  60           HB2      ARG  60  -4.910   7.327  -0.394
  479    HB3  ARG  60           HB1      ARG  60  -5.062   5.999   0.737
  480    HG2  ARG  60           HG2      ARG  60  -6.090   8.678   1.522
  481    HG3  ARG  60           HG1      ARG  60  -7.021   7.679   0.400
  482    HD2  ARG  60           HD2      ARG  60  -7.155   5.905   1.963
  483    HD3  ARG  60           HD1      ARG  60  -5.970   6.663   3.017
  484    HE   ARG  60           HE       ARG  60  -7.625   7.665   4.038
  485   HH11  ARG  60          HH11      ARG  60  -8.790   7.223   0.706
  486   HH12  ARG  60          HH12      ARG  60 -10.338   7.825   0.990
  487   HH21  ARG  60          HH21      ARG  60  -9.802   8.474   4.461
  488   HH22  ARG  60          HH22      ARG  60 -10.953   8.522   3.229
  489    H    ILE  61           HN       ILE  61  -1.352   7.125   0.956
  490    HA   ILE  61           HA       ILE  61  -1.134   4.645   2.470
  491    HB   ILE  61           HB       ILE  61   0.274   5.524  -0.091
  492   HG12  ILE  61          HG12      ILE  61  -1.703   3.277   0.348
  493   HG13  ILE  61          HG11      ILE  61  -2.031   4.790  -0.484
  494   HG21  ILE  61          HG21      ILE  61   1.330   3.339  -0.124
  495   HG22  ILE  61          HG22      ILE  61   0.584   2.963   1.431
  496   HG23  ILE  61          HG23      ILE  61   1.777   4.263   1.315
  497   HD11  ILE  61          HD11      ILE  61  -0.358   4.181  -2.189
  498   HD12  ILE  61          HD12      ILE  61  -1.702   3.046  -2.083
  499   HD13  ILE  61          HD13      ILE  61  -0.148   2.614  -1.383
  500    H    ILE  62           HN       ILE  62   0.915   4.487   3.589
  501    HA   ILE  62           HA       ILE  62   2.353   7.017   3.917
  502    HB   ILE  62           HB       ILE  62   2.393   4.590   5.757
  503   HG12  ILE  62          HG12      ILE  62   1.378   6.282   7.451
  504   HG13  ILE  62          HG11      ILE  62   0.916   7.199   6.027
  505   HG21  ILE  62          HG21      ILE  62   4.500   5.766   5.773
  506   HG22  ILE  62          HG22      ILE  62   3.664   5.926   7.318
  507   HG23  ILE  62          HG23      ILE  62   3.667   7.270   6.182
  508   HD11  ILE  62          HD11      ILE  62  -0.920   5.863   6.798
  509   HD12  ILE  62          HD12      ILE  62   0.064   4.405   6.724
  510   HD13  ILE  62          HD13      ILE  62  -0.373   5.250   5.234
  511    H    TRP  63           HN       TRP  63   4.019   7.016   2.647
  512    HA   TRP  63           HA       TRP  63   5.167   4.549   1.715
  513    HB2  TRP  63           HB2      TRP  63   5.641   7.424   0.958
  514    HB3  TRP  63           HB1      TRP  63   6.514   6.066   0.244
  515    HD1  TRP  63           HD1      TRP  63   3.072   7.709   0.316
  516    HE1  TRP  63           HE1      TRP  63   1.664   6.750  -1.584
  517    HE3  TRP  63           HE3      TRP  63   6.257   4.044  -1.222
  518    HZ2  TRP  63           HZ2      TRP  63   1.890   4.692  -3.515
  519    HZ3  TRP  63           HZ3      TRP  63   5.593   2.617  -3.110
  520    HH2  TRP  63           HH2      TRP  63   3.456   2.934  -4.228
  521    HA   PRO  64           HA       PRO  64   8.445   4.949   4.732
  522    HB2  PRO  64           HB2      PRO  64   9.523   2.571   3.367
  523    HB3  PRO  64           HB1      PRO  64   9.053   2.760   5.060
  524    HG2  PRO  64           HG2      PRO  64   7.598   1.259   3.379
  525    HG3  PRO  64           HG1      PRO  64   6.854   2.251   4.653
  526    HD2  PRO  64           HD2      PRO  64   7.113   2.833   1.724
  527    HD3  PRO  64           HD1      PRO  64   5.712   3.026   2.807
  528    H    LEU  65           HN       LEU  65   9.830   6.398   4.293
  529    HA   LEU  65           HA       LEU  65  12.084   6.201   2.706
  530    HB2  LEU  65           HB2      LEU  65  10.143   6.579   0.919
  531    HB3  LEU  65           HB1      LEU  65  10.127   8.208   1.547
  532    HG   LEU  65           HG       LEU  65  11.365   8.099  -0.543
  533   HD11  LEU  65          HD11      LEU  65  13.215   8.574   1.770
  534   HD12  LEU  65          HD12      LEU  65  12.157   9.754   0.996
  535   HD13  LEU  65          HD13      LEU  65  13.515   9.066   0.104
  536   HD21  LEU  65          HD21      LEU  65  13.144   6.125   0.848
  537   HD22  LEU  65          HD22      LEU  65  13.438   6.823  -0.747
  538   HD23  LEU  65          HD23      LEU  65  12.031   5.789  -0.475
  539    H    ASP  66           HN       ASP  66  12.669   6.817   4.808
  540    HA   ASP  66           HA       ASP  66  13.469   8.304   6.333
  541    HB2  ASP  66           HB2      ASP  66  14.016   9.864   4.540
  542    HB3  ASP  66           HB1      ASP  66  12.339  10.366   4.431
  543    H    LYS  67           HN       LYS  67  10.597  10.014   5.324
  544    HA   LYS  67           HA       LYS  67   8.729  10.708   6.255
  545    HB2  LYS  67           HB2      LYS  67   8.577   8.059   6.295
  546    HB3  LYS  67           HB1      LYS  67   8.537   8.326   8.032
  547    HG2  LYS  67           HG2      LYS  67   6.284   8.154   7.151
  548    HG3  LYS  67           HG1      LYS  67   6.577   9.785   7.761
  549    HD2  LYS  67           HD2      LYS  67   6.970  10.586   5.475
  550    HD3  LYS  67           HD1      LYS  67   6.769   8.947   4.862
  551    HE2  LYS  67           HE2      LYS  67   4.458   8.952   5.586
  552    HE3  LYS  67           HE1      LYS  67   4.657  10.554   6.292
  553    HZ1  LYS  67           HZ1      LYS  67   5.035  11.453   4.102
  554    HZ2  LYS  67           HZ2      LYS  67   3.612  10.577   4.059
  555    HZ3  LYS  67           HZ3      LYS  67   5.008   9.931   3.412
  556    H    GLY  68           HN       GLY  68   8.491  12.348   7.523
  557    HA2  GLY  68           HA2      GLY  68  10.206  12.545   9.860
  558    HA3  GLY  68           HA1      GLY  68   9.346  13.860   9.081
  559    H    LEU  69           HN       LEU  69   8.872  10.998  11.084
  560    HA   LEU  69           HA       LEU  69   6.402  12.122  12.151
  561    HB2  LEU  69           HB2      LEU  69   7.864   9.580  12.907
  562    HB3  LEU  69           HB1      LEU  69   6.383  10.114  13.664
  563    HG   LEU  69           HG       LEU  69   5.763   8.420  12.204
  564   HD11  LEU  69          HD11      LEU  69   4.264  10.279  12.086
  565   HD12  LEU  69          HD12      LEU  69   4.342   9.450  10.532
  566   HD13  LEU  69          HD13      LEU  69   5.187  10.980  10.755
  567   HD21  LEU  69          HD21      LEU  69   7.414   9.722  10.050
  568   HD22  LEU  69          HD22      LEU  69   6.375   8.316   9.824
  569   HD23  LEU  69          HD23      LEU  69   7.776   8.214  10.889
  570    H    GLU  70           HN       GLU  70   6.362  13.451  13.743
  571    HA   GLU  70           HA       GLU  70   6.789  14.669  15.542
  572    HB2  GLU  70           HB2      GLU  70   8.674  12.432  16.313
  573    HB3  GLU  70           HB1      GLU  70   8.304  13.799  17.360
  574    HG2  GLU  70           HG2      GLU  70   6.326  11.773  16.320
  575    HG3  GLU  70           HG1      GLU  70   6.969  11.851  17.962
  576    H    HIS  71           HN       HIS  71   9.522  13.603  13.817
  577    HA   HIS  71           HA       HIS  71  10.775  16.230  14.171
  578    HB2  HIS  71           HB2      HIS  71  12.061  13.683  13.116
  579    HB3  HIS  71           HB1      HIS  71  12.873  15.206  13.448
  580    HD1  HIS  71           HD1      HIS  71  13.534  15.666  15.894
  581    HD2  HIS  71           HD2      HIS  71  11.469  12.111  15.356
  582    HE1  HIS  71           HE1      HIS  71  13.779  14.415  18.043
  583    HE2  HIS  71           HE2      HIS  71  12.193  12.469  17.770
  584    H    HIS  72           HN       HIS  72   9.243  17.035  12.640
  585    HA   HIS  72           HA       HIS  72   9.430  15.840   9.978
  586    HB2  HIS  72           HB2      HIS  72   7.156  16.101  10.948
  587    HB3  HIS  72           HB1      HIS  72   7.391  17.844  10.972
  588    HD1  HIS  72           HD1      HIS  72   6.183  18.903   9.077
  589    HD2  HIS  72           HD2      HIS  72   7.658  15.156   8.060
  590    HE1  HIS  72           HE1      HIS  72   5.520  18.530   6.675
  591    HE2  HIS  72           HE2      HIS  72   6.521  16.309   6.059
  592    H    HIS  73           HN       HIS  73   9.714  18.925  11.644
  593    HA   HIS  73           HA       HIS  73  10.376  20.415   9.310
  594    HB2  HIS  73           HB2      HIS  73   9.533  21.484  11.399
  595    HB3  HIS  73           HB1      HIS  73  11.023  21.023  12.210
  596    HD1  HIS  73           HD1      HIS  73  12.566  22.950  12.407
  597    HD2  HIS  73           HD2      HIS  73  10.293  23.151   8.936
  598    HE1  HIS  73           HE1      HIS  73  13.261  25.063  11.267
  599    HE2  HIS  73           HE2      HIS  73  11.997  25.064   9.087
  600    H    HIS  74           HN       HIS  74  12.268  19.005  11.887
  601    HA   HIS  74           HA       HIS  74  14.565  19.086  10.100
  602    HB2  HIS  74           HB2      HIS  74  14.997  20.447  12.064
  603    HB3  HIS  74           HB1      HIS  74  14.527  19.134  13.131
  604    HD1  HIS  74           HD1      HIS  74  16.581  18.266  14.227
  605    HD2  HIS  74           HD2      HIS  74  17.269  19.271  10.259
  606    HE1  HIS  74           HE1      HIS  74  18.948  17.638  13.782
  607    HE2  HIS  74           HE2      HIS  74  19.402  18.656  11.545
  608    H    HIS  75           HN       HIS  75  14.162  17.247   9.147
  609    HA   HIS  75           HA       HIS  75  14.057  14.879  10.835
  610    HB2  HIS  75           HB2      HIS  75  13.005  13.652   8.914
  611    HB3  HIS  75           HB1      HIS  75  12.018  14.954   9.547
  612    HD1  HIS  75           HD1      HIS  75  12.790  13.467   6.520
  613    HD2  HIS  75           HD2      HIS  75  12.567  17.425   7.723
  614    HE1  HIS  75           HE1      HIS  75  12.471  14.804   4.416
  615    HE2  HIS  75           HE2      HIS  75  12.047  17.135   5.228
  616    H    HIS  76           HN       HIS  76  16.148  14.770  11.153
  617    HA   HIS  76           HA       HIS  76  17.678  13.325   9.266
  618    HB2  HIS  76           HB2      HIS  76  18.034  15.722   8.497
  619    HB3  HIS  76           HB1      HIS  76  18.670  16.080  10.097
  620    HD1  HIS  76           HD1      HIS  76  21.061  15.095  10.661
  621    HD2  HIS  76           HD2      HIS  76  19.771  14.410   6.769
  622    HE1  HIS  76           HE1      HIS  76  23.099  14.445   9.386
  623    HE2  HIS  76           HE2      HIS  76  22.274  13.857   7.089
  Start of MODEL   10
    1    H1   GLU   1           HT1      GLU   1  19.354  -8.574 -18.799
    2    H2   GLU   1           HT2      GLU   1  18.520  -9.853 -18.123
    3    H3   GLU   1           HT3      GLU   1  20.188  -9.835 -18.035
    4    HA   GLU   1           HA       GLU   1  19.139  -9.230 -15.958
    5    HB2  GLU   1           HB2      GLU   1  20.576  -6.968 -17.360
    6    HB3  GLU   1           HB1      GLU   1  20.197  -6.957 -15.646
    7    HG2  GLU   1           HG2      GLU   1  21.900  -9.028 -17.019
    8    HG3  GLU   1           HG1      GLU   1  22.515  -7.636 -16.128
    9    H    ASP   2           HN       ASP   2  16.933  -9.262 -16.017
   10    HA   ASP   2           HA       ASP   2  15.791  -6.641 -15.905
   11    HB2  ASP   2           HB2      ASP   2  15.254  -7.175 -18.209
   12    HB3  ASP   2           HB1      ASP   2  14.608  -8.745 -17.744
   13    H    MET   3           HN       MET   3  15.771  -6.985 -13.813
   14    HA   MET   3           HA       MET   3  13.370  -7.973 -12.781
   15    HB2  MET   3           HB2      MET   3  14.490 -10.176 -12.810
   16    HB3  MET   3           HB1      MET   3  15.869  -9.497 -11.951
   17    HG2  MET   3           HG2      MET   3  14.353  -8.967 -10.052
   18    HG3  MET   3           HG1      MET   3  13.063  -9.808 -10.904
   19    HE1  MET   3           HE1      MET   3  14.193 -10.303  -7.923
   20    HE2  MET   3           HE2      MET   3  14.131 -12.056  -7.828
   21    HE3  MET   3           HE3      MET   3  12.794 -11.167  -8.570
   22    H    GLU   4           HN       GLU   4  13.384  -5.794 -12.252
   23    HA   GLU   4           HA       GLU   4  15.368  -4.973 -10.302
   24    HB2  GLU   4           HB2      GLU   4  13.129  -3.410 -11.585
   25    HB3  GLU   4           HB1      GLU   4  14.318  -2.757 -10.479
   26    HG2  GLU   4           HG2      GLU   4  16.074  -3.365 -12.147
   27    HG3  GLU   4           HG1      GLU   4  14.771  -3.785 -13.264
   28    HA   PRO   5           HA       PRO   5  12.246  -5.595  -7.131
   29    HB2  PRO   5           HB2      PRO   5  13.962  -3.886  -5.452
   30    HB3  PRO   5           HB1      PRO   5  13.480  -5.565  -5.179
   31    HG2  PRO   5           HG2      PRO   5  16.008  -4.961  -5.851
   32    HG3  PRO   5           HG1      PRO   5  15.184  -6.411  -6.473
   33    HD2  PRO   5           HD2      PRO   5  15.611  -3.770  -7.839
   34    HD3  PRO   5           HD1      PRO   5  15.880  -5.419  -8.458
   35    H    CYS   6           HN       CYS   6  10.812  -4.272  -8.227
   36    HA   CYS   6           HA       CYS   6  11.065  -1.413  -8.212
   37    HB2  CYS   6           HB2      CYS   6   8.924  -3.254  -9.266
   38    HB3  CYS   6           HB1      CYS   6   9.036  -1.538  -9.599
   39    HG   CYS   6           HG       CYS   6   9.954  -2.420 -11.878
   40    H    LEU   7           HN       LEU   7   8.516  -0.534  -7.971
   41    HA   LEU   7           HA       LEU   7   8.021  -0.403  -5.248
   42    HB2  LEU   7           HB2      LEU   7   5.949   0.724  -5.760
   43    HB3  LEU   7           HB1      LEU   7   7.165   1.268  -6.881
   44    HG   LEU   7           HG       LEU   7   4.931  -0.681  -7.533
   45   HD11  LEU   7          HD11      LEU   7   3.970   1.169  -8.805
   46   HD12  LEU   7          HD12      LEU   7   5.251   2.228  -8.234
   47   HD13  LEU   7          HD13      LEU   7   4.091   1.553  -7.092
   48   HD21  LEU   7          HD21      LEU   7   6.912   0.684  -9.374
   49   HD22  LEU   7          HD22      LEU   7   5.550  -0.314  -9.882
   50   HD23  LEU   7          HD23      LEU   7   6.882  -1.038  -8.984
   51    H    THR   8           HN       THR   8   6.836  -2.633  -7.665
   52    HA   THR   8           HA       THR   8   4.827  -3.934  -6.331
   53    HB   THR   8           HB       THR   8   6.836  -5.197  -8.171
   54    HG1  THR   8           HG1      THR   8   5.098  -4.178  -9.713
   55   HG21  THR   8          HG21      THR   8   4.968  -6.577  -7.273
   56   HG22  THR   8          HG22      THR   8   4.840  -6.346  -9.016
   57   HG23  THR   8          HG23      THR   8   3.828  -5.396  -7.928
   58    H    GLY   9           HN       GLY   9   4.959  -5.044  -4.476
   59    HA2  GLY   9           HA2      GLY   9   5.761  -6.968  -3.277
   60    HA3  GLY   9           HA1      GLY   9   7.362  -6.663  -3.930
   61    H    THR  10           HN       THR  10   6.543  -3.708  -3.229
   62    HA   THR  10           HA       THR  10   7.997  -3.662  -0.754
   63    HB   THR  10           HB       THR  10   6.476  -1.446  -2.091
   64    HG1  THR  10           HG1      THR  10   7.844  -2.030  -3.614
   65   HG21  THR  10          HG21      THR  10   8.120   0.023  -1.007
   66   HG22  THR  10          HG22      THR  10   8.887  -1.382  -0.260
   67   HG23  THR  10          HG23      THR  10   7.234  -0.936   0.178
   68    H    LYS  11           HN       LYS  11   7.096  -3.715   1.214
   69    HA   LYS  11           HA       LYS  11   4.230  -3.456   1.300
   70    HB2  LYS  11           HB2      LYS  11   4.162  -4.583   3.438
   71    HB3  LYS  11           HB1      LYS  11   5.105  -5.532   2.320
   72    HG2  LYS  11           HG2      LYS  11   6.265  -5.761   4.304
   73    HG3  LYS  11           HG1      LYS  11   7.143  -4.444   3.529
   74    HD2  LYS  11           HD2      LYS  11   6.002  -2.812   4.889
   75    HD3  LYS  11           HD1      LYS  11   4.923  -4.044   5.543
   76    HE2  LYS  11           HE2      LYS  11   6.787  -5.137   6.632
   77    HE3  LYS  11           HE1      LYS  11   7.910  -3.973   5.925
   78    HZ1  LYS  11           HZ1      LYS  11   6.870  -2.236   7.208
   79    HZ2  LYS  11           HZ2      LYS  11   7.353  -3.486   8.231
   80    HZ3  LYS  11           HZ3      LYS  11   5.721  -3.302   7.837
   81    H    VAL  12           HN       VAL  12   3.230  -1.883   1.988
   82    HA   VAL  12           HA       VAL  12   4.680   0.302   3.341
   83    HB   VAL  12           HB       VAL  12   3.288   1.868   2.021
   84   HG11  VAL  12          HG11      VAL  12   4.833  -0.079   0.311
   85   HG12  VAL  12          HG12      VAL  12   5.510   1.293   1.185
   86   HG13  VAL  12          HG13      VAL  12   4.389   1.562  -0.149
   87   HG21  VAL  12          HG21      VAL  12   2.360  -0.599   0.532
   88   HG22  VAL  12          HG22      VAL  12   1.956   1.070   0.126
   89   HG23  VAL  12          HG23      VAL  12   1.376   0.361   1.631
   90    H    LYS  13           HN       LYS  13   2.849   1.919   4.113
   91    HA   LYS  13           HA       LYS  13   0.732   0.256   5.192
   92    HB2  LYS  13           HB2      LYS  13   2.082   2.619   6.431
   93    HB3  LYS  13           HB1      LYS  13   0.444   2.194   6.895
   94    HG2  LYS  13           HG2      LYS  13   1.197  -0.049   7.456
   95    HG3  LYS  13           HG1      LYS  13   2.862   0.411   7.072
   96    HD2  LYS  13           HD2      LYS  13   1.117   1.679   9.177
   97    HD3  LYS  13           HD1      LYS  13   2.363   0.465   9.488
   98    HE2  LYS  13           HE2      LYS  13   4.008   1.926   8.534
   99    HE3  LYS  13           HE1      LYS  13   2.771   3.172   8.272
  100    HZ1  LYS  13           HZ1      LYS  13   3.593   2.071  10.911
  101    HZ2  LYS  13           HZ2      LYS  13   2.396   3.202  10.690
  102    HZ3  LYS  13           HZ3      LYS  13   4.002   3.596  10.331
  103    H    VAL  14           HN       VAL  14  -1.258   0.912   5.202
  104    HA   VAL  14           HA       VAL  14  -1.863   3.027   3.263
  105    HB   VAL  14           HB       VAL  14  -3.234   0.374   3.704
  106   HG11  VAL  14          HG11      VAL  14  -3.931   2.512   1.692
  107   HG12  VAL  14          HG12      VAL  14  -4.745   2.277   3.231
  108   HG13  VAL  14          HG13      VAL  14  -4.801   0.998   2.019
  109   HG21  VAL  14          HG21      VAL  14  -2.576  -0.129   1.439
  110   HG22  VAL  14          HG22      VAL  14  -1.150   0.227   2.424
  111   HG23  VAL  14          HG23      VAL  14  -1.764   1.427   1.286
  112    H    LYS  15           HN       LYS  15  -3.135   4.513   4.054
  113    HA   LYS  15           HA       LYS  15  -4.622   4.007   6.534
  114    HB2  LYS  15           HB2      LYS  15  -2.940   5.806   6.511
  115    HB3  LYS  15           HB1      LYS  15  -3.770   6.565   5.160
  116    HG2  LYS  15           HG2      LYS  15  -5.719   6.932   6.592
  117    HG3  LYS  15           HG1      LYS  15  -4.859   6.192   7.940
  118    HD2  LYS  15           HD2      LYS  15  -3.946   8.650   6.440
  119    HD3  LYS  15           HD1      LYS  15  -4.760   8.663   8.003
  120    HE2  LYS  15           HE2      LYS  15  -2.895   7.358   8.955
  121    HE3  LYS  15           HE1      LYS  15  -2.100   7.380   7.386
  122    HZ1  LYS  15           HZ1      LYS  15  -1.226   9.032   8.866
  123    HZ2  LYS  15           HZ2      LYS  15  -2.737   9.792   8.983
  124    HZ3  LYS  15           HZ3      LYS  15  -1.921   9.757   7.520
  125    H    TYR  16           HN       TYR  16  -6.606   3.338   5.938
  126    HA   TYR  16           HA       TYR  16  -7.985   4.717   3.734
  127    HB2  TYR  16           HB2      TYR  16  -6.764   2.642   2.978
  128    HB3  TYR  16           HB1      TYR  16  -7.807   1.742   4.063
  129    HD1  TYR  16           HD1      TYR  16  -7.679   3.736   0.978
  130    HD2  TYR  16           HD2      TYR  16 -10.032   1.138   3.383
  131    HE1  TYR  16           HE1      TYR  16  -9.229   3.403  -0.904
  132    HE2  TYR  16           HE2      TYR  16 -11.591   0.813   1.513
  133    HH   TYR  16           HH       TYR  16 -10.784   1.753  -1.657
  134    H    GLY  17           HN       GLY  17  -9.717   5.522   4.787
  135    HA2  GLY  17           HA2      GLY  17 -11.719   3.850   5.586
  136    HA3  GLY  17           HA1      GLY  17 -10.927   4.415   7.049
  137    H    ARG  18           HN       ARG  18 -13.426   5.089   6.751
  138    HA   ARG  18           HA       ARG  18 -13.376   7.820   5.713
  139    HB2  ARG  18           HB2      ARG  18 -15.843   7.663   5.635
  140    HB3  ARG  18           HB1      ARG  18 -15.073   6.402   4.696
  141    HG2  ARG  18           HG2      ARG  18 -15.429   4.847   6.614
  142    HG3  ARG  18           HG1      ARG  18 -16.336   6.128   7.403
  143    HD2  ARG  18           HD2      ARG  18 -17.874   6.177   5.523
  144    HD3  ARG  18           HD1      ARG  18 -16.980   4.852   4.766
  145    HE   ARG  18           HE       ARG  18 -18.312   4.631   7.373
  146   HH11  ARG  18          HH11      ARG  18 -17.626   3.308   4.166
  147   HH12  ARG  18          HH12      ARG  18 -18.413   1.818   4.462
  148   HH21  ARG  18          HH21      ARG  18 -19.443   2.582   7.746
  149   HH22  ARG  18          HH22      ARG  18 -19.458   1.410   6.512
  150    H    GLY  19           HN       GLY  19 -12.731   9.121   7.248
  151    HA2  GLY  19           HA2      GLY  19 -12.815  10.449   9.113
  152    HA3  GLY  19           HA1      GLY  19 -14.434   9.831   9.382
  153    H    LYS  20           HN       LYS  20 -14.765   8.557  11.036
  154    HA   LYS  20           HA       LYS  20 -12.696   8.031  12.937
  155    HB2  LYS  20           HB2      LYS  20 -14.957   8.577  13.657
  156    HB3  LYS  20           HB1      LYS  20 -15.591   7.169  12.822
  157    HG2  LYS  20           HG2      LYS  20 -14.319   5.720  14.343
  158    HG3  LYS  20           HG1      LYS  20 -13.735   7.148  15.190
  159    HD2  LYS  20           HD2      LYS  20 -15.995   7.748  15.812
  160    HD3  LYS  20           HD1      LYS  20 -16.636   6.386  14.890
  161    HE2  LYS  20           HE2      LYS  20 -14.764   6.159  17.238
  162    HE3  LYS  20           HE1      LYS  20 -16.515   5.940  17.308
  163    HZ1  LYS  20           HZ1      LYS  20 -16.312   4.057  15.820
  164    HZ2  LYS  20           HZ2      LYS  20 -15.358   3.829  17.171
  165    HZ3  LYS  20           HZ3      LYS  20 -14.639   4.244  15.706
  166    H    THR  21           HN       THR  21 -14.270   6.268  10.423
  167    HA   THR  21           HA       THR  21 -13.516   3.639  11.309
  168    HB   THR  21           HB       THR  21 -14.635   4.543   8.631
  169    HG1  THR  21           HG1      THR  21 -16.575   4.787   9.629
  170   HG21  THR  21          HG21      THR  21 -15.728   2.357   8.637
  171   HG22  THR  21          HG22      THR  21 -15.099   2.014  10.243
  172   HG23  THR  21          HG23      THR  21 -13.993   2.127   8.871
  173    H    GLN  22           HN       GLN  22 -11.422   5.579  10.873
  174    HA   GLN  22           HA       GLN  22  -9.935   5.171   8.456
  175    HB2  GLN  22           HB2      GLN  22 -10.016   7.198   9.904
  176    HB3  GLN  22           HB1      GLN  22  -9.131   6.307  11.124
  177    HG2  GLN  22           HG2      GLN  22  -7.601   7.709  10.020
  178    HG3  GLN  22           HG1      GLN  22  -7.283   6.074   9.445
  179   HE21  GLN  22          HE21      GLN  22  -6.817   8.753   8.343
  180   HE22  GLN  22          HE22      GLN  22  -7.493   8.758   6.755
  181    H    LYS  23           HN       LYS  23  -8.919   3.201   8.110
  182    HA   LYS  23           HA       LYS  23  -7.654   1.887  10.418
  183    HB2  LYS  23           HB2      LYS  23  -8.628   0.708   7.817
  184    HB3  LYS  23           HB1      LYS  23  -7.620  -0.159   8.948
  185    HG2  LYS  23           HG2      LYS  23  -9.430  -0.031  10.597
  186    HG3  LYS  23           HG1      LYS  23 -10.440   0.789   9.376
  187    HD2  LYS  23           HD2      LYS  23 -10.089  -1.140   7.879
  188    HD3  LYS  23           HD1      LYS  23  -9.184  -1.926   9.177
  189    HE2  LYS  23           HE2      LYS  23 -12.037  -1.083   9.323
  190    HE3  LYS  23           HE1      LYS  23 -11.472  -2.702   8.891
  191    HZ1  LYS  23           HZ1      LYS  23 -11.068  -1.333  11.510
  192    HZ2  LYS  23           HZ2      LYS  23 -10.420  -2.830  11.096
  193    HZ3  LYS  23           HZ3      LYS  23 -12.086  -2.646  11.206
  194    H    ILE  24           HN       ILE  24  -5.438   1.695  10.365
  195    HA   ILE  24           HA       ILE  24  -4.092   2.211   7.818
  196    HB   ILE  24           HB       ILE  24  -2.953   2.167  10.631
  197   HG12  ILE  24          HG12      ILE  24  -3.506   4.583   8.906
  198   HG13  ILE  24          HG11      ILE  24  -4.609   4.010  10.154
  199   HG21  ILE  24          HG21      ILE  24  -1.753   3.110   8.016
  200   HG22  ILE  24          HG22      ILE  24  -1.299   1.648   8.889
  201   HG23  ILE  24          HG23      ILE  24  -0.984   3.233   9.599
  202   HD11  ILE  24          HD11      ILE  24  -2.907   4.288  11.799
  203   HD12  ILE  24          HD12      ILE  24  -3.239   5.822  10.975
  204   HD13  ILE  24          HD13      ILE  24  -1.769   4.898  10.592
  205    H    TYR  25           HN       TYR  25  -3.586   0.412   6.797
  206    HA   TYR  25           HA       TYR  25  -2.981  -2.059   8.336
  207    HB2  TYR  25           HB2      TYR  25  -3.402  -2.268   5.416
  208    HB3  TYR  25           HB1      TYR  25  -3.889  -3.355   6.687
  209    HD1  TYR  25           HD2      TYR  25  -6.145  -2.934   7.858
  210    HD2  TYR  25           HD1      TYR  25  -4.838  -0.716   4.457
  211    HE1  TYR  25           HE2      TYR  25  -8.445  -2.265   7.387
  212    HE2  TYR  25           HE1      TYR  25  -7.137  -0.083   3.983
  213    HH   TYR  25           HH       TYR  25  -9.329  -0.971   4.413
  214    H    GLU  26           HN       GLU  26  -1.280  -3.440   7.243
  215    HA   GLU  26           HA       GLU  26   0.598  -1.816   5.678
  216    HB2  GLU  26           HB2      GLU  26   1.060  -4.379   7.249
  217    HB3  GLU  26           HB1      GLU  26   2.256  -3.670   6.184
  218    HG2  GLU  26           HG2      GLU  26   2.363  -1.678   7.639
  219    HG3  GLU  26           HG1      GLU  26   1.163  -2.408   8.704
  220    H    ALA  27           HN       ALA  27   0.646  -2.247   3.618
  221    HA   ALA  27           HA       ALA  27  -0.427  -4.802   2.673
  222    HB1  ALA  27           HB1      ALA  27  -1.665  -3.680   0.892
  223    HB2  ALA  27           HB2      ALA  27  -1.048  -2.131   1.347
  224    HB3  ALA  27           HB3      ALA  27  -2.148  -2.984   2.433
  225    H    SER  28           HN       SER  28   0.083  -4.778   0.092
  226    HA   SER  28           HA       SER  28   2.851  -3.909  -0.138
  227    HB2  SER  28           HB2      SER  28   3.329  -6.113  -1.291
  228    HB3  SER  28           HB1      SER  28   3.148  -6.182   0.462
  229    HG   SER  28           HG       SER  28   0.777  -6.608  -0.238
  230    H    ILE  29           HN       ILE  29   3.342  -3.021  -1.941
  231    HA   ILE  29           HA       ILE  29   1.260  -2.203  -3.707
  232    HB   ILE  29           HB       ILE  29   4.254  -1.955  -4.123
  233   HG12  ILE  29          HG12      ILE  29   3.513  -0.940  -1.966
  234   HG13  ILE  29          HG11      ILE  29   4.124   0.244  -3.100
  235   HG21  ILE  29          HG21      ILE  29   3.648  -0.037  -5.560
  236   HG22  ILE  29          HG22      ILE  29   1.947  -0.440  -5.319
  237   HG23  ILE  29          HG23      ILE  29   3.007  -1.575  -6.161
  238   HD11  ILE  29          HD11      ILE  29   2.151   1.062  -1.929
  239   HD12  ILE  29          HD12      ILE  29   1.193  -0.284  -2.547
  240   HD13  ILE  29          HD13      ILE  29   1.851   0.917  -3.651
  241    H    LYS  30           HN       LYS  30   0.548  -3.105  -5.542
  242    HA   LYS  30           HA       LYS  30   2.175  -5.263  -6.649
  243    HB2  LYS  30           HB2      LYS  30  -0.105  -5.755  -5.474
  244    HB3  LYS  30           HB1      LYS  30  -0.820  -5.101  -6.932
  245    HG2  LYS  30           HG2      LYS  30   1.136  -7.396  -6.999
  246    HG3  LYS  30           HG1      LYS  30  -0.584  -7.636  -6.746
  247    HD2  LYS  30           HD2      LYS  30   0.601  -6.230  -9.127
  248    HD3  LYS  30           HD1      LYS  30   0.182  -7.948  -9.100
  249    HE2  LYS  30           HE2      LYS  30  -1.705  -5.628  -8.687
  250    HE3  LYS  30           HE1      LYS  30  -1.611  -6.633 -10.127
  251    HZ1  LYS  30           HZ1      LYS  30  -2.518  -7.464  -7.406
  252    HZ2  LYS  30           HZ2      LYS  30  -2.201  -8.557  -8.631
  253    HZ3  LYS  30           HZ3      LYS  30  -3.431  -7.447  -8.824
  254    H    SER  31           HN       SER  31  -0.084  -2.577  -7.452
  255    HA   SER  31           HA       SER  31   1.441  -1.982  -9.820
  256    HB2  SER  31           HB2      SER  31  -1.470  -2.834 -10.079
  257    HB3  SER  31           HB1      SER  31  -0.495  -2.138 -11.371
  258    HG   SER  31           HG       SER  31   0.829  -4.181 -10.325
  259    H    THR  32           HN       THR  32   0.397   0.055 -10.947
  260    HA   THR  32           HA       THR  32  -1.155   1.684  -9.048
  261    HB   THR  32           HB       THR  32   0.783   3.134 -10.700
  262    HG1  THR  32           HG1      THR  32   2.076   1.332 -10.053
  263   HG21  THR  32          HG21      THR  32   1.130   4.339  -8.642
  264   HG22  THR  32          HG22      THR  32   0.191   3.139  -7.768
  265   HG23  THR  32          HG23      THR  32  -0.596   4.157  -8.990
  266    H    GLU  33           HN       GLU  33  -2.673   2.928 -10.120
  267    HA   GLU  33           HA       GLU  33  -2.360   3.454 -12.934
  268    HB2  GLU  33           HB2      GLU  33  -4.773   1.943 -11.902
  269    HB3  GLU  33           HB1      GLU  33  -4.799   2.878 -13.387
  270    HG2  GLU  33           HG2      GLU  33  -2.942   1.545 -14.233
  271    HG3  GLU  33           HG1      GLU  33  -3.026   0.523 -12.799
  272    H    ILE  34           HN       ILE  34  -3.783   5.086 -13.701
  273    HA   ILE  34           HA       ILE  34  -4.521   6.860 -11.483
  274    HB   ILE  34           HB       ILE  34  -3.676   7.571 -14.302
  275   HG12  ILE  34          HG12      ILE  34  -1.887   8.954 -13.136
  276   HG13  ILE  34          HG11      ILE  34  -2.447   8.240 -11.636
  277   HG21  ILE  34          HG21      ILE  34  -4.637   9.457 -12.146
  278   HG22  ILE  34          HG22      ILE  34  -5.500   9.031 -13.615
  279   HG23  ILE  34          HG23      ILE  34  -3.990   9.947 -13.715
  280   HD11  ILE  34          HD11      ILE  34  -1.226   6.713 -13.918
  281   HD12  ILE  34          HD12      ILE  34  -1.748   6.080 -12.346
  282   HD13  ILE  34          HD13      ILE  34  -0.401   7.214 -12.431
  283    H    ASP  35           HN       ASP  35  -6.585   7.339 -11.314
  284    HA   ASP  35           HA       ASP  35  -8.318   6.698 -13.599
  285    HB2  ASP  35           HB2      ASP  35  -8.329   4.916 -11.778
  286    HB3  ASP  35           HB1      ASP  35  -9.049   6.120 -10.723
  287    H    ASP  36           HN       ASP  36  -8.923   8.554 -14.246
  288    HA   ASP  36           HA       ASP  36  -9.496  10.670 -14.423
  289    HB2  ASP  36           HB2      ASP  36 -11.707   9.690 -13.908
  290    HB3  ASP  36           HB1      ASP  36 -11.462  10.057 -12.207
  291    H    GLY  37           HN       GLY  37  -7.341  11.020 -13.607
  292    HA2  GLY  37           HA2      GLY  37  -6.146  12.889 -12.886
  293    HA3  GLY  37           HA1      GLY  37  -7.528  13.381 -11.935
  294    H    GLU  38           HN       GLU  38  -7.511  10.618 -10.592
  295    HA   GLU  38           HA       GLU  38  -5.331  11.351  -8.772
  296    HB2  GLU  38           HB2      GLU  38  -6.645  10.319  -6.949
  297    HB3  GLU  38           HB1      GLU  38  -7.473  11.675  -7.700
  298    HG2  GLU  38           HG2      GLU  38  -8.696   9.883  -9.070
  299    HG3  GLU  38           HG1      GLU  38  -8.081   8.749  -7.866
  300    H    VAL  39           HN       VAL  39  -4.128   9.711  -7.678
  301    HA   VAL  39           HA       VAL  39  -3.808   7.445  -9.500
  302    HB   VAL  39           HB       VAL  39  -1.818   8.208  -7.396
  303   HG11  VAL  39          HG11      VAL  39  -1.444   6.036  -8.370
  304   HG12  VAL  39          HG12      VAL  39  -0.176   7.102  -8.935
  305   HG13  VAL  39          HG13      VAL  39  -1.512   6.688  -9.993
  306   HG21  VAL  39          HG21      VAL  39  -2.142  10.246  -8.665
  307   HG22  VAL  39          HG22      VAL  39  -1.900   9.400 -10.185
  308   HG23  VAL  39          HG23      VAL  39  -0.571   9.556  -9.039
  309    H    LEU  40           HN       LEU  40  -4.214   5.561  -9.019
  310    HA   LEU  40           HA       LEU  40  -4.837   4.929  -6.246
  311    HB2  LEU  40           HB2      LEU  40  -5.842   3.615  -8.764
  312    HB3  LEU  40           HB1      LEU  40  -6.321   3.256  -7.120
  313    HG   LEU  40           HG       LEU  40  -6.934   5.775  -8.645
  314   HD11  LEU  40          HD11      LEU  40  -8.223   3.857  -9.368
  315   HD12  LEU  40          HD12      LEU  40  -9.240   5.001  -8.488
  316   HD13  LEU  40          HD13      LEU  40  -8.688   3.522  -7.700
  317   HD21  LEU  40          HD21      LEU  40  -8.286   6.382  -6.683
  318   HD22  LEU  40          HD22      LEU  40  -6.564   6.263  -6.324
  319   HD23  LEU  40          HD23      LEU  40  -7.648   4.965  -5.830
  320    H    TYR  41           HN       TYR  41  -3.843   3.271  -5.449
  321    HA   TYR  41           HA       TYR  41  -1.957   1.808  -7.132
  322    HB2  TYR  41           HB2      TYR  41  -2.023   2.368  -4.183
  323    HB3  TYR  41           HB1      TYR  41  -1.061   1.068  -4.851
  324    HD1  TYR  41           HD1      TYR  41  -1.581   4.745  -5.188
  325    HD2  TYR  41           HD2      TYR  41   1.109   1.482  -5.460
  326    HE1  TYR  41           HE1      TYR  41   0.305   6.312  -5.474
  327    HE2  TYR  41           HE2      TYR  41   2.992   3.037  -5.747
  328    HH   TYR  41           HH       TYR  41   2.691   6.305  -5.058
  329    H    LEU  42           HN       LEU  42  -1.964  -0.347  -6.977
  330    HA   LEU  42           HA       LEU  42  -4.380  -1.502  -5.835
  331    HB2  LEU  42           HB2      LEU  42  -3.980  -1.714  -8.306
  332    HB3  LEU  42           HB1      LEU  42  -2.488  -2.560  -7.948
  333    HG   LEU  42           HG       LEU  42  -3.753  -4.386  -6.940
  334   HD11  LEU  42          HD11      LEU  42  -6.206  -4.434  -7.190
  335   HD12  LEU  42          HD12      LEU  42  -6.165  -2.766  -7.768
  336   HD13  LEU  42          HD13      LEU  42  -5.675  -3.144  -6.117
  337   HD21  LEU  42          HD21      LEU  42  -4.755  -5.242  -8.989
  338   HD22  LEU  42          HD22      LEU  42  -3.215  -4.441  -9.312
  339   HD23  LEU  42          HD23      LEU  42  -4.732  -3.621  -9.682
  340    H    VAL  43           HN       VAL  43  -3.857  -2.114  -3.904
  341    HA   VAL  43           HA       VAL  43  -1.183  -3.232  -3.382
  342    HB   VAL  43           HB       VAL  43  -1.969  -0.879  -2.451
  343   HG11  VAL  43          HG11      VAL  43  -3.990  -1.322  -1.583
  344   HG12  VAL  43          HG12      VAL  43  -2.893  -0.742  -0.355
  345   HG13  VAL  43          HG13      VAL  43  -3.331  -2.464  -0.414
  346   HG21  VAL  43          HG21      VAL  43  -0.474  -2.811  -0.753
  347   HG22  VAL  43          HG22      VAL  43  -0.486  -1.017  -0.613
  348   HG23  VAL  43          HG23      VAL  43   0.127  -1.795  -2.043
  349    H    HIS  44           HN       HIS  44  -1.172  -5.093  -2.292
  350    HA   HIS  44           HA       HIS  44  -3.763  -6.073  -1.385
  351    HB2  HIS  44           HB2      HIS  44  -3.143  -8.438  -2.000
  352    HB3  HIS  44           HB1      HIS  44  -3.363  -7.380  -3.371
  353    HD1  HIS  44           HD1      HIS  44  -1.841 -10.070  -3.500
  354    HD2  HIS  44           HD2      HIS  44  -0.024  -6.369  -3.070
  355    HE1  HIS  44           HE1      HIS  44   0.456 -10.345  -4.425
  356    HE2  HIS  44           HE2      HIS  44   1.604  -8.259  -3.697
  357    H    TYR  45           HN       TYR  45  -3.850  -7.403   0.404
  358    HA   TYR  45           HA       TYR  45  -1.842  -6.475   2.285
  359    HB2  TYR  45           HB2      TYR  45  -4.431  -7.930   2.888
  360    HB3  TYR  45           HB1      TYR  45  -3.453  -6.983   3.996
  361    HD1  TYR  45           HD1      TYR  45  -3.458  -4.523   3.874
  362    HD2  TYR  45           HD2      TYR  45  -5.942  -6.844   1.324
  363    HE1  TYR  45           HE1      TYR  45  -4.765  -2.519   3.313
  364    HE2  TYR  45           HE2      TYR  45  -7.257  -4.846   0.767
  365    HH   TYR  45           HH       TYR  45  -6.210  -1.729   1.458
  366    H    TYR  46           HN       TYR  46  -0.133  -7.786   2.317
  367    HA   TYR  46           HA       TYR  46  -0.122 -10.462   1.554
  368    HB2  TYR  46           HB2      TYR  46   2.194 -10.516   2.398
  369    HB3  TYR  46           HB1      TYR  46   1.880  -9.077   1.445
  370    HD1  TYR  46           HD2      TYR  46   1.709  -6.859   2.573
  371    HD2  TYR  46           HD1      TYR  46   2.764 -10.389   4.688
  372    HE1  TYR  46           HE2      TYR  46   2.574  -5.492   4.432
  373    HE2  TYR  46           HE1      TYR  46   3.624  -9.046   6.529
  374    HH   TYR  46           HH       TYR  46   4.477  -6.865   6.905
  375    H    GLY  47           HN       GLY  47  -0.131 -12.355   2.607
  376    HA2  GLY  47           HA2      GLY  47  -0.122 -13.786   4.471
  377    HA3  GLY  47           HA1      GLY  47  -0.368 -12.391   5.511
  378    H    TRP  48           HN       TRP  48  -2.507 -11.221   4.526
  379    HA   TRP  48           HA       TRP  48  -4.583 -13.143   5.212
  380    HB2  TRP  48           HB2      TRP  48  -4.505 -11.119   6.521
  381    HB3  TRP  48           HB1      TRP  48  -4.582 -10.122   5.080
  382    HD1  TRP  48           HD1      TRP  48  -6.856  -9.009   4.938
  383    HE1  TRP  48           HE1      TRP  48  -9.288  -9.664   5.457
  384    HE3  TRP  48           HE3      TRP  48  -6.084 -13.748   6.704
  385    HZ2  TRP  48           HZ2      TRP  48 -10.695 -11.871   6.473
  386    HZ3  TRP  48           HZ3      TRP  48  -8.035 -15.062   7.428
  387    HH2  TRP  48           HH2      TRP  48 -10.288 -14.140   7.315
  388    H    ASN  49           HN       ASN  49  -4.129 -10.566   2.810
  389    HA   ASN  49           HA       ASN  49  -6.124 -11.906   1.143
  390    HB2  ASN  49           HB2      ASN  49  -5.432  -9.029   1.508
  391    HB3  ASN  49           HB1      ASN  49  -6.246  -9.550   0.053
  392   HD21  ASN  49          HD21      ASN  49  -7.226  -7.732   2.075
  393   HD22  ASN  49          HD22      ASN  49  -8.624  -8.422   2.775
  394    H    VAL  50           HN       VAL  50  -4.782 -13.220   0.034
  395    HA   VAL  50           HA       VAL  50  -2.364 -12.309  -1.068
  396    HB   VAL  50           HB       VAL  50  -2.342 -14.446  -2.423
  397   HG11  VAL  50          HG11      VAL  50  -2.023 -15.891  -0.464
  398   HG12  VAL  50          HG12      VAL  50  -2.813 -14.679   0.545
  399   HG13  VAL  50          HG13      VAL  50  -1.283 -14.306  -0.245
  400   HG21  VAL  50          HG21      VAL  50  -3.996 -16.185  -1.836
  401   HG22  VAL  50          HG22      VAL  50  -4.749 -14.816  -2.651
  402   HG23  VAL  50          HG23      VAL  50  -4.905 -14.994  -0.903
  403    H    ARG  51           HN       ARG  51  -5.442 -13.030  -2.812
  404    HA   ARG  51           HA       ARG  51  -4.367 -11.204  -4.822
  405    HB2  ARG  51           HB2      ARG  51  -4.939 -13.558  -5.600
  406    HB3  ARG  51           HB1      ARG  51  -6.631 -13.147  -5.313
  407    HG2  ARG  51           HG2      ARG  51  -6.270 -11.160  -6.846
  408    HG3  ARG  51           HG1      ARG  51  -4.742 -11.904  -7.297
  409    HD2  ARG  51           HD2      ARG  51  -5.919 -13.854  -8.105
  410    HD3  ARG  51           HD1      ARG  51  -7.451 -13.159  -7.561
  411    HE   ARG  51           HE       ARG  51  -5.766 -11.847  -9.571
  412   HH11  ARG  51          HH11      ARG  51  -8.920 -13.165  -8.648
  413   HH12  ARG  51          HH12      ARG  51  -9.776 -12.461  -9.943
  414   HH21  ARG  51          HH21      ARG  51  -6.914 -10.884 -11.363
  415   HH22  ARG  51          HH22      ARG  51  -8.588 -11.094 -11.530
  416    H    TYR  52           HN       TYR  52  -6.317 -11.021  -2.246
  417    HA   TYR  52           HA       TYR  52  -8.359  -9.462  -3.581
  418    HB2  TYR  52           HB2      TYR  52  -7.958  -9.741  -0.561
  419    HB3  TYR  52           HB1      TYR  52  -9.202  -8.787  -1.327
  420    HD1  TYR  52           HD1      TYR  52 -11.039  -9.905  -2.526
  421    HD2  TYR  52           HD2      TYR  52  -8.154 -12.085  -0.294
  422    HE1  TYR  52           HE1      TYR  52 -12.566 -11.825  -2.435
  423    HE2  TYR  52           HE2      TYR  52  -9.672 -14.017  -0.209
  424    HH   TYR  52           HH       TYR  52 -12.466 -14.184  -2.149
  425    H    ASP  53           HN       ASP  53  -6.657  -8.363  -4.603
  426    HA   ASP  53           HA       ASP  53  -5.187  -6.269  -3.369
  427    HB2  ASP  53           HB2      ASP  53  -6.100  -6.644  -6.237
  428    HB3  ASP  53           HB1      ASP  53  -4.958  -5.435  -5.692
  429    H    GLU  54           HN       GLU  54  -5.770  -4.077  -3.250
  430    HA   GLU  54           HA       GLU  54  -8.440  -3.332  -4.177
  431    HB2  GLU  54           HB2      GLU  54  -8.541  -4.181  -1.776
  432    HB3  GLU  54           HB1      GLU  54  -7.504  -2.840  -1.338
  433    HG2  GLU  54           HG2      GLU  54  -9.173  -1.258  -1.766
  434    HG3  GLU  54           HG1      GLU  54 -10.118  -2.383  -2.740
  435    H    TRP  55           HN       TRP  55  -8.760  -1.070  -4.122
  436    HA   TRP  55           HA       TRP  55  -6.317   0.190  -5.055
  437    HB2  TRP  55           HB2      TRP  55  -9.212   0.886  -5.527
  438    HB3  TRP  55           HB1      TRP  55  -7.825   1.691  -6.257
  439    HD1  TRP  55           HD1      TRP  55  -9.775  -1.613  -6.372
  440    HE1  TRP  55           HE1      TRP  55  -9.240  -2.790  -8.586
  441    HE3  TRP  55           HE3      TRP  55  -6.022   1.441  -8.005
  442    HZ2  TRP  55           HZ2      TRP  55  -7.419  -2.481 -10.737
  443    HZ3  TRP  55           HZ3      TRP  55  -4.920   0.927 -10.129
  444    HH2  TRP  55           HH2      TRP  55  -5.599  -0.993 -11.473
  445    H    VAL  56           HN       VAL  56  -5.437   1.662  -3.911
  446    HA   VAL  56           HA       VAL  56  -7.045   3.287  -2.084
  447    HB   VAL  56           HB       VAL  56  -5.305   3.210  -0.388
  448   HG11  VAL  56          HG11      VAL  56  -6.915   1.471  -0.151
  449   HG12  VAL  56          HG12      VAL  56  -5.324   0.758   0.201
  450   HG13  VAL  56          HG13      VAL  56  -6.093   0.483  -1.349
  451   HG21  VAL  56          HG21      VAL  56  -3.751   1.369  -2.229
  452   HG22  VAL  56          HG22      VAL  56  -3.286   1.813  -0.582
  453   HG23  VAL  56          HG23      VAL  56  -3.350   3.040  -1.837
  454    H    LYS  57           HN       LYS  57  -6.154   5.424  -1.825
  455    HA   LYS  57           HA       LYS  57  -4.843   6.253  -4.222
  456    HB2  LYS  57           HB2      LYS  57  -5.990   7.744  -1.926
  457    HB3  LYS  57           HB1      LYS  57  -5.064   8.560  -3.184
  458    HG2  LYS  57           HG2      LYS  57  -6.515   7.731  -4.858
  459    HG3  LYS  57           HG1      LYS  57  -7.378   6.779  -3.623
  460    HD2  LYS  57           HD2      LYS  57  -8.650   8.767  -4.197
  461    HD3  LYS  57           HD1      LYS  57  -8.088   8.826  -2.525
  462    HE2  LYS  57           HE2      LYS  57  -6.401  10.411  -3.085
  463    HE3  LYS  57           HE1      LYS  57  -6.672  10.175  -4.812
  464    HZ1  LYS  57           HZ1      LYS  57  -8.832  11.045  -4.600
  465    HZ2  LYS  57           HZ2      LYS  57  -7.744  12.208  -3.984
  466    HZ3  LYS  57           HZ3      LYS  57  -8.689  11.270  -2.938
  467    H    ALA  58           HN       ALA  58  -3.130   7.550  -4.429
  468    HA   ALA  58           HA       ALA  58  -0.778   6.567  -3.358
  469    HB1  ALA  58           HB1      ALA  58   0.301   8.317  -4.576
  470    HB2  ALA  58           HB2      ALA  58  -1.192   9.250  -4.637
  471    HB3  ALA  58           HB3      ALA  58  -1.081   7.720  -5.509
  472    H    ASP  59           HN       ASP  59  -2.608   9.429  -2.558
  473    HA   ASP  59           HA       ASP  59  -0.709  10.341  -0.602
  474    HB2  ASP  59           HB2      ASP  59  -2.357  12.096  -0.051
  475    HB3  ASP  59           HB1      ASP  59  -2.015  12.011  -1.774
  476    H    ARG  60           HN       ARG  60  -2.823   7.847  -0.489
  477    HA   ARG  60           HA       ARG  60  -3.260   8.236   2.379
  478    HB2  ARG  60           HB2      ARG  60  -4.580   6.265   0.516
  479    HB3  ARG  60           HB1      ARG  60  -4.958   6.475   2.221
  480    HG2  ARG  60           HG2      ARG  60  -5.537   8.871   1.664
  481    HG3  ARG  60           HG1      ARG  60  -5.456   8.403  -0.033
  482    HD2  ARG  60           HD2      ARG  60  -7.732   8.274   0.622
  483    HD3  ARG  60           HD1      ARG  60  -7.133   6.627   0.482
  484    HE   ARG  60           HE       ARG  60  -6.753   6.810   2.984
  485   HH11  ARG  60          HH11      ARG  60  -9.537   8.316   1.340
  486   HH12  ARG  60          HH12      ARG  60 -10.473   8.437   2.744
  487   HH21  ARG  60          HH21      ARG  60  -8.094   7.025   4.945
  488   HH22  ARG  60          HH22      ARG  60  -9.664   7.662   4.814
  489    H    ILE  61           HN       ILE  61  -0.894   7.161   0.634
  490    HA   ILE  61           HA       ILE  61  -0.531   4.683   2.103
  491    HB   ILE  61           HB       ILE  61   0.726   5.650  -0.483
  492   HG12  ILE  61          HG12      ILE  61  -1.204   3.412   0.124
  493   HG13  ILE  61          HG11      ILE  61  -1.567   4.902  -0.734
  494   HG21  ILE  61          HG21      ILE  61   1.150   3.065   0.986
  495   HG22  ILE  61          HG22      ILE  61   2.336   4.373   0.839
  496   HG23  ILE  61          HG23      ILE  61   1.818   3.470  -0.598
  497   HD11  ILE  61          HD11      ILE  61  -1.347   3.058  -2.254
  498   HD12  ILE  61          HD12      ILE  61   0.253   2.697  -1.646
  499   HD13  ILE  61          HD13      ILE  61  -0.045   4.223  -2.522
  500    H    ILE  62           HN       ILE  62   1.183   4.423   3.343
  501    HA   ILE  62           HA       ILE  62   2.927   6.729   3.855
  502    HB   ILE  62           HB       ILE  62   2.418   4.313   5.619
  503   HG12  ILE  62          HG12      ILE  62   1.365   5.920   7.230
  504   HG13  ILE  62          HG11      ILE  62   1.281   7.113   5.923
  505   HG21  ILE  62          HG21      ILE  62   3.604   5.561   7.378
  506   HG22  ILE  62          HG22      ILE  62   3.949   6.832   6.207
  507   HG23  ILE  62          HG23      ILE  62   4.612   5.214   5.973
  508   HD11  ILE  62          HD11      ILE  62  -0.191   5.522   4.713
  509   HD12  ILE  62          HD12      ILE  62  -0.842   6.017   6.279
  510   HD13  ILE  62          HD13      ILE  62  -0.076   4.436   6.101
  511    H    TRP  63           HN       TRP  63   4.690   6.418   2.676
  512    HA   TRP  63           HA       TRP  63   5.697   3.776   2.137
  513    HB2  TRP  63           HB2      TRP  63   6.711   6.520   1.365
  514    HB3  TRP  63           HB1      TRP  63   7.469   5.011   0.865
  515    HD1  TRP  63           HD1      TRP  63   4.369   7.165   0.218
  516    HE1  TRP  63           HE1      TRP  63   3.246   6.348  -1.944
  517    HE3  TRP  63           HE3      TRP  63   7.154   2.975  -0.626
  518    HZ2  TRP  63           HZ2      TRP  63   3.503   4.233  -3.765
  519    HZ3  TRP  63           HZ3      TRP  63   6.650   1.602  -2.613
  520    HH2  TRP  63           HH2      TRP  63   4.860   2.223  -4.148
  521    HA   PRO  64           HA       PRO  64   8.211   3.683   5.836
  522    HB2  PRO  64           HB2      PRO  64   9.971   1.962   4.185
  523    HB3  PRO  64           HB1      PRO  64   9.236   1.619   5.752
  524    HG2  PRO  64           HG2      PRO  64   8.315   0.459   3.543
  525    HG3  PRO  64           HG1      PRO  64   7.209   0.995   4.819
  526    HD2  PRO  64           HD2      PRO  64   7.796   2.254   2.173
  527    HD3  PRO  64           HD1      PRO  64   6.267   2.131   3.079
  528    H    LEU  65           HN       LEU  65   9.377   5.231   6.429
  529    HA   LEU  65           HA       LEU  65  11.789   5.855   4.968
  530    HB2  LEU  65           HB2      LEU  65   9.790   7.235   4.156
  531    HB3  LEU  65           HB1      LEU  65   9.795   7.985   5.731
  532    HG   LEU  65           HG       LEU  65  12.096   8.131   3.770
  533   HD11  LEU  65          HD11      LEU  65   9.907  10.099   4.367
  534   HD12  LEU  65          HD12      LEU  65  10.083   9.144   2.898
  535   HD13  LEU  65          HD13      LEU  65  11.289  10.379   3.298
  536   HD21  LEU  65          HD21      LEU  65  12.716   8.484   6.118
  537   HD22  LEU  65          HD22      LEU  65  11.471   9.720   6.258
  538   HD23  LEU  65          HD23      LEU  65  12.854   9.979   5.184
  539    H    ASP  66           HN       ASP  66  12.841   4.967   6.690
  540    HA   ASP  66           HA       ASP  66  14.131   5.018   8.493
  541    HB2  ASP  66           HB2      ASP  66  14.508   7.412   7.886
  542    HB3  ASP  66           HB1      ASP  66  13.189   7.857   8.955
  543    H    LYS  67           HN       LYS  67  10.990   4.825   8.697
  544    HA   LYS  67           HA       LYS  67  11.096   4.107  11.533
  545    HB2  LYS  67           HB2      LYS  67  10.157   6.527  11.092
  546    HB3  LYS  67           HB1      LYS  67   8.747   5.674  10.494
  547    HG2  LYS  67           HG2      LYS  67   8.108   6.047  12.666
  548    HG3  LYS  67           HG1      LYS  67   8.869   4.470  12.841
  549    HD2  LYS  67           HD2      LYS  67  10.145   7.154  13.451
  550    HD3  LYS  67           HD1      LYS  67   9.558   6.006  14.639
  551    HE2  LYS  67           HE2      LYS  67  11.284   4.399  13.940
  552    HE3  LYS  67           HE1      LYS  67  11.824   5.531  12.699
  553    HZ1  LYS  67           HZ1      LYS  67  13.237   5.640  14.604
  554    HZ2  LYS  67           HZ2      LYS  67  11.944   5.982  15.623
  555    HZ3  LYS  67           HZ3      LYS  67  12.411   7.092  14.423
  556    H    GLY  68           HN       GLY  68  11.112   2.636   9.081
  557    HA2  GLY  68           HA2      GLY  68   8.492   1.293   9.300
  558    HA3  GLY  68           HA1      GLY  68   9.322   1.479   7.764
  559    H    LEU  69           HN       LEU  69  11.487   0.951  10.267
  560    HA   LEU  69           HA       LEU  69  12.900  -0.601  10.813
  561    HB2  LEU  69           HB2      LEU  69  10.454  -2.187  10.481
  562    HB3  LEU  69           HB1      LEU  69  11.949  -3.060  10.814
  563    HG   LEU  69           HG       LEU  69  10.747  -2.805  12.870
  564   HD11  LEU  69          HD11      LEU  69  12.263  -1.535  14.271
  565   HD12  LEU  69          HD12      LEU  69  12.948  -0.760  12.850
  566   HD13  LEU  69          HD13      LEU  69  13.130  -2.502  13.078
  567   HD21  LEU  69          HD21      LEU  69  10.042  -0.636  13.778
  568   HD22  LEU  69          HD22      LEU  69   9.240  -0.998  12.249
  569   HD23  LEU  69          HD23      LEU  69  10.576   0.154  12.294
  570    H    GLU  70           HN       GLU  70  14.577  -1.530  10.035
  571    HA   GLU  70           HA       GLU  70  14.744  -1.889   7.187
  572    HB2  GLU  70           HB2      GLU  70  16.481  -0.953   9.047
  573    HB3  GLU  70           HB1      GLU  70  16.974  -2.634   9.034
  574    HG2  GLU  70           HG2      GLU  70  16.890  -0.859   6.597
  575    HG3  GLU  70           HG1      GLU  70  18.319  -1.148   7.572
  576    H    HIS  71           HN       HIS  71  15.697  -3.948   6.373
  577    HA   HIS  71           HA       HIS  71  14.104  -6.110   7.435
  578    HB2  HIS  71           HB2      HIS  71  15.808  -5.979   4.942
  579    HB3  HIS  71           HB1      HIS  71  14.779  -7.331   5.387
  580    HD1  HIS  71           HD1      HIS  71  14.723  -3.954   3.829
  581    HD2  HIS  71           HD2      HIS  71  11.977  -6.790   5.159
  582    HE1  HIS  71           HE1      HIS  71  12.546  -3.265   2.880
  583    HE2  HIS  71           HE2      HIS  71  11.042  -5.184   3.347
  584    H    HIS  72           HN       HIS  72  15.061  -6.793   9.224
  585    HA   HIS  72           HA       HIS  72  17.858  -7.510   9.396
  586    HB2  HIS  72           HB2      HIS  72  16.398  -6.839  11.386
  587    HB3  HIS  72           HB1      HIS  72  15.572  -8.374  11.203
  588    HD1  HIS  72           HD1      HIS  72  18.344  -6.817  12.934
  589    HD2  HIS  72           HD2      HIS  72  17.428 -10.657  11.641
  590    HE1  HIS  72           HE1      HIS  72  19.843  -8.332  14.214
  591    HE2  HIS  72           HE2      HIS  72  19.129 -10.651  13.566
  592    H    HIS  73           HN       HIS  73  14.870  -8.892   8.580
  593    HA   HIS  73           HA       HIS  73  15.455 -11.644   8.630
  594    HB2  HIS  73           HB2      HIS  73  13.179 -10.815   8.599
  595    HB3  HIS  73           HB1      HIS  73  13.452 -10.003   7.068
  596    HD1  HIS  73           HD1      HIS  73  12.947 -13.423   8.534
  597    HD2  HIS  73           HD2      HIS  73  13.080 -11.577   4.826
  598    HE1  HIS  73           HE1      HIS  73  12.070 -15.117   6.902
  599    HE2  HIS  73           HE2      HIS  73  12.080 -13.946   4.688
  600    H    HIS  74           HN       HIS  74  16.555 -12.875   7.259
  601    HA   HIS  74           HA       HIS  74  18.302 -12.137   5.281
  602    HB2  HIS  74           HB2      HIS  74  18.209 -14.378   6.307
  603    HB3  HIS  74           HB1      HIS  74  16.701 -14.701   5.472
  604    HD1  HIS  74           HD1      HIS  74  20.268 -15.132   5.195
  605    HD2  HIS  74           HD2      HIS  74  17.094 -14.900   2.547
  606    HE1  HIS  74           HE1      HIS  74  21.090 -16.182   3.063
  607    HE2  HIS  74           HE2      HIS  74  19.095 -16.144   1.521
  608    H    HIS  75           HN       HIS  75  18.073 -11.345   3.280
  609    HA   HIS  75           HA       HIS  75  15.684 -11.900   1.739
  610    HB2  HIS  75           HB2      HIS  75  15.083  -9.558   1.443
  611    HB3  HIS  75           HB1      HIS  75  15.053  -9.967   3.146
  612    HD1  HIS  75           HD1      HIS  75  16.436  -7.519   0.797
  613    HD2  HIS  75           HD2      HIS  75  17.409  -8.926   4.587
  614    HE1  HIS  75           HE1      HIS  75  17.933  -5.788   1.794
  615    HE2  HIS  75           HE2      HIS  75  18.714  -6.801   3.967
  616    H    HIS  76           HN       HIS  76  15.917 -10.462  -0.342
  617    HA   HIS  76           HA       HIS  76  18.603 -10.869  -1.340
  618    HB2  HIS  76           HB2      HIS  76  16.612 -11.501  -2.711
  619    HB3  HIS  76           HB1      HIS  76  16.115  -9.813  -2.730
  620    HD1  HIS  76           HD1      HIS  76  17.037  -8.413  -4.594
  621    HD2  HIS  76           HD2      HIS  76  19.085 -11.986  -4.109
  622    HE1  HIS  76           HE1      HIS  76  18.593  -8.561  -6.553
  623    HE2  HIS  76           HE2      HIS  76  19.607 -10.849  -6.363
  Start of MODEL   11
    1    H1   GLU   1           HT1      GLU   1  16.134   0.225 -15.026
    2    H2   GLU   1           HT2      GLU   1  17.821   0.386 -15.011
    3    H3   GLU   1           HT3      GLU   1  17.086  -0.900 -15.833
    4    HA   GLU   1           HA       GLU   1  16.658   1.897 -16.540
    5    HB2  GLU   1           HB2      GLU   1  18.595  -0.121 -17.682
    6    HB3  GLU   1           HB1      GLU   1  18.106   1.317 -18.556
    7    HG2  GLU   1           HG2      GLU   1  20.164   1.856 -17.611
    8    HG3  GLU   1           HG1      GLU   1  18.987   2.639 -16.564
    9    H    ASP   2           HN       ASP   2  15.748   2.064 -18.725
   10    HA   ASP   2           HA       ASP   2  14.199   1.648 -20.281
   11    HB2  ASP   2           HB2      ASP   2  15.103  -1.194 -19.853
   12    HB3  ASP   2           HB1      ASP   2  13.831  -0.800 -21.001
   13    H    MET   3           HN       MET   3  13.469   1.726 -17.456
   14    HA   MET   3           HA       MET   3  10.735   0.994 -17.816
   15    HB2  MET   3           HB2      MET   3  10.542  -0.417 -15.824
   16    HB3  MET   3           HB1      MET   3  11.625  -1.149 -16.993
   17    HG2  MET   3           HG2      MET   3  13.550  -0.369 -15.682
   18    HG3  MET   3           HG1      MET   3  12.444   0.344 -14.508
   19    HE1  MET   3           HE1      MET   3  13.954  -2.774 -12.617
   20    HE2  MET   3           HE2      MET   3  13.743  -1.022 -12.587
   21    HE3  MET   3           HE3      MET   3  14.793  -1.761 -13.794
   22    H    GLU   4           HN       GLU   4   9.489   1.648 -15.894
   23    HA   GLU   4           HA       GLU   4  10.515   4.148 -14.829
   24    HB2  GLU   4           HB2      GLU   4   7.780   2.854 -14.829
   25    HB3  GLU   4           HB1      GLU   4   8.133   4.444 -14.163
   26    HG2  GLU   4           HG2      GLU   4   8.578   5.344 -16.274
   27    HG3  GLU   4           HG1      GLU   4   8.717   3.752 -17.009
   28    HA   PRO   5           HA       PRO   5  11.185   2.143 -10.902
   29    HB2  PRO   5           HB2      PRO   5  10.199   4.555  -9.515
   30    HB3  PRO   5           HB1      PRO   5  11.810   3.819  -9.480
   31    HG2  PRO   5           HG2      PRO   5  11.385   6.140 -10.755
   32    HG3  PRO   5           HG1      PRO   5  12.511   4.917 -11.372
   33    HD2  PRO   5           HD2      PRO   5   9.694   5.482 -12.238
   34    HD3  PRO   5           HD1      PRO   5  11.138   5.195 -13.235
   35    H    CYS   6           HN       CYS   6   9.676   0.621 -10.733
   36    HA   CYS   6           HA       CYS   6   6.913   1.307 -10.278
   37    HB2  CYS   6           HB2      CYS   6   8.196  -1.416 -10.488
   38    HB3  CYS   6           HB1      CYS   6   6.480  -1.009 -10.574
   39    HG   CYS   6           HG       CYS   6   8.652   0.285 -12.844
   40    H    LEU   7           HN       LEU   7   5.759   0.267  -8.519
   41    HA   LEU   7           HA       LEU   7   7.415   0.274  -6.104
   42    HB2  LEU   7           HB2      LEU   7   4.460   0.846  -6.446
   43    HB3  LEU   7           HB1      LEU   7   5.339   0.927  -4.935
   44    HG   LEU   7           HG       LEU   7   4.987   3.156  -5.604
   45   HD11  LEU   7          HD11      LEU   7   7.792   2.452  -6.381
   46   HD12  LEU   7          HD12      LEU   7   7.191   2.798  -4.760
   47   HD13  LEU   7          HD13      LEU   7   7.204   4.067  -5.989
   48   HD21  LEU   7          HD21      LEU   7   6.045   2.460  -8.353
   49   HD22  LEU   7          HD22      LEU   7   5.597   4.080  -7.822
   50   HD23  LEU   7          HD23      LEU   7   4.368   2.828  -7.968
   51    H    THR   8           HN       THR   8   6.597  -1.867  -8.084
   52    HA   THR   8           HA       THR   8   4.756  -3.634  -6.997
   53    HB   THR   8           HB       THR   8   6.161  -5.220  -8.527
   54    HG1  THR   8           HG1      THR   8   7.335  -3.915 -10.046
   55   HG21  THR   8          HG21      THR   8   3.980  -4.236  -9.149
   56   HG22  THR   8          HG22      THR   8   5.094  -4.251 -10.517
   57   HG23  THR   8          HG23      THR   8   4.800  -2.753  -9.634
   58    H    GLY   9           HN       GLY   9   4.932  -4.725  -5.158
   59    HA2  GLY   9           HA2      GLY   9   5.870  -6.344  -3.756
   60    HA3  GLY   9           HA1      GLY   9   7.413  -6.109  -4.557
   61    H    THR  10           HN       THR  10   6.341  -3.086  -3.868
   62    HA   THR  10           HA       THR  10   8.109  -2.870  -1.622
   63    HB   THR  10           HB       THR  10   6.265  -0.822  -2.854
   64    HG1  THR  10           HG1      THR  10   8.331  -1.918  -3.930
   65   HG21  THR  10          HG21      THR  10   7.737   0.853  -1.773
   66   HG22  THR  10          HG22      THR  10   8.638  -0.456  -1.006
   67   HG23  THR  10          HG23      THR  10   6.945  -0.187  -0.586
   68    H    LYS  11           HN       LYS  11   7.576  -2.806   0.428
   69    HA   LYS  11           HA       LYS  11   4.849  -3.433   1.209
   70    HB2  LYS  11           HB2      LYS  11   7.247  -3.087   3.049
   71    HB3  LYS  11           HB1      LYS  11   5.694  -3.860   3.354
   72    HG2  LYS  11           HG2      LYS  11   7.687  -4.938   1.392
   73    HG3  LYS  11           HG1      LYS  11   7.623  -5.423   3.078
   74    HD2  LYS  11           HD2      LYS  11   5.314  -5.686   1.143
   75    HD3  LYS  11           HD1      LYS  11   6.474  -6.964   1.461
   76    HE2  LYS  11           HE2      LYS  11   4.506  -7.417   2.758
   77    HE3  LYS  11           HE1      LYS  11   5.765  -6.915   3.875
   78    HZ1  LYS  11           HZ1      LYS  11   3.509  -6.004   4.277
   79    HZ2  LYS  11           HZ2      LYS  11   3.639  -5.061   2.890
   80    HZ3  LYS  11           HZ3      LYS  11   4.689  -4.833   4.197
   81    H    VAL  12           HN       VAL  12   3.526  -1.960   2.085
   82    HA   VAL  12           HA       VAL  12   4.602   0.625   2.950
   83    HB   VAL  12           HB       VAL  12   2.733   1.797   1.815
   84   HG11  VAL  12          HG11      VAL  12   4.436   0.179  -0.073
   85   HG12  VAL  12          HG12      VAL  12   4.885   1.705   0.688
   86   HG13  VAL  12          HG13      VAL  12   3.573   1.658  -0.483
   87   HG21  VAL  12          HG21      VAL  12   1.403   0.652   0.094
   88   HG22  VAL  12          HG22      VAL  12   1.147  -0.055   1.689
   89   HG23  VAL  12          HG23      VAL  12   2.177  -0.877   0.516
   90    H    LYS  13           HN       LYS  13   2.657   1.873   3.979
   91    HA   LYS  13           HA       LYS  13   0.946  -0.060   5.308
   92    HB2  LYS  13           HB2      LYS  13   2.593   0.783   6.931
   93    HB3  LYS  13           HB1      LYS  13   2.174   2.437   6.516
   94    HG2  LYS  13           HG2      LYS  13   0.112   2.328   7.598
   95    HG3  LYS  13           HG1      LYS  13   0.125   0.565   7.633
   96    HD2  LYS  13           HD2      LYS  13   0.603   1.733   9.826
   97    HD3  LYS  13           HD1      LYS  13   1.779   0.519   9.319
   98    HE2  LYS  13           HE2      LYS  13   3.214   2.223   8.482
   99    HE3  LYS  13           HE1      LYS  13   2.061   3.501   8.912
  100    HZ1  LYS  13           HZ1      LYS  13   3.820   3.313  10.577
  101    HZ2  LYS  13           HZ2      LYS  13   3.516   1.681  10.773
  102    HZ3  LYS  13           HZ3      LYS  13   2.362   2.806  11.255
  103    H    VAL  14           HN       VAL  14  -1.192   0.691   5.714
  104    HA   VAL  14           HA       VAL  14  -1.881   2.904   3.966
  105    HB   VAL  14           HB       VAL  14  -3.160   0.146   3.991
  106   HG11  VAL  14          HG11      VAL  14  -3.931   2.543   2.348
  107   HG12  VAL  14          HG12      VAL  14  -4.784   1.988   3.782
  108   HG13  VAL  14          HG13      VAL  14  -4.703   0.947   2.356
  109   HG21  VAL  14          HG21      VAL  14  -1.074   0.262   2.686
  110   HG22  VAL  14          HG22      VAL  14  -1.748   1.591   1.733
  111   HG23  VAL  14          HG23      VAL  14  -2.485  -0.003   1.669
  112    H    LYS  15           HN       LYS  15  -3.294   4.197   4.823
  113    HA   LYS  15           HA       LYS  15  -4.887   3.410   7.170
  114    HB2  LYS  15           HB2      LYS  15  -3.059   5.163   7.503
  115    HB3  LYS  15           HB1      LYS  15  -3.850   6.100   6.251
  116    HG2  LYS  15           HG2      LYS  15  -5.786   6.427   7.668
  117    HG3  LYS  15           HG1      LYS  15  -5.081   5.421   8.931
  118    HD2  LYS  15           HD2      LYS  15  -3.162   6.987   9.057
  119    HD3  LYS  15           HD1      LYS  15  -3.948   8.011   7.861
  120    HE2  LYS  15           HE2      LYS  15  -5.859   8.287   9.425
  121    HE3  LYS  15           HE1      LYS  15  -4.986   7.325  10.607
  122    HZ1  LYS  15           HZ1      LYS  15  -4.710   9.713  11.011
  123    HZ2  LYS  15           HZ2      LYS  15  -3.994   9.923   9.510
  124    HZ3  LYS  15           HZ3      LYS  15  -3.248   8.983  10.675
  125    H    TYR  16           HN       TYR  16  -6.856   2.954   6.107
  126    HA   TYR  16           HA       TYR  16  -7.809   4.920   4.171
  127    HB2  TYR  16           HB2      TYR  16  -6.472   3.563   2.762
  128    HB3  TYR  16           HB1      TYR  16  -7.096   2.091   3.468
  129    HD1  TYR  16           HD2      TYR  16  -8.301   5.074   1.522
  130    HD2  TYR  16           HD1      TYR  16  -8.648   0.909   2.279
  131    HE1  TYR  16           HE2      TYR  16  -9.914   4.865  -0.339
  132    HE2  TYR  16           HE1      TYR  16 -10.238   0.694   0.433
  133    HH   TYR  16           HH       TYR  16 -11.777   2.035  -0.802
  134    H    GLY  17           HN       GLY  17  -9.857   5.302   4.507
  135    HA2  GLY  17           HA2      GLY  17 -11.806   3.394   4.222
  136    HA3  GLY  17           HA1      GLY  17 -11.689   3.705   5.936
  137    H    ARG  18           HN       ARG  18 -13.935   4.289   4.761
  138    HA   ARG  18           HA       ARG  18 -13.891   7.127   4.263
  139    HB2  ARG  18           HB2      ARG  18 -16.336   6.824   3.833
  140    HB3  ARG  18           HB1      ARG  18 -15.285   5.921   2.760
  141    HG2  ARG  18           HG2      ARG  18 -15.718   3.890   4.183
  142    HG3  ARG  18           HG1      ARG  18 -16.915   4.848   5.057
  143    HD2  ARG  18           HD2      ARG  18 -17.943   3.509   3.291
  144    HD3  ARG  18           HD1      ARG  18 -18.134   5.239   2.980
  145    HE   ARG  18           HE       ARG  18 -16.185   3.472   1.666
  146   HH11  ARG  18          HH11      ARG  18 -18.252   6.363   1.588
  147   HH12  ARG  18          HH12      ARG  18 -17.844   6.744  -0.031
  148   HH21  ARG  18          HH21      ARG  18 -15.653   4.043  -0.536
  149   HH22  ARG  18          HH22      ARG  18 -16.351   5.434  -1.232
  150    H    GLY  19           HN       GLY  19 -13.837   8.397   5.893
  151    HA2  GLY  19           HA2      GLY  19 -14.367   9.444   7.837
  152    HA3  GLY  19           HA1      GLY  19 -15.851   8.506   7.847
  153    H    LYS  20           HN       LYS  20 -16.040   6.839   9.177
  154    HA   LYS  20           HA       LYS  20 -13.955   6.568  11.187
  155    HB2  LYS  20           HB2      LYS  20 -16.230   7.097  11.930
  156    HB3  LYS  20           HB1      LYS  20 -16.823   5.631  11.169
  157    HG2  LYS  20           HG2      LYS  20 -15.552   4.277  12.687
  158    HG3  LYS  20           HG1      LYS  20 -14.823   5.714  13.399
  159    HD2  LYS  20           HD2      LYS  20 -17.029   6.455  14.142
  160    HD3  LYS  20           HD1      LYS  20 -17.747   4.999  13.440
  161    HE2  LYS  20           HE2      LYS  20 -17.376   4.795  15.850
  162    HE3  LYS  20           HE1      LYS  20 -16.450   3.609  14.931
  163    HZ1  LYS  20           HZ1      LYS  20 -15.150   4.642  16.701
  164    HZ2  LYS  20           HZ2      LYS  20 -15.375   6.152  16.026
  165    HZ3  LYS  20           HZ3      LYS  20 -14.476   4.980  15.202
  166    H    THR  21           HN       THR  21 -15.294   4.929   8.530
  167    HA   THR  21           HA       THR  21 -14.726   2.234   9.323
  168    HB   THR  21           HB       THR  21 -15.263   3.324   6.540
  169    HG1  THR  21           HG1      THR  21 -17.451   3.275   7.082
  170   HG21  THR  21          HG21      THR  21 -16.422   1.180   6.228
  171   HG22  THR  21          HG22      THR  21 -16.050   0.719   7.891
  172   HG23  THR  21          HG23      THR  21 -14.751   0.905   6.714
  173    H    GLN  22           HN       GLN  22 -12.457   3.997   9.514
  174    HA   GLN  22           HA       GLN  22 -10.662   3.204   7.324
  175    HB2  GLN  22           HB2      GLN  22 -10.902   5.624   7.605
  176    HB3  GLN  22           HB1      GLN  22 -10.465   5.476   9.296
  177    HG2  GLN  22           HG2      GLN  22  -8.233   4.814   8.718
  178    HG3  GLN  22           HG1      GLN  22  -8.662   4.724   7.013
  179   HE21  GLN  22          HE21      GLN  22  -8.117   6.837   9.691
  180   HE22  GLN  22          HE22      GLN  22  -7.890   8.268   8.747
  181    H    LYS  23           HN       LYS  23  -9.152   1.909   7.564
  182    HA   LYS  23           HA       LYS  23  -8.426   1.096  10.282
  183    HB2  LYS  23           HB2      LYS  23  -8.534  -0.599   7.773
  184    HB3  LYS  23           HB1      LYS  23  -7.891  -1.122   9.305
  185    HG2  LYS  23           HG2      LYS  23 -10.012  -2.100   9.166
  186    HG3  LYS  23           HG1      LYS  23 -10.191  -0.734  10.261
  187    HD2  LYS  23           HD2      LYS  23 -12.096  -0.842   8.777
  188    HD3  LYS  23           HD1      LYS  23 -11.144   0.592   8.421
  189    HE2  LYS  23           HE2      LYS  23 -10.152  -0.478   6.485
  190    HE3  LYS  23           HE1      LYS  23 -10.959  -1.996   6.877
  191    HZ1  LYS  23           HZ1      LYS  23 -12.376   0.534   6.196
  192    HZ2  LYS  23           HZ2      LYS  23 -13.063  -0.985   6.432
  193    HZ3  LYS  23           HZ3      LYS  23 -12.076  -0.721   5.113
  194    H    ILE  24           HN       ILE  24  -6.226   0.789  10.630
  195    HA   ILE  24           HA       ILE  24  -4.475   1.558   8.428
  196    HB   ILE  24           HB       ILE  24  -3.839   1.357  11.389
  197   HG12  ILE  24          HG12      ILE  24  -4.237   3.867   9.777
  198   HG13  ILE  24          HG11      ILE  24  -5.541   3.141  10.708
  199   HG21  ILE  24          HG21      ILE  24  -1.895   1.083   9.932
  200   HG22  ILE  24          HG22      ILE  24  -1.808   2.673  10.702
  201   HG23  ILE  24          HG23      ILE  24  -2.333   2.518   9.024
  202   HD11  ILE  24          HD11      ILE  24  -4.249   3.396  12.713
  203   HD12  ILE  24          HD12      ILE  24  -4.493   4.957  11.922
  204   HD13  ILE  24          HD13      ILE  24  -2.922   4.132  11.812
  205    H    TYR  25           HN       TYR  25  -3.356   0.048   7.559
  206    HA   TYR  25           HA       TYR  25  -2.592  -2.340   8.920
  207    HB2  TYR  25           HB2      TYR  25  -3.570  -3.633   6.782
  208    HB3  TYR  25           HB1      TYR  25  -4.487  -3.431   8.257
  209    HD1  TYR  25           HD2      TYR  25  -4.032  -0.754   5.667
  210    HD2  TYR  25           HD1      TYR  25  -6.628  -3.661   7.350
  211    HE1  TYR  25           HE2      TYR  25  -5.922   0.185   4.383
  212    HE2  TYR  25           HE1      TYR  25  -8.509  -2.730   6.082
  213    HH   TYR  25           HH       TYR  25  -8.121  -0.795   3.491
  214    H    GLU  26           HN       GLU  26  -1.219  -3.724   7.395
  215    HA   GLU  26           HA       GLU  26   0.323  -1.825   5.793
  216    HB2  GLU  26           HB2      GLU  26   1.193  -4.253   7.317
  217    HB3  GLU  26           HB1      GLU  26   2.206  -3.511   6.100
  218    HG2  GLU  26           HG2      GLU  26   2.120  -1.371   7.443
  219    HG3  GLU  26           HG1      GLU  26   1.220  -2.271   8.659
  220    H    ALA  27           HN       ALA  27   0.944  -2.296   3.766
  221    HA   ALA  27           HA       ALA  27  -0.228  -4.699   2.558
  222    HB1  ALA  27           HB1      ALA  27  -1.103  -3.401   0.743
  223    HB2  ALA  27           HB2      ALA  27  -0.480  -1.915   1.457
  224    HB3  ALA  27           HB3      ALA  27  -1.765  -2.815   2.267
  225    H    SER  28           HN       SER  28   0.418  -4.638   0.116
  226    HA   SER  28           HA       SER  28   3.129  -3.635  -0.304
  227    HB2  SER  28           HB2      SER  28   2.164  -6.371  -1.147
  228    HB3  SER  28           HB1      SER  28   3.816  -5.740  -1.177
  229    HG   SER  28           HG       SER  28   2.227  -6.478   1.019
  230    H    ILE  29           HN       ILE  29   3.370  -2.906  -2.427
  231    HA   ILE  29           HA       ILE  29   0.907  -2.363  -3.811
  232    HB   ILE  29           HB       ILE  29   3.708  -1.735  -4.751
  233   HG12  ILE  29          HG12      ILE  29   3.432  -0.756  -2.539
  234   HG13  ILE  29          HG11      ILE  29   3.388   0.512  -3.754
  235   HG21  ILE  29          HG21      ILE  29   2.071  -1.526  -6.508
  236   HG22  ILE  29          HG22      ILE  29   2.600   0.083  -6.023
  237   HG23  ILE  29          HG23      ILE  29   1.042  -0.538  -5.479
  238   HD11  ILE  29          HD11      ILE  29   1.060  -0.671  -2.278
  239   HD12  ILE  29          HD12      ILE  29   0.915   0.513  -3.577
  240   HD13  ILE  29          HD13      ILE  29   1.738   0.945  -2.075
  241    H    LYS  30           HN       LYS  30   0.126  -3.244  -5.578
  242    HA   LYS  30           HA       LYS  30   1.544  -5.472  -6.889
  243    HB2  LYS  30           HB2      LYS  30  -0.764  -5.803  -5.832
  244    HB3  LYS  30           HB1      LYS  30  -1.391  -4.711  -7.043
  245    HG2  LYS  30           HG2      LYS  30  -0.020  -7.327  -7.697
  246    HG3  LYS  30           HG1      LYS  30  -1.758  -7.162  -7.480
  247    HD2  LYS  30           HD2      LYS  30  -1.794  -5.562  -9.376
  248    HD3  LYS  30           HD1      LYS  30  -0.055  -5.782  -9.546
  249    HE2  LYS  30           HE2      LYS  30  -2.134  -7.952  -9.858
  250    HE3  LYS  30           HE1      LYS  30  -1.332  -7.121 -11.178
  251    HZ1  LYS  30           HZ1      LYS  30   0.783  -7.988 -10.347
  252    HZ2  LYS  30           HZ2      LYS  30  -0.300  -9.198 -10.791
  253    HZ3  LYS  30           HZ3      LYS  30  -0.049  -8.868  -9.152
  254    H    SER  31           HN       SER  31  -0.634  -2.726  -7.741
  255    HA   SER  31           HA       SER  31   1.028  -2.151 -10.031
  256    HB2  SER  31           HB2      SER  31  -1.028  -2.201 -11.502
  257    HB3  SER  31           HB1      SER  31  -0.456  -3.784 -10.967
  258    HG   SER  31           HG       SER  31  -2.779  -3.375 -10.754
  259    H    THR  32           HN       THR  32  -0.301  -0.257 -11.293
  260    HA   THR  32           HA       THR  32  -1.351   1.629  -9.309
  261    HB   THR  32           HB       THR  32   0.344   2.755 -11.428
  262    HG1  THR  32           HG1      THR  32   2.162   1.843 -10.893
  263   HG21  THR  32          HG21      THR  32  -0.586   4.081  -9.630
  264   HG22  THR  32          HG22      THR  32   1.183   4.086  -9.553
  265   HG23  THR  32          HG23      THR  32   0.259   3.082  -8.447
  266    H    GLU  33           HN       GLU  33  -2.974   2.982 -10.276
  267    HA   GLU  33           HA       GLU  33  -3.123   2.951 -13.184
  268    HB2  GLU  33           HB2      GLU  33  -5.503   2.759 -13.252
  269    HB3  GLU  33           HB1      GLU  33  -4.891   1.381 -12.325
  270    HG2  GLU  33           HG2      GLU  33  -5.662   2.371 -10.288
  271    HG3  GLU  33           HG1      GLU  33  -6.046   3.888 -11.113
  272    H    ILE  34           HN       ILE  34  -4.126   4.831 -14.036
  273    HA   ILE  34           HA       ILE  34  -4.329   6.960 -12.065
  274    HB   ILE  34           HB       ILE  34  -3.478   7.199 -14.956
  275   HG12  ILE  34          HG12      ILE  34  -1.394   8.289 -14.045
  276   HG13  ILE  34          HG11      ILE  34  -1.967   7.935 -12.425
  277   HG21  ILE  34          HG21      ILE  34  -4.002   9.432 -12.988
  278   HG22  ILE  34          HG22      ILE  34  -4.938   9.052 -14.429
  279   HG23  ILE  34          HG23      ILE  34  -3.282   9.648 -14.586
  280   HD11  ILE  34          HD11      ILE  34  -1.213   5.908 -14.521
  281   HD12  ILE  34          HD12      ILE  34  -1.827   5.584 -12.893
  282   HD13  ILE  34          HD13      ILE  34  -0.257   6.370 -13.095
  283    H    ASP  35           HN       ASP  35  -6.270   7.674 -11.925
  284    HA   ASP  35           HA       ASP  35  -8.194   7.290 -14.120
  285    HB2  ASP  35           HB2      ASP  35  -8.388   5.395 -12.544
  286    HB3  ASP  35           HB1      ASP  35  -8.682   6.535 -11.241
  287    H    ASP  36           HN       ASP  36  -9.048   9.187 -14.574
  288    HA   ASP  36           HA       ASP  36 -10.090  11.207 -14.427
  289    HB2  ASP  36           HB2      ASP  36 -11.632  10.014 -12.854
  290    HB3  ASP  36           HB1      ASP  36 -10.540  10.414 -11.541
  291    H    GLY  37           HN       GLY  37  -7.253  10.808 -13.755
  292    HA2  GLY  37           HA2      GLY  37  -5.651  12.528 -13.642
  293    HA3  GLY  37           HA1      GLY  37  -6.808  13.514 -12.760
  294    H    GLU  38           HN       GLU  38  -7.095  10.727 -11.149
  295    HA   GLU  38           HA       GLU  38  -4.794  11.367  -9.471
  296    HB2  GLU  38           HB2      GLU  38  -6.051  10.429  -7.538
  297    HB3  GLU  38           HB1      GLU  38  -6.781  11.870  -8.213
  298    HG2  GLU  38           HG2      GLU  38  -8.518  10.565  -9.246
  299    HG3  GLU  38           HG1      GLU  38  -7.722   9.066  -8.765
  300    H    VAL  39           HN       VAL  39  -3.577   9.817  -8.597
  301    HA   VAL  39           HA       VAL  39  -3.663   7.368 -10.169
  302    HB   VAL  39           HB       VAL  39  -1.607   8.683 -10.371
  303   HG11  VAL  39          HG11      VAL  39  -1.585   9.787  -8.262
  304   HG12  VAL  39          HG12      VAL  39  -0.046   8.960  -8.526
  305   HG13  VAL  39          HG13      VAL  39  -1.253   8.270  -7.427
  306   HG21  VAL  39          HG21      VAL  39  -1.167   6.093  -8.889
  307   HG22  VAL  39          HG22      VAL  39  -0.001   6.882  -9.961
  308   HG23  VAL  39          HG23      VAL  39  -1.533   6.270 -10.599
  309    H    LEU  40           HN       LEU  40  -4.161   5.590  -9.362
  310    HA   LEU  40           HA       LEU  40  -4.561   5.299  -6.474
  311    HB2  LEU  40           HB2      LEU  40  -5.777   3.814  -8.776
  312    HB3  LEU  40           HB1      LEU  40  -6.196   3.629  -7.087
  313    HG   LEU  40           HG       LEU  40  -6.652   6.098  -8.749
  314   HD11  LEU  40          HD11      LEU  40  -8.992   5.457  -8.679
  315   HD12  LEU  40          HD12      LEU  40  -8.572   3.987  -7.785
  316   HD13  LEU  40          HD13      LEU  40  -8.010   4.203  -9.443
  317   HD21  LEU  40          HD21      LEU  40  -7.515   5.389  -5.946
  318   HD22  LEU  40          HD22      LEU  40  -7.990   6.842  -6.836
  319   HD23  LEU  40          HD23      LEU  40  -6.303   6.587  -6.396
  320    H    TYR  41           HN       TYR  41  -3.774   3.488  -5.532
  321    HA   TYR  41           HA       TYR  41  -2.026   1.822  -7.173
  322    HB2  TYR  41           HB2      TYR  41  -1.823   2.683  -4.308
  323    HB3  TYR  41           HB1      TYR  41  -0.959   1.280  -4.920
  324    HD1  TYR  41           HD2      TYR  41  -1.447   4.893  -5.538
  325    HD2  TYR  41           HD1      TYR  41   1.093   1.541  -5.879
  326    HE1  TYR  41           HE2      TYR  41   0.390   6.364  -6.336
  327    HE2  TYR  41           HE1      TYR  41   2.918   2.967  -6.666
  328    HH   TYR  41           HH       TYR  41   3.233   5.101  -7.717
  329    H    LEU  42           HN       LEU  42  -2.017  -0.320  -6.776
  330    HA   LEU  42           HA       LEU  42  -4.382  -1.301  -5.395
  331    HB2  LEU  42           HB2      LEU  42  -4.279  -1.904  -7.740
  332    HB3  LEU  42           HB1      LEU  42  -2.655  -2.525  -7.540
  333    HG   LEU  42           HG       LEU  42  -3.477  -4.350  -6.174
  334   HD11  LEU  42          HD11      LEU  42  -6.208  -3.142  -6.606
  335   HD12  LEU  42          HD12      LEU  42  -5.325  -3.196  -5.078
  336   HD13  LEU  42          HD13      LEU  42  -5.863  -4.691  -5.835
  337   HD21  LEU  42          HD21      LEU  42  -5.063  -3.976  -8.695
  338   HD22  LEU  42          HD22      LEU  42  -4.772  -5.508  -7.869
  339   HD23  LEU  42          HD23      LEU  42  -3.425  -4.616  -8.586
  340    H    VAL  43           HN       VAL  43  -3.978  -2.113  -3.521
  341    HA   VAL  43           HA       VAL  43  -1.258  -2.994  -2.929
  342    HB   VAL  43           HB       VAL  43  -1.435  -2.032  -0.736
  343   HG11  VAL  43          HG11      VAL  43  -0.858  -0.449  -2.468
  344   HG12  VAL  43          HG12      VAL  43  -1.709   0.321  -1.130
  345   HG13  VAL  43          HG13      VAL  43  -2.555  -0.011  -2.640
  346   HG21  VAL  43          HG21      VAL  43  -3.768  -2.576  -0.217
  347   HG22  VAL  43          HG22      VAL  43  -4.314  -1.361  -1.366
  348   HG23  VAL  43          HG23      VAL  43  -3.459  -0.865   0.089
  349    H    HIS  44           HN       HIS  44  -1.089  -4.906  -1.876
  350    HA   HIS  44           HA       HIS  44  -3.514  -5.981  -0.741
  351    HB2  HIS  44           HB2      HIS  44  -2.918  -8.352  -1.431
  352    HB3  HIS  44           HB1      HIS  44  -3.504  -7.303  -2.704
  353    HD1  HIS  44           HD1      HIS  44  -2.329  -7.536  -4.716
  354    HD2  HIS  44           HD2      HIS  44   0.098  -8.460  -1.501
  355    HE1  HIS  44           HE1      HIS  44  -0.126  -8.351  -5.724
  356    HE2  HIS  44           HE2      HIS  44   1.264  -9.026  -3.747
  357    H    TYR  45           HN       TYR  45  -3.426  -7.184   0.953
  358    HA   TYR  45           HA       TYR  45  -1.135  -6.509   2.646
  359    HB2  TYR  45           HB2      TYR  45  -3.867  -7.529   3.455
  360    HB3  TYR  45           HB1      TYR  45  -2.685  -6.686   4.452
  361    HD1  TYR  45           HD1      TYR  45  -5.238  -6.286   1.825
  362    HD2  TYR  45           HD2      TYR  45  -2.486  -4.270   4.344
  363    HE1  TYR  45           HE1      TYR  45  -6.284  -4.142   1.226
  364    HE2  TYR  45           HE2      TYR  45  -3.524  -2.127   3.756
  365    HH   TYR  45           HH       TYR  45  -6.486  -1.841   2.054
  366    H    TYR  46           HN       TYR  46   0.127  -8.040   3.489
  367    HA   TYR  46           HA       TYR  46  -0.602 -10.817   3.020
  368    HB2  TYR  46           HB2      TYR  46   2.089  -9.577   3.599
  369    HB3  TYR  46           HB1      TYR  46   1.802 -11.309   3.531
  370    HD1  TYR  46           HD1      TYR  46   0.770 -12.186   1.315
  371    HD2  TYR  46           HD2      TYR  46   2.751  -8.464   1.702
  372    HE1  TYR  46           HE1      TYR  46   1.221 -12.191  -1.099
  373    HE2  TYR  46           HE2      TYR  46   3.213  -8.448  -0.714
  374    HH   TYR  46           HH       TYR  46   3.455 -10.146  -2.524
  375    H    GLY  47           HN       GLY  47  -2.009 -10.958   4.731
  376    HA2  GLY  47           HA2      GLY  47  -0.646 -11.164   7.336
  377    HA3  GLY  47           HA1      GLY  47  -2.358 -10.749   7.157
  378    H    TRP  48           HN       TRP  48  -3.573 -12.295   5.813
  379    HA   TRP  48           HA       TRP  48  -2.611 -15.028   5.918
  380    HB2  TRP  48           HB2      TRP  48  -3.902 -14.929   7.959
  381    HB3  TRP  48           HB1      TRP  48  -5.232 -14.117   7.144
  382    HD1  TRP  48           HD1      TRP  48  -7.150 -15.644   6.388
  383    HE1  TRP  48           HE1      TRP  48  -7.464 -18.163   6.000
  384    HE3  TRP  48           HE3      TRP  48  -2.344 -17.185   7.169
  385    HZ2  TRP  48           HZ2      TRP  48  -5.881 -20.505   6.032
  386    HZ3  TRP  48           HZ3      TRP  48  -1.829 -19.576   6.963
  387    HH2  TRP  48           HH2      TRP  48  -3.563 -21.203   6.410
  388    H    ASN  49           HN       ASN  49  -5.439 -13.047   5.065
  389    HA   ASN  49           HA       ASN  49  -5.679 -14.625   2.644
  390    HB2  ASN  49           HB2      ASN  49  -7.741 -14.174   3.916
  391    HB3  ASN  49           HB1      ASN  49  -7.471 -12.442   3.724
  392   HD21  ASN  49          HD21      ASN  49  -9.429 -12.172   2.621
  393   HD22  ASN  49          HD22      ASN  49  -9.644 -12.725   1.007
  394    H    VAL  50           HN       VAL  50  -4.476 -14.046   1.040
  395    HA   VAL  50           HA       VAL  50  -3.402 -11.390   0.808
  396    HB   VAL  50           HB       VAL  50  -3.112 -13.739  -1.106
  397   HG11  VAL  50          HG11      VAL  50  -1.035 -12.649  -1.817
  398   HG12  VAL  50          HG12      VAL  50  -1.388 -11.287  -0.754
  399   HG13  VAL  50          HG13      VAL  50  -2.447 -11.637  -2.118
  400   HG21  VAL  50          HG21      VAL  50  -1.353 -12.968   1.225
  401   HG22  VAL  50          HG22      VAL  50  -0.991 -14.227   0.045
  402   HG23  VAL  50          HG23      VAL  50  -2.376 -14.401   1.118
  403    H    ARG  51           HN       ARG  51  -6.219 -12.905  -0.126
  404    HA   ARG  51           HA       ARG  51  -6.653 -11.647  -2.633
  405    HB2  ARG  51           HB2      ARG  51  -8.692 -12.803  -0.740
  406    HB3  ARG  51           HB1      ARG  51  -9.026 -12.282  -2.380
  407    HG2  ARG  51           HG2      ARG  51  -7.395 -13.994  -3.176
  408    HG3  ARG  51           HG1      ARG  51  -7.278 -14.568  -1.506
  409    HD2  ARG  51           HD2      ARG  51  -8.888 -15.912  -2.719
  410    HD3  ARG  51           HD1      ARG  51  -9.717 -14.939  -1.499
  411    HE   ARG  51           HE       ARG  51  -9.533 -13.897  -4.210
  412   HH11  ARG  51          HH11      ARG  51 -11.584 -15.392  -1.778
  413   HH12  ARG  51          HH12      ARG  51 -13.053 -14.920  -2.499
  414   HH21  ARG  51          HH21      ARG  51 -11.485 -13.234  -5.200
  415   HH22  ARG  51          HH22      ARG  51 -12.996 -13.648  -4.519
  416    H    TYR  52           HN       TYR  52  -6.495 -10.238   0.368
  417    HA   TYR  52           HA       TYR  52  -8.443  -8.195  -0.221
  418    HB2  TYR  52           HB2      TYR  52  -6.269  -8.277   1.889
  419    HB3  TYR  52           HB1      TYR  52  -7.341  -6.906   1.655
  420    HD1  TYR  52           HD2      TYR  52  -9.854  -7.315   1.910
  421    HD2  TYR  52           HD1      TYR  52  -6.892 -10.047   3.250
  422    HE1  TYR  52           HE2      TYR  52 -11.498  -8.345   3.427
  423    HE2  TYR  52           HE1      TYR  52  -8.521 -11.075   4.761
  424    HH   TYR  52           HH       TYR  52 -11.850 -10.438   4.577
  425    H    ASP  53           HN       ASP  53  -7.857  -7.770  -2.219
  426    HA   ASP  53           HA       ASP  53  -5.351  -6.319  -2.706
  427    HB2  ASP  53           HB2      ASP  53  -6.021  -8.527  -3.928
  428    HB3  ASP  53           HB1      ASP  53  -7.253  -7.568  -4.712
  429    H    GLU  54           HN       GLU  54  -5.891  -4.286  -2.240
  430    HA   GLU  54           HA       GLU  54  -8.560  -3.194  -2.939
  431    HB2  GLU  54           HB2      GLU  54  -8.321  -3.814  -0.542
  432    HB3  GLU  54           HB1      GLU  54  -6.877  -2.834  -0.449
  433    HG2  GLU  54           HG2      GLU  54  -8.136  -0.831  -0.619
  434    HG3  GLU  54           HG1      GLU  54  -9.604  -1.721  -1.025
  435    H    TRP  55           HN       TRP  55  -8.653  -0.978  -3.347
  436    HA   TRP  55           HA       TRP  55  -6.155   0.044  -4.490
  437    HB2  TRP  55           HB2      TRP  55  -9.025   0.709  -5.125
  438    HB3  TRP  55           HB1      TRP  55  -7.626   1.434  -5.904
  439    HD1  TRP  55           HD1      TRP  55  -9.453  -1.946  -5.616
  440    HE1  TRP  55           HE1      TRP  55  -8.871  -3.342  -7.705
  441    HE3  TRP  55           HE3      TRP  55  -5.908   1.109  -7.688
  442    HZ2  TRP  55           HZ2      TRP  55  -7.129  -3.177  -9.918
  443    HZ3  TRP  55           HZ3      TRP  55  -4.822   0.405  -9.782
  444    HH2  TRP  55           HH2      TRP  55  -5.419  -1.691 -10.870
  445    H    VAL  56           HN       VAL  56  -5.273   1.845  -3.732
  446    HA   VAL  56           HA       VAL  56  -6.855   3.695  -2.101
  447    HB   VAL  56           HB       VAL  56  -4.095   2.725  -1.303
  448   HG11  VAL  56          HG11      VAL  56  -4.525   3.877   0.811
  449   HG12  VAL  56          HG12      VAL  56  -6.086   4.417   0.193
  450   HG13  VAL  56          HG13      VAL  56  -4.596   4.972  -0.568
  451   HG21  VAL  56          HG21      VAL  56  -5.685   0.886  -1.011
  452   HG22  VAL  56          HG22      VAL  56  -6.724   1.932  -0.040
  453   HG23  VAL  56          HG23      VAL  56  -5.110   1.499   0.533
  454    H    LYS  57           HN       LYS  57  -6.209   5.844  -2.490
  455    HA   LYS  57           HA       LYS  57  -4.508   6.296  -4.678
  456    HB2  LYS  57           HB2      LYS  57  -6.466   7.653  -4.244
  457    HB3  LYS  57           HB1      LYS  57  -5.794   8.173  -2.713
  458    HG2  LYS  57           HG2      LYS  57  -4.257   9.558  -3.702
  459    HG3  LYS  57           HG1      LYS  57  -4.328   8.707  -5.247
  460    HD2  LYS  57           HD2      LYS  57  -5.487  10.861  -5.405
  461    HD3  LYS  57           HD1      LYS  57  -6.581   9.477  -5.578
  462    HE2  LYS  57           HE2      LYS  57  -7.318   9.724  -3.305
  463    HE3  LYS  57           HE1      LYS  57  -6.208  11.077  -3.061
  464    HZ1  LYS  57           HZ1      LYS  57  -8.479  11.818  -3.527
  465    HZ2  LYS  57           HZ2      LYS  57  -8.426  11.060  -5.055
  466    HZ3  LYS  57           HZ3      LYS  57  -7.402  12.318  -4.710
  467    H    ALA  58           HN       ALA  58  -2.642   7.638  -4.709
  468    HA   ALA  58           HA       ALA  58  -0.535   6.448  -3.433
  469    HB1  ALA  58           HB1      ALA  58  -0.631   7.715  -5.553
  470    HB2  ALA  58           HB2      ALA  58   0.797   7.954  -4.551
  471    HB3  ALA  58           HB3      ALA  58  -0.473   9.192  -4.596
  472    H    ASP  59           HN       ASP  59  -1.939   9.561  -2.858
  473    HA   ASP  59           HA       ASP  59  -0.002  10.346  -0.852
  474    HB2  ASP  59           HB2      ASP  59  -1.252  12.389  -0.598
  475    HB3  ASP  59           HB1      ASP  59  -1.123  12.009  -2.310
  476    H    ARG  60           HN       ARG  60  -2.594   8.347  -0.727
  477    HA   ARG  60           HA       ARG  60  -3.284   9.062   2.022
  478    HB2  ARG  60           HB2      ARG  60  -4.910   8.959  -0.061
  479    HB3  ARG  60           HB1      ARG  60  -4.872   7.237   0.259
  480    HG2  ARG  60           HG2      ARG  60  -5.493   9.077   2.501
  481    HG3  ARG  60           HG1      ARG  60  -6.722   8.814   1.273
  482    HD2  ARG  60           HD2      ARG  60  -6.579   6.404   1.675
  483    HD3  ARG  60           HD1      ARG  60  -5.354   6.701   2.914
  484    HE   ARG  60           HE       ARG  60  -6.916   7.337   4.343
  485   HH11  ARG  60          HH11      ARG  60  -8.430   7.209   1.144
  486   HH12  ARG  60          HH12      ARG  60  -9.991   7.587   1.712
  487   HH21  ARG  60          HH21      ARG  60  -9.089   7.798   5.121
  488   HH22  ARG  60          HH22      ARG  60 -10.380   7.881   4.029
  489    H    ILE  61           HN       ILE  61  -1.169   7.297   0.505
  490    HA   ILE  61           HA       ILE  61  -1.378   4.927   2.213
  491    HB   ILE  61           HB       ILE  61   0.286   5.442  -0.291
  492   HG12  ILE  61          HG12      ILE  61  -2.132   3.681   0.099
  493   HG13  ILE  61          HG11      ILE  61  -2.110   5.228  -0.742
  494   HG21  ILE  61          HG21      ILE  61   1.412   3.896   1.211
  495   HG22  ILE  61          HG22      ILE  61   0.838   3.059  -0.237
  496   HG23  ILE  61          HG23      ILE  61  -0.046   2.902   1.290
  497   HD11  ILE  61          HD11      ILE  61  -0.649   2.736  -1.546
  498   HD12  ILE  61          HD12      ILE  61  -0.618   4.281  -2.422
  499   HD13  ILE  61          HD13      ILE  61  -2.124   3.370  -2.277
  500    H    ILE  62           HN       ILE  62   0.676   4.308   3.290
  501    HA   ILE  62           HA       ILE  62   2.340   6.634   3.932
  502    HB   ILE  62           HB       ILE  62   1.948   4.036   5.459
  503   HG12  ILE  62          HG12      ILE  62   1.070   5.428   7.310
  504   HG13  ILE  62          HG11      ILE  62   0.996   6.822   6.223
  505   HG21  ILE  62          HG21      ILE  62   3.616   6.425   6.195
  506   HG22  ILE  62          HG22      ILE  62   4.200   4.825   5.736
  507   HG23  ILE  62          HG23      ILE  62   3.314   5.041   7.247
  508   HD11  ILE  62          HD11      ILE  62  -1.182   5.796   6.522
  509   HD12  ILE  62          HD12      ILE  62  -0.518   4.230   6.034
  510   HD13  ILE  62          HD13      ILE  62  -0.629   5.540   4.860
  511    H    TRP  63           HN       TRP  63   4.051   6.563   2.727
  512    HA   TRP  63           HA       TRP  63   5.165   4.034   1.800
  513    HB2  TRP  63           HB2      TRP  63   5.785   6.897   1.016
  514    HB3  TRP  63           HB1      TRP  63   6.430   5.453   0.244
  515    HD1  TRP  63           HD1      TRP  63   3.247   7.546   0.495
  516    HE1  TRP  63           HE1      TRP  63   1.636   6.833  -1.369
  517    HE3  TRP  63           HE3      TRP  63   5.819   3.512  -1.228
  518    HZ2  TRP  63           HZ2      TRP  63   1.495   4.791  -3.332
  519    HZ3  TRP  63           HZ3      TRP  63   4.896   2.230  -3.099
  520    HH2  TRP  63           HH2      TRP  63   2.788   2.843  -4.122
  521    HA   PRO  64           HA       PRO  64   8.523   4.685   4.723
  522    HB2  PRO  64           HB2      PRO  64  10.268   3.256   2.817
  523    HB3  PRO  64           HB1      PRO  64   9.844   2.813   4.472
  524    HG2  PRO  64           HG2      PRO  64   8.889   1.425   2.386
  525    HG3  PRO  64           HG1      PRO  64   7.912   1.739   3.838
  526    HD2  PRO  64           HD2      PRO  64   7.834   3.132   1.182
  527    HD3  PRO  64           HD1      PRO  64   6.493   2.575   2.209
  528    H    LEU  65           HN       LEU  65   9.330   6.607   4.750
  529    HA   LEU  65           HA       LEU  65  11.352   7.611   3.118
  530    HB2  LEU  65           HB2      LEU  65   9.266   7.696   1.543
  531    HB3  LEU  65           HB1      LEU  65   8.684   8.962   2.591
  532    HG   LEU  65           HG       LEU  65   9.672   9.831   0.511
  533   HD11  LEU  65          HD11      LEU  65  11.180  11.503   1.449
  534   HD12  LEU  65          HD12      LEU  65  11.278  10.559   2.938
  535   HD13  LEU  65          HD13      LEU  65   9.744  11.270   2.451
  536   HD21  LEU  65          HD21      LEU  65  12.224   8.606   1.522
  537   HD22  LEU  65          HD22      LEU  65  12.075   9.661   0.115
  538   HD23  LEU  65          HD23      LEU  65  11.285   8.078   0.128
  539    H    ASP  66           HN       ASP  66  12.128   8.075   5.131
  540    HA   ASP  66           HA       ASP  66  12.597   9.229   7.019
  541    HB2  ASP  66           HB2      ASP  66  12.351  11.149   5.386
  542    HB3  ASP  66           HB1      ASP  66  10.690  11.330   5.920
  543    H    LYS  67           HN       LYS  67  10.260   7.449   6.841
  544    HA   LYS  67           HA       LYS  67   8.306   8.713   8.641
  545    HB2  LYS  67           HB2      LYS  67   7.635   7.820   6.352
  546    HB3  LYS  67           HB1      LYS  67   7.887   6.216   7.011
  547    HG2  LYS  67           HG2      LYS  67   5.559   6.709   7.119
  548    HG3  LYS  67           HG1      LYS  67   6.194   6.752   8.765
  549    HD2  LYS  67           HD2      LYS  67   6.332   9.174   8.668
  550    HD3  LYS  67           HD1      LYS  67   5.748   9.165   7.006
  551    HE2  LYS  67           HE2      LYS  67   3.638   8.140   7.824
  552    HE3  LYS  67           HE1      LYS  67   4.255   8.283   9.470
  553    HZ1  LYS  67           HZ1      LYS  67   2.813  10.131   8.953
  554    HZ2  LYS  67           HZ2      LYS  67   3.724  10.520   7.599
  555    HZ3  LYS  67           HZ3      LYS  67   4.387  10.710   9.125
  556    H    GLY  68           HN       GLY  68  10.371   5.922   8.232
  557    HA2  GLY  68           HA2      GLY  68  11.286   5.013  10.340
  558    HA3  GLY  68           HA1      GLY  68   9.653   5.110  10.987
  559    H    LEU  69           HN       LEU  69   9.396   4.191   7.849
  560    HA   LEU  69           HA       LEU  69   9.077   1.387   8.610
  561    HB2  LEU  69           HB2      LEU  69   8.240   2.896   6.120
  562    HB3  LEU  69           HB1      LEU  69   8.143   1.158   6.238
  563    HG   LEU  69           HG       LEU  69   6.518   1.448   8.131
  564   HD11  LEU  69          HD11      LEU  69   6.554   4.339   7.295
  565   HD12  LEU  69          HD12      LEU  69   7.110   3.691   8.840
  566   HD13  LEU  69          HD13      LEU  69   5.405   3.591   8.403
  567   HD21  LEU  69          HD21      LEU  69   5.771   2.668   5.480
  568   HD22  LEU  69          HD22      LEU  69   4.642   2.052   6.683
  569   HD23  LEU  69          HD23      LEU  69   5.768   0.954   5.886
  570    H    GLU  70           HN       GLU  70  11.050   3.524   6.887
  571    HA   GLU  70           HA       GLU  70  12.477   1.744   5.229
  572    HB2  GLU  70           HB2      GLU  70  13.847   4.068   6.575
  573    HB3  GLU  70           HB1      GLU  70  14.101   3.432   4.964
  574    HG2  GLU  70           HG2      GLU  70  13.078   5.477   4.588
  575    HG3  GLU  70           HG1      GLU  70  11.734   4.343   4.477
  576    H    HIS  71           HN       HIS  71  14.019   0.302   5.766
  577    HA   HIS  71           HA       HIS  71  14.455   0.003   8.605
  578    HB2  HIS  71           HB2      HIS  71  14.984  -1.894   6.327
  579    HB3  HIS  71           HB1      HIS  71  15.488  -2.225   7.986
  580    HD1  HIS  71           HD1      HIS  71  12.856  -3.146   5.855
  581    HD2  HIS  71           HD2      HIS  71  13.000  -1.713   9.751
  582    HE1  HIS  71           HE1      HIS  71  10.644  -3.712   6.866
  583    HE2  HIS  71           HE2      HIS  71  10.734  -2.815   9.207
  584    H    HIS  72           HN       HIS  72  16.494  -0.404   9.536
  585    HA   HIS  72           HA       HIS  72  18.371   1.545   8.711
  586    HB2  HIS  72           HB2      HIS  72  17.954   0.852  11.096
  587    HB3  HIS  72           HB1      HIS  72  18.750  -0.671  10.741
  588    HD1  HIS  72           HD1      HIS  72  19.496   3.008  11.147
  589    HD2  HIS  72           HD2      HIS  72  21.515  -0.606  10.842
  590    HE1  HIS  72           HE1      HIS  72  21.863   3.507  11.763
  591    HE2  HIS  72           HE2      HIS  72  22.967   1.269  11.862
  592    H    HIS  73           HN       HIS  73  18.109  -1.905   8.394
  593    HA   HIS  73           HA       HIS  73  20.575  -2.041   6.870
  594    HB2  HIS  73           HB2      HIS  73  18.550  -4.172   7.631
  595    HB3  HIS  73           HB1      HIS  73  19.918  -4.479   6.576
  596    HD1  HIS  73           HD1      HIS  73  19.142  -5.442   9.690
  597    HD2  HIS  73           HD2      HIS  73  22.290  -3.114   8.317
  598    HE1  HIS  73           HE1      HIS  73  20.970  -5.693  11.395
  599    HE2  HIS  73           HE2      HIS  73  22.903  -4.347  10.470
  600    H    HIS  74           HN       HIS  74  20.405  -1.208   4.964
  601    HA   HIS  74           HA       HIS  74  18.101  -0.650   3.540
  602    HB2  HIS  74           HB2      HIS  74  19.493  -0.129   1.619
  603    HB3  HIS  74           HB1      HIS  74  20.311   0.411   3.073
  604    HD1  HIS  74           HD1      HIS  74  21.141  -1.062  -0.006
  605    HD2  HIS  74           HD2      HIS  74  22.171  -1.925   3.916
  606    HE1  HIS  74           HE1      HIS  74  23.176  -2.493  -0.145
  607    HE2  HIS  74           HE2      HIS  74  23.917  -2.778   2.252
  608    H    HIS  75           HN       HIS  75  16.925  -1.599   2.061
  609    HA   HIS  75           HA       HIS  75  16.916  -4.421   1.720
  610    HB2  HIS  75           HB2      HIS  75  14.830  -3.197   1.681
  611    HB3  HIS  75           HB1      HIS  75  15.401  -2.168   0.379
  612    HD1  HIS  75           HD1      HIS  75  13.885  -5.513   1.050
  613    HD2  HIS  75           HD2      HIS  75  15.262  -3.330  -2.198
  614    HE1  HIS  75           HE1      HIS  75  12.964  -6.656  -0.967
  615    HE2  HIS  75           HE2      HIS  75  13.565  -5.145  -2.866
  616    H    HIS  76           HN       HIS  76  17.781  -5.624   0.095
  617    HA   HIS  76           HA       HIS  76  18.542  -4.391  -2.386
  618    HB2  HIS  76           HB2      HIS  76  20.595  -4.185  -0.950
  619    HB3  HIS  76           HB1      HIS  76  20.575  -5.932  -0.732
  620    HD1  HIS  76           HD1      HIS  76  22.277  -7.000  -2.185
  621    HD2  HIS  76           HD2      HIS  76  20.596  -3.677  -4.008
  622    HE1  HIS  76           HE1      HIS  76  23.430  -6.789  -4.405
  623    HE2  HIS  76           HE2      HIS  76  22.609  -4.606  -5.320
  Start of MODEL   12
    1    H1   GLU   1           HT1      GLU   1  11.207   9.505 -13.921
    2    H2   GLU   1           HT2      GLU   1  10.963   8.204 -12.897
    3    H3   GLU   1           HT3      GLU   1   9.828   8.533 -14.112
    4    HA   GLU   1           HA       GLU   1  11.156   6.671 -14.697
    5    HB2  GLU   1           HB2      GLU   1  11.603   9.225 -16.247
    6    HB3  GLU   1           HB1      GLU   1  12.299   7.721 -16.815
    7    HG2  GLU   1           HG2      GLU   1  10.169   8.272 -17.917
    8    HG3  GLU   1           HG1      GLU   1  10.113   6.740 -17.053
    9    H    ASP   2           HN       ASP   2  13.640   6.783 -16.061
   10    HA   ASP   2           HA       ASP   2  15.844   6.579 -15.794
   11    HB2  ASP   2           HB2      ASP   2  15.607   8.173 -13.216
   12    HB3  ASP   2           HB1      ASP   2  17.114   7.690 -13.983
   13    H    MET   3           HN       MET   3  14.585   6.499 -12.538
   14    HA   MET   3           HA       MET   3  15.777   3.930 -12.047
   15    HB2  MET   3           HB2      MET   3  14.591   3.975  -9.921
   16    HB3  MET   3           HB1      MET   3  15.297   5.558 -10.188
   17    HG2  MET   3           HG2      MET   3  13.113   6.412 -10.896
   18    HG3  MET   3           HG1      MET   3  12.411   4.817 -10.651
   19    HE1  MET   3           HE1      MET   3  14.014   3.952  -7.905
   20    HE2  MET   3           HE2      MET   3  12.321   3.611  -8.253
   21    HE3  MET   3           HE3      MET   3  12.766   4.398  -6.741
   22    H    GLU   4           HN       GLU   4  14.551   1.961 -11.886
   23    HA   GLU   4           HA       GLU   4  12.633   1.731 -13.958
   24    HB2  GLU   4           HB2      GLU   4  13.407  -0.251 -11.825
   25    HB3  GLU   4           HB1      GLU   4  12.404  -0.610 -13.214
   26    HG2  GLU   4           HG2      GLU   4  14.297  -0.040 -14.685
   27    HG3  GLU   4           HG1      GLU   4  15.293   0.213 -13.250
   28    HA   PRO   5           HA       PRO   5   9.106   2.682 -11.330
   29    HB2  PRO   5           HB2      PRO   5   7.568   2.125 -13.785
   30    HB3  PRO   5           HB1      PRO   5   7.624   3.606 -12.825
   31    HG2  PRO   5           HG2      PRO   5   8.774   3.484 -15.246
   32    HG3  PRO   5           HG1      PRO   5   9.500   4.395 -13.903
   33    HD2  PRO   5           HD2      PRO   5  10.225   1.659 -14.915
   34    HD3  PRO   5           HD1      PRO   5  11.273   3.032 -14.483
   35    H    CYS   6           HN       CYS   6   9.658   0.624 -10.380
   36    HA   CYS   6           HA       CYS   6   8.355  -1.750 -11.372
   37    HB2  CYS   6           HB2      CYS   6   9.803  -1.253  -8.777
   38    HB3  CYS   6           HB1      CYS   6   9.365  -2.832  -9.430
   39    HG   CYS   6           HG       CYS   6  11.494  -3.174 -10.834
   40    H    LEU   7           HN       LEU   7   8.370  -0.123  -8.241
   41    HA   LEU   7           HA       LEU   7   6.918   0.251  -6.645
   42    HB2  LEU   7           HB2      LEU   7   4.886   0.303  -8.885
   43    HB3  LEU   7           HB1      LEU   7   4.501   0.694  -7.225
   44    HG   LEU   7           HG       LEU   7   6.181   2.579  -7.366
   45   HD11  LEU   7          HD11      LEU   7   7.464   1.787  -9.279
   46   HD12  LEU   7          HD12      LEU   7   6.834   3.417  -9.536
   47   HD13  LEU   7          HD13      LEU   7   6.063   2.035 -10.321
   48   HD21  LEU   7          HD21      LEU   7   3.876   2.708  -9.290
   49   HD22  LEU   7          HD22      LEU   7   4.674   4.081  -8.512
   50   HD23  LEU   7          HD23      LEU   7   3.777   2.905  -7.546
   51    H    THR   8           HN       THR   8   5.500  -2.225  -8.737
   52    HA   THR   8           HA       THR   8   4.051  -3.621  -6.853
   53    HB   THR   8           HB       THR   8   5.567  -4.702  -9.227
   54    HG1  THR   8           HG1      THR   8   2.825  -4.110  -9.300
   55   HG21  THR   8          HG21      THR   8   3.838  -6.453  -9.247
   56   HG22  THR   8          HG22      THR   8   3.100  -5.724  -7.819
   57   HG23  THR   8          HG23      THR   8   4.705  -6.451  -7.705
   58    H    GLY   9           HN       GLY   9   4.695  -4.599  -5.072
   59    HA2  GLY   9           HA2      GLY   9   6.023  -6.370  -4.070
   60    HA3  GLY   9           HA1      GLY   9   7.397  -5.773  -4.995
   61    H    THR  10           HN       THR  10   6.411  -2.935  -4.296
   62    HA   THR  10           HA       THR  10   8.047  -2.675  -1.972
   63    HB   THR  10           HB       THR  10   6.249  -0.675  -3.324
   64    HG1  THR  10           HG1      THR  10   8.434  -1.867  -4.174
   65   HG21  THR  10          HG21      THR  10   8.632  -0.215  -1.496
   66   HG22  THR  10          HG22      THR  10   6.948   0.058  -1.059
   67   HG23  THR  10          HG23      THR  10   7.705   1.048  -2.302
   68    H    LYS  11           HN       LYS  11   7.422  -2.637   0.050
   69    HA   LYS  11           HA       LYS  11   4.611  -2.965   0.572
   70    HB2  LYS  11           HB2      LYS  11   5.271  -3.637   2.926
   71    HB3  LYS  11           HB1      LYS  11   5.825  -4.699   1.659
   72    HG2  LYS  11           HG2      LYS  11   7.577  -4.558   3.226
   73    HG3  LYS  11           HG1      LYS  11   8.089  -3.566   1.871
   74    HD2  LYS  11           HD2      LYS  11   7.392  -1.554   3.105
   75    HD3  LYS  11           HD1      LYS  11   6.885  -2.567   4.457
   76    HE2  LYS  11           HE2      LYS  11   9.091  -1.591   4.862
   77    HE3  LYS  11           HE1      LYS  11   9.179  -3.346   4.745
   78    HZ1  LYS  11           HZ1      LYS  11  10.969  -2.222   3.524
   79    HZ2  LYS  11           HZ2      LYS  11   9.833  -1.472   2.539
   80    HZ3  LYS  11           HZ3      LYS  11  10.008  -3.143   2.506
   81    H    VAL  12           HN       VAL  12   3.344  -1.625   1.483
   82    HA   VAL  12           HA       VAL  12   4.483   0.916   2.372
   83    HB   VAL  12           HB       VAL  12   2.643   2.100   1.250
   84   HG11  VAL  12          HG11      VAL  12   4.239   0.341  -0.593
   85   HG12  VAL  12          HG12      VAL  12   4.773   1.868   0.110
   86   HG13  VAL  12          HG13      VAL  12   3.440   1.849  -1.042
   87   HG21  VAL  12          HG21      VAL  12   1.251   0.946  -0.404
   88   HG22  VAL  12          HG22      VAL  12   0.993   0.299   1.217
   89   HG23  VAL  12          HG23      VAL  12   1.985  -0.592   0.061
   90    H    LYS  13           HN       LYS  13   2.581   2.258   3.345
   91    HA   LYS  13           HA       LYS  13   1.155   0.517   5.226
   92    HB2  LYS  13           HB2      LYS  13   2.762   2.880   5.454
   93    HB3  LYS  13           HB1      LYS  13   1.144   3.190   6.056
   94    HG2  LYS  13           HG2      LYS  13   2.875   0.921   6.926
   95    HG3  LYS  13           HG1      LYS  13   2.739   2.488   7.799
   96    HD2  LYS  13           HD2      LYS  13   0.222   1.886   7.692
   97    HD3  LYS  13           HD1      LYS  13   0.805   0.246   7.440
   98    HE2  LYS  13           HE2      LYS  13   1.272   2.091   9.732
   99    HE3  LYS  13           HE1      LYS  13   0.446   0.540   9.773
  100    HZ1  LYS  13           HZ1      LYS  13   3.351   1.066   9.530
  101    HZ2  LYS  13           HZ2      LYS  13   2.738  -0.452   9.148
  102    HZ3  LYS  13           HZ3      LYS  13   2.549   0.170  10.709
  103    H    VAL  14           HN       VAL  14  -1.078   0.745   5.281
  104    HA   VAL  14           HA       VAL  14  -2.206   2.845   3.573
  105    HB   VAL  14           HB       VAL  14  -3.185  -0.015   3.846
  106   HG11  VAL  14          HG11      VAL  14  -4.306   2.259   2.206
  107   HG12  VAL  14          HG12      VAL  14  -5.061   1.533   3.624
  108   HG13  VAL  14          HG13      VAL  14  -4.862   0.586   2.148
  109   HG21  VAL  14          HG21      VAL  14  -2.037   1.417   1.445
  110   HG22  VAL  14          HG22      VAL  14  -2.643  -0.244   1.509
  111   HG23  VAL  14          HG23      VAL  14  -1.211   0.210   2.434
  112    H    LYS  15           HN       LYS  15  -3.727   4.015   4.493
  113    HA   LYS  15           HA       LYS  15  -4.699   3.222   7.148
  114    HB2  LYS  15           HB2      LYS  15  -3.416   5.317   7.047
  115    HB3  LYS  15           HB1      LYS  15  -4.462   5.910   5.774
  116    HG2  LYS  15           HG2      LYS  15  -6.339   5.925   7.374
  117    HG3  LYS  15           HG1      LYS  15  -5.222   5.416   8.647
  118    HD2  LYS  15           HD2      LYS  15  -3.891   7.396   8.345
  119    HD3  LYS  15           HD1      LYS  15  -4.871   7.894   6.970
  120    HE2  LYS  15           HE2      LYS  15  -6.826   8.018   8.522
  121    HE3  LYS  15           HE1      LYS  15  -5.719   7.694   9.853
  122    HZ1  LYS  15           HZ1      LYS  15  -4.498   9.691   9.257
  123    HZ2  LYS  15           HZ2      LYS  15  -6.095  10.054   9.616
  124    HZ3  LYS  15           HZ3      LYS  15  -5.588  10.005   8.007
  125    H    TYR  16           HN       TYR  16  -6.778   2.390   7.013
  126    HA   TYR  16           HA       TYR  16  -8.492   3.590   4.972
  127    HB2  TYR  16           HB2      TYR  16  -7.391   1.302   4.371
  128    HB3  TYR  16           HB1      TYR  16  -8.543   0.634   5.519
  129    HD1  TYR  16           HD1      TYR  16 -10.939   0.701   5.035
  130    HD2  TYR  16           HD2      TYR  16  -8.090   2.131   2.235
  131    HE1  TYR  16           HE1      TYR  16 -12.665   0.681   3.251
  132    HE2  TYR  16           HE2      TYR  16  -9.793   2.103   0.453
  133    HH   TYR  16           HH       TYR  16 -11.938   0.850   0.032
  134    H    GLY  17           HN       GLY  17 -10.201   4.483   6.046
  135    HA2  GLY  17           HA2      GLY  17 -11.593   2.883   7.981
  136    HA3  GLY  17           HA1      GLY  17 -10.757   4.306   8.606
  137    H    ARG  18           HN       ARG  18 -13.485   3.882   8.735
  138    HA   ARG  18           HA       ARG  18 -14.306   6.318   7.481
  139    HB2  ARG  18           HB2      ARG  18 -16.394   5.348   6.581
  140    HB3  ARG  18           HB1      ARG  18 -14.977   4.689   5.793
  141    HG2  ARG  18           HG2      ARG  18 -15.182   2.684   7.272
  142    HG3  ARG  18           HG1      ARG  18 -16.714   3.344   7.852
  143    HD2  ARG  18           HD2      ARG  18 -17.185   1.772   6.099
  144    HD3  ARG  18           HD1      ARG  18 -17.500   3.395   5.484
  145    HE   ARG  18           HE       ARG  18 -14.900   2.204   4.986
  146   HH11  ARG  18          HH11      ARG  18 -18.068   3.129   3.664
  147   HH12  ARG  18          HH12      ARG  18 -17.575   2.960   2.048
  148   HH21  ARG  18          HH21      ARG  18 -14.266   1.968   2.743
  149   HH22  ARG  18          HH22      ARG  18 -15.403   2.234   1.508
  150    H    GLY  19           HN       GLY  19 -15.396   7.476   8.903
  151    HA2  GLY  19           HA2      GLY  19 -16.680   8.034  10.714
  152    HA3  GLY  19           HA1      GLY  19 -17.224   6.360  10.777
  153    H    LYS  20           HN       LYS  20 -16.785   5.461  12.639
  154    HA   LYS  20           HA       LYS  20 -14.699   6.490  14.356
  155    HB2  LYS  20           HB2      LYS  20 -16.921   5.929  15.278
  156    HB3  LYS  20           HB1      LYS  20 -16.701   4.263  14.774
  157    HG2  LYS  20           HG2      LYS  20 -14.794   4.068  16.325
  158    HG3  LYS  20           HG1      LYS  20 -15.098   5.721  16.865
  159    HD2  LYS  20           HD2      LYS  20 -17.333   5.073  17.616
  160    HD3  LYS  20           HD1      LYS  20 -17.058   3.429  17.047
  161    HE2  LYS  20           HE2      LYS  20 -15.187   3.215  18.644
  162    HE3  LYS  20           HE1      LYS  20 -15.522   4.846  19.221
  163    HZ1  LYS  20           HZ1      LYS  20 -16.518   3.119  20.637
  164    HZ2  LYS  20           HZ2      LYS  20 -17.444   2.590  19.334
  165    HZ3  LYS  20           HZ3      LYS  20 -17.684   4.124  19.958
  166    H    THR  21           HN       THR  21 -15.401   3.629  12.433
  167    HA   THR  21           HA       THR  21 -13.088   2.320  13.516
  168    HB   THR  21           HB       THR  21 -15.030   0.897  13.175
  169    HG1  THR  21           HG1      THR  21 -12.774   0.108  12.696
  170   HG21  THR  21          HG21      THR  21 -15.860   0.324  10.901
  171   HG22  THR  21          HG22      THR  21 -14.796   1.555  10.227
  172   HG23  THR  21          HG23      THR  21 -16.117   2.024  11.294
  173    H    GLN  22           HN       GLN  22 -11.275   3.048  12.907
  174    HA   GLN  22           HA       GLN  22 -10.684   3.143  10.068
  175    HB2  GLN  22           HB2      GLN  22 -10.935   5.453  10.850
  176    HB3  GLN  22           HB1      GLN  22  -9.818   5.138  12.166
  177    HG2  GLN  22           HG2      GLN  22  -7.995   4.889  10.621
  178    HG3  GLN  22           HG1      GLN  22  -9.068   5.043   9.239
  179   HE21  GLN  22          HE21      GLN  22  -9.993   7.081   8.784
  180   HE22  GLN  22          HE22      GLN  22  -9.317   8.512   9.455
  181    H    LYS  23           HN       LYS  23  -9.196   1.717   9.633
  182    HA   LYS  23           HA       LYS  23  -7.364   1.026  11.763
  183    HB2  LYS  23           HB2      LYS  23  -7.509  -1.346  10.805
  184    HB3  LYS  23           HB1      LYS  23  -8.796  -0.761  11.843
  185    HG2  LYS  23           HG2      LYS  23 -10.029  -0.150   9.712
  186    HG3  LYS  23           HG1      LYS  23  -8.821  -1.131   8.873
  187    HD2  LYS  23           HD2      LYS  23  -9.393  -3.042  10.190
  188    HD3  LYS  23           HD1      LYS  23 -10.482  -2.060  11.174
  189    HE2  LYS  23           HE2      LYS  23 -11.873  -1.621   9.184
  190    HE3  LYS  23           HE1      LYS  23 -10.786  -2.631   8.230
  191    HZ1  LYS  23           HZ1      LYS  23 -11.435  -4.546   9.551
  192    HZ2  LYS  23           HZ2      LYS  23 -12.827  -3.798   8.956
  193    HZ3  LYS  23           HZ3      LYS  23 -12.380  -3.575  10.544
  194    H    ILE  24           HN       ILE  24  -5.329   0.426  11.185
  195    HA   ILE  24           HA       ILE  24  -4.626   1.353   8.519
  196    HB   ILE  24           HB       ILE  24  -2.907   1.388  11.045
  197   HG12  ILE  24          HG12      ILE  24  -2.986   3.935  10.692
  198   HG13  ILE  24          HG11      ILE  24  -4.321   3.645   9.593
  199   HG21  ILE  24          HG21      ILE  24  -1.587   1.064   9.040
  200   HG22  ILE  24          HG22      ILE  24  -1.300   2.661   9.718
  201   HG23  ILE  24          HG23      ILE  24  -2.329   2.478   8.298
  202   HD11  ILE  24          HD11      ILE  24  -5.628   2.713  11.447
  203   HD12  ILE  24          HD12      ILE  24  -5.096   4.357  11.802
  204   HD13  ILE  24          HD13      ILE  24  -4.273   2.984  12.540
  205    H    TYR  25           HN       TYR  25  -3.589   0.026   7.228
  206    HA   TYR  25           HA       TYR  25  -2.843  -2.662   8.208
  207    HB2  TYR  25           HB2      TYR  25  -3.805  -1.818   5.482
  208    HB3  TYR  25           HB1      TYR  25  -3.338  -3.432   5.956
  209    HD1  TYR  25           HD2      TYR  25  -4.830  -4.710   7.506
  210    HD2  TYR  25           HD1      TYR  25  -6.002  -0.989   5.794
  211    HE1  TYR  25           HE2      TYR  25  -7.180  -5.269   7.896
  212    HE2  TYR  25           HE1      TYR  25  -8.360  -1.548   6.177
  213    HH   TYR  25           HH       TYR  25  -9.646  -3.682   6.390
  214    H    GLU  26           HN       GLU  26  -1.109  -3.636   6.852
  215    HA   GLU  26           HA       GLU  26   0.587  -1.630   5.562
  216    HB2  GLU  26           HB2      GLU  26   1.430  -4.300   6.711
  217    HB3  GLU  26           HB1      GLU  26   2.482  -3.041   6.076
  218    HG2  GLU  26           HG2      GLU  26   1.409  -1.577   7.918
  219    HG3  GLU  26           HG1      GLU  26   0.970  -3.121   8.635
  220    H    ALA  27           HN       ALA  27   1.190  -2.177   3.425
  221    HA   ALA  27           HA       ALA  27   0.052  -4.633   2.352
  222    HB1  ALA  27           HB1      ALA  27  -0.578  -1.975   1.045
  223    HB2  ALA  27           HB2      ALA  27  -1.604  -2.702   2.238
  224    HB3  ALA  27           HB3      ALA  27  -1.300  -3.547   0.731
  225    H    SER  28           HN       SER  28   0.488  -4.546  -0.199
  226    HA   SER  28           HA       SER  28   3.121  -3.452  -0.743
  227    HB2  SER  28           HB2      SER  28   2.446  -6.378  -1.157
  228    HB3  SER  28           HB1      SER  28   3.946  -5.553  -1.607
  229    HG   SER  28           HG       SER  28   3.477  -5.043   0.933
  230    H    ILE  29           HN       ILE  29   3.231  -2.697  -2.718
  231    HA   ILE  29           HA       ILE  29   0.893  -2.279  -4.205
  232    HB   ILE  29           HB       ILE  29   3.721  -2.081  -5.239
  233   HG12  ILE  29          HG12      ILE  29   3.504  -0.748  -3.181
  234   HG13  ILE  29          HG11      ILE  29   3.669   0.294  -4.584
  235   HG21  ILE  29          HG21      ILE  29   1.169  -0.768  -6.146
  236   HG22  ILE  29          HG22      ILE  29   2.091  -2.004  -7.007
  237   HG23  ILE  29          HG23      ILE  29   2.769  -0.392  -6.782
  238   HD11  ILE  29          HD11      ILE  29   1.199   0.619  -4.536
  239   HD12  ILE  29          HD12      ILE  29   2.052   1.237  -3.127
  240   HD13  ILE  29          HD13      ILE  29   1.161  -0.275  -3.015
  241    H    LYS  30           HN       LYS  30  -0.155  -3.434  -5.589
  242    HA   LYS  30           HA       LYS  30   1.037  -5.850  -6.763
  243    HB2  LYS  30           HB2      LYS  30  -1.152  -5.883  -5.421
  244    HB3  LYS  30           HB1      LYS  30  -1.854  -4.920  -6.699
  245    HG2  LYS  30           HG2      LYS  30  -0.694  -7.667  -7.146
  246    HG3  LYS  30           HG1      LYS  30  -2.374  -7.389  -6.719
  247    HD2  LYS  30           HD2      LYS  30  -2.626  -6.026  -8.766
  248    HD3  LYS  30           HD1      LYS  30  -0.935  -6.387  -9.148
  249    HE2  LYS  30           HE2      LYS  30  -1.435  -8.753  -9.297
  250    HE3  LYS  30           HE1      LYS  30  -3.094  -8.472  -8.786
  251    HZ1  LYS  30           HZ1      LYS  30  -3.500  -7.255 -10.823
  252    HZ2  LYS  30           HZ2      LYS  30  -2.905  -8.773 -11.193
  253    HZ3  LYS  30           HZ3      LYS  30  -1.900  -7.448 -11.317
  254    H    SER  31           HN       SER  31  -0.774  -2.888  -7.501
  255    HA   SER  31           HA       SER  31   0.553  -2.653 -10.047
  256    HB2  SER  31           HB2      SER  31  -1.404  -4.072 -10.589
  257    HB3  SER  31           HB1      SER  31  -2.461  -2.909  -9.803
  258    HG   SER  31           HG       SER  31  -2.599  -2.056 -11.712
  259    H    THR  32           HN       THR  32   0.390  -0.483 -10.780
  260    HA   THR  32           HA       THR  32  -1.198   1.299  -9.095
  261    HB   THR  32           HB       THR  32   1.142   2.269 -10.616
  262    HG1  THR  32           HG1      THR  32   1.878   0.550  -9.161
  263   HG21  THR  32          HG21      THR  32  -0.197   3.109  -8.077
  264   HG22  THR  32          HG22      THR  32  -0.494   3.746  -9.681
  265   HG23  THR  32          HG23      THR  32   1.086   3.995  -8.913
  266    H    GLU  33           HN       GLU  33  -2.438   2.586 -10.254
  267    HA   GLU  33           HA       GLU  33  -2.131   2.666 -13.127
  268    HB2  GLU  33           HB2      GLU  33  -4.564   1.475 -11.801
  269    HB3  GLU  33           HB1      GLU  33  -4.520   2.088 -13.460
  270    HG2  GLU  33           HG2      GLU  33  -2.940   0.505 -14.143
  271    HG3  GLU  33           HG1      GLU  33  -2.562   0.031 -12.498
  272    H    ILE  34           HN       ILE  34  -3.595   4.150 -14.110
  273    HA   ILE  34           HA       ILE  34  -3.969   6.344 -12.237
  274    HB   ILE  34           HB       ILE  34  -3.255   6.404 -15.164
  275   HG12  ILE  34          HG12      ILE  34  -1.315   7.820 -14.346
  276   HG13  ILE  34          HG11      ILE  34  -1.857   7.457 -12.713
  277   HG21  ILE  34          HG21      ILE  34  -4.905   8.141 -14.837
  278   HG22  ILE  34          HG22      ILE  34  -3.313   8.858 -15.088
  279   HG23  ILE  34          HG23      ILE  34  -3.998   8.776 -13.462
  280   HD11  ILE  34          HD11      ILE  34  -1.440   5.105 -13.096
  281   HD12  ILE  34          HD12      ILE  34   0.028   6.059 -13.344
  282   HD13  ILE  34          HD13      ILE  34  -0.883   5.445 -14.733
  283    H    ASP  35           HN       ASP  35  -5.839   7.185 -12.026
  284    HA   ASP  35           HA       ASP  35  -7.935   6.476 -13.924
  285    HB2  ASP  35           HB2      ASP  35  -7.988   6.338 -10.950
  286    HB3  ASP  35           HB1      ASP  35  -9.453   6.776 -11.822
  287    H    ASP  36           HN       ASP  36  -8.147   8.182 -14.997
  288    HA   ASP  36           HA       ASP  36  -8.425  10.281 -15.652
  289    HB2  ASP  36           HB2      ASP  36 -10.685   9.615 -14.866
  290    HB3  ASP  36           HB1      ASP  36 -10.341  10.400 -13.330
  291    H    GLY  37           HN       GLY  37  -6.195  10.551 -14.858
  292    HA2  GLY  37           HA2      GLY  37  -4.812  12.388 -14.467
  293    HA3  GLY  37           HA1      GLY  37  -6.121  13.178 -13.626
  294    H    GLU  38           HN       GLU  38  -6.387  10.643 -11.848
  295    HA   GLU  38           HA       GLU  38  -4.062  11.349 -10.214
  296    HB2  GLU  38           HB2      GLU  38  -5.366  10.750  -8.205
  297    HB3  GLU  38           HB1      GLU  38  -6.132  12.029  -9.121
  298    HG2  GLU  38           HG2      GLU  38  -7.698  10.351 -10.063
  299    HG3  GLU  38           HG1      GLU  38  -6.960   9.135  -9.023
  300    H    VAL  39           HN       VAL  39  -2.989   9.701  -9.000
  301    HA   VAL  39           HA       VAL  39  -3.025   7.200 -10.522
  302    HB   VAL  39           HB       VAL  39  -0.933   8.029  -8.522
  303   HG11  VAL  39          HG11      VAL  39   0.510   6.515  -9.867
  304   HG12  VAL  39          HG12      VAL  39  -0.892   6.118 -10.850
  305   HG13  VAL  39          HG13      VAL  39  -0.876   5.712  -9.148
  306   HG21  VAL  39          HG21      VAL  39  -0.903   8.670 -11.473
  307   HG22  VAL  39          HG22      VAL  39   0.423   8.938 -10.341
  308   HG23  VAL  39          HG23      VAL  39  -1.087   9.828 -10.161
  309    H    LEU  40           HN       LEU  40  -3.933   5.516  -9.631
  310    HA   LEU  40           HA       LEU  40  -4.345   5.517  -6.738
  311    HB2  LEU  40           HB2      LEU  40  -5.895   4.057  -8.875
  312    HB3  LEU  40           HB1      LEU  40  -6.224   4.034  -7.154
  313    HG   LEU  40           HG       LEU  40  -6.521   6.394  -9.001
  314   HD11  LEU  40          HD11      LEU  40  -8.890   6.194  -8.437
  315   HD12  LEU  40          HD12      LEU  40  -8.534   4.737  -7.505
  316   HD13  LEU  40          HD13      LEU  40  -8.262   4.759  -9.247
  317   HD21  LEU  40          HD21      LEU  40  -7.003   6.192  -6.032
  318   HD22  LEU  40          HD22      LEU  40  -7.427   7.565  -7.060
  319   HD23  LEU  40          HD23      LEU  40  -5.738   7.128  -6.828
  320    H    TYR  41           HN       TYR  41  -3.829   3.689  -5.627
  321    HA   TYR  41           HA       TYR  41  -2.074   1.903  -7.104
  322    HB2  TYR  41           HB2      TYR  41  -2.104   2.690  -4.189
  323    HB3  TYR  41           HB1      TYR  41  -1.035   1.478  -4.880
  324    HD1  TYR  41           HD2      TYR  41  -1.916   5.113  -5.110
  325    HD2  TYR  41           HD1      TYR  41   1.015   2.119  -5.809
  326    HE1  TYR  41           HE2      TYR  41  -0.328   6.825  -5.644
  327    HE2  TYR  41           HE1      TYR  41   2.657   3.871  -6.342
  328    HH   TYR  41           HH       TYR  41   2.678   6.144  -7.146
  329    H    LEU  42           HN       LEU  42  -2.359  -0.190  -6.962
  330    HA   LEU  42           HA       LEU  42  -4.711  -1.171  -5.543
  331    HB2  LEU  42           HB2      LEU  42  -4.687  -1.492  -8.010
  332    HB3  LEU  42           HB1      LEU  42  -3.145  -2.312  -7.868
  333    HG   LEU  42           HG       LEU  42  -4.222  -4.116  -6.599
  334   HD11  LEU  42          HD11      LEU  42  -6.040  -2.912  -5.563
  335   HD12  LEU  42          HD12      LEU  42  -6.705  -4.205  -6.570
  336   HD13  LEU  42          HD13      LEU  42  -6.723  -2.546  -7.141
  337   HD21  LEU  42          HD21      LEU  42  -3.996  -4.312  -9.017
  338   HD22  LEU  42          HD22      LEU  42  -5.549  -3.502  -9.234
  339   HD23  LEU  42          HD23      LEU  42  -5.481  -5.080  -8.456
  340    H    VAL  43           HN       VAL  43  -4.062  -1.900  -3.698
  341    HA   VAL  43           HA       VAL  43  -1.415  -3.176  -3.501
  342    HB   VAL  43           HB       VAL  43  -1.836  -0.741  -2.628
  343   HG11  VAL  43          HG11      VAL  43  -2.440  -0.438  -0.421
  344   HG12  VAL  43          HG12      VAL  43  -3.086  -2.093  -0.366
  345   HG13  VAL  43          HG13      VAL  43  -3.764  -0.916  -1.475
  346   HG21  VAL  43          HG21      VAL  43   0.187  -1.828  -2.422
  347   HG22  VAL  43          HG22      VAL  43  -0.355  -2.801  -1.103
  348   HG23  VAL  43          HG23      VAL  43  -0.194  -1.017  -0.918
  349    H    HIS  44           HN       HIS  44  -1.380  -5.007  -2.270
  350    HA   HIS  44           HA       HIS  44  -3.839  -5.584  -0.817
  351    HB2  HIS  44           HB2      HIS  44  -3.453  -8.047  -1.112
  352    HB3  HIS  44           HB1      HIS  44  -3.854  -7.203  -2.592
  353    HD1  HIS  44           HD1      HIS  44  -2.505  -7.752  -4.451
  354    HD2  HIS  44           HD2      HIS  44  -0.518  -8.584  -0.920
  355    HE1  HIS  44           HE1      HIS  44  -0.342  -8.929  -5.136
  356    HE2  HIS  44           HE2      HIS  44   0.904  -9.250  -2.989
  357    H    TYR  45           HN       TYR  45  -3.683  -6.696   1.081
  358    HA   TYR  45           HA       TYR  45  -1.521  -5.588   2.581
  359    HB2  TYR  45           HB2      TYR  45  -3.863  -7.248   3.511
  360    HB3  TYR  45           HB1      TYR  45  -2.838  -6.207   4.512
  361    HD1  TYR  45           HD1      TYR  45  -2.673  -3.732   3.442
  362    HD2  TYR  45           HD2      TYR  45  -5.965  -6.371   3.031
  363    HE1  TYR  45           HE1      TYR  45  -4.140  -1.810   2.961
  364    HE2  TYR  45           HE2      TYR  45  -7.449  -4.462   2.566
  365    HH   TYR  45           HH       TYR  45  -7.547  -2.070   2.903
  366    H    TYR  46           HN       TYR  46   0.380  -6.671   2.587
  367    HA   TYR  46           HA       TYR  46   0.594  -9.406   1.966
  368    HB2  TYR  46           HB2      TYR  46   2.971  -9.241   2.463
  369    HB3  TYR  46           HB1      TYR  46   2.466  -7.811   1.589
  370    HD1  TYR  46           HD1      TYR  46   2.345  -5.621   2.795
  371    HD2  TYR  46           HD2      TYR  46   3.862  -9.119   4.672
  372    HE1  TYR  46           HE1      TYR  46   3.412  -4.233   4.519
  373    HE2  TYR  46           HE2      TYR  46   4.925  -7.742   6.401
  374    HH   TYR  46           HH       TYR  46   4.185  -4.521   6.900
  375    H    GLY  47           HN       GLY  47   0.634 -11.190   3.120
  376    HA2  GLY  47           HA2      GLY  47   0.492 -12.613   4.922
  377    HA3  GLY  47           HA1      GLY  47   0.970 -11.277   5.958
  378    H    TRP  48           HN       TRP  48  -1.099  -9.564   5.311
  379    HA   TRP  48           HA       TRP  48  -3.114 -10.417   7.153
  380    HB2  TRP  48           HB2      TRP  48  -2.113  -8.031   6.494
  381    HB3  TRP  48           HB1      TRP  48  -3.475  -8.054   5.387
  382    HD1  TRP  48           HD1      TRP  48  -5.913  -8.799   6.896
  383    HE1  TRP  48           HE1      TRP  48  -6.701  -7.612   9.025
  384    HE3  TRP  48           HE3      TRP  48  -1.483  -6.683   8.316
  385    HZ2  TRP  48           HZ2      TRP  48  -5.580  -5.961  11.053
  386    HZ3  TRP  48           HZ3      TRP  48  -1.427  -5.312  10.353
  387    HH2  TRP  48           HH2      TRP  48  -3.436  -4.958  11.691
  388    H    ASN  49           HN       ASN  49  -3.366  -9.296   3.761
  389    HA   ASN  49           HA       ASN  49  -5.300 -11.360   3.133
  390    HB2  ASN  49           HB2      ASN  49  -5.936  -8.413   2.722
  391    HB3  ASN  49           HB1      ASN  49  -6.811  -9.760   2.016
  392   HD21  ASN  49          HD21      ASN  49  -8.138 -11.003   3.316
  393   HD22  ASN  49          HD22      ASN  49  -8.693 -10.442   4.842
  394    H    VAL  50           HN       VAL  50  -4.061 -12.220   1.577
  395    HA   VAL  50           HA       VAL  50  -2.471 -10.489  -0.075
  396    HB   VAL  50           HB       VAL  50  -1.534 -12.515  -1.105
  397   HG11  VAL  50          HG11      VAL  50  -0.419 -13.393   0.891
  398   HG12  VAL  50          HG12      VAL  50  -1.625 -12.601   1.903
  399   HG13  VAL  50          HG13      VAL  50  -0.531 -11.633   0.916
  400   HG21  VAL  50          HG21      VAL  50  -2.126 -14.742  -0.252
  401   HG22  VAL  50          HG22      VAL  50  -3.515 -13.967  -1.018
  402   HG23  VAL  50          HG23      VAL  50  -3.396 -14.024   0.739
  403    H    ARG  51           HN       ARG  51  -5.491 -12.126  -0.407
  404    HA   ARG  51           HA       ARG  51  -5.447 -11.563  -3.286
  405    HB2  ARG  51           HB2      ARG  51  -5.996 -13.873  -2.668
  406    HB3  ARG  51           HB1      ARG  51  -7.318 -13.313  -1.671
  407    HG2  ARG  51           HG2      ARG  51  -8.140 -14.304  -3.735
  408    HG3  ARG  51           HG1      ARG  51  -8.537 -12.597  -3.672
  409    HD2  ARG  51           HD2      ARG  51  -6.139 -13.653  -5.186
  410    HD3  ARG  51           HD1      ARG  51  -7.739 -13.553  -5.908
  411    HE   ARG  51           HE       ARG  51  -6.322 -11.155  -4.885
  412   HH11  ARG  51          HH11      ARG  51  -8.082 -12.764  -7.516
  413   HH12  ARG  51          HH12      ARG  51  -8.110 -11.367  -8.495
  414   HH21  ARG  51          HH21      ARG  51  -6.393  -9.281  -6.225
  415   HH22  ARG  51          HH22      ARG  51  -7.149  -9.346  -7.753
  416    H    TYR  52           HN       TYR  52  -6.214  -9.938  -0.661
  417    HA   TYR  52           HA       TYR  52  -8.582  -8.754  -1.896
  418    HB2  TYR  52           HB2      TYR  52  -8.917  -9.376   0.497
  419    HB3  TYR  52           HB1      TYR  52  -7.556  -8.339   0.921
  420    HD1  TYR  52           HD2      TYR  52 -11.035  -8.317  -0.347
  421    HD2  TYR  52           HD1      TYR  52  -7.796  -6.009   1.137
  422    HE1  TYR  52           HE2      TYR  52 -12.533  -6.368  -0.104
  423    HE2  TYR  52           HE1      TYR  52  -9.268  -4.072   1.376
  424    HH   TYR  52           HH       TYR  52 -11.311  -3.230   0.465
  425    H    ASP  53           HN       ASP  53  -7.767  -7.529  -3.391
  426    HA   ASP  53           HA       ASP  53  -5.611  -5.704  -2.746
  427    HB2  ASP  53           HB2      ASP  53  -6.974  -6.307  -5.388
  428    HB3  ASP  53           HB1      ASP  53  -5.624  -5.201  -5.165
  429    H    GLU  54           HN       GLU  54  -5.903  -3.612  -2.495
  430    HA   GLU  54           HA       GLU  54  -8.637  -2.510  -2.753
  431    HB2  GLU  54           HB2      GLU  54  -7.954  -3.068  -0.404
  432    HB3  GLU  54           HB1      GLU  54  -6.561  -2.022  -0.593
  433    HG2  GLU  54           HG2      GLU  54  -8.272  -0.912   0.679
  434    HG3  GLU  54           HG1      GLU  54  -8.079  -0.111  -0.882
  435    H    TRP  55           HN       TRP  55  -8.789  -0.327  -3.055
  436    HA   TRP  55           HA       TRP  55  -6.573   0.716  -4.655
  437    HB2  TRP  55           HB2      TRP  55  -9.521   1.154  -4.825
  438    HB3  TRP  55           HB1      TRP  55  -8.349   2.104  -5.731
  439    HD1  TRP  55           HD1      TRP  55  -9.777  -1.440  -5.498
  440    HE1  TRP  55           HE1      TRP  55  -9.303  -2.641  -7.757
  441    HE3  TRP  55           HE3      TRP  55  -6.695   2.029  -7.622
  442    HZ2  TRP  55           HZ2      TRP  55  -7.753  -2.166 -10.096
  443    HZ3  TRP  55           HZ3      TRP  55  -5.716   1.589  -9.829
  444    HH2  TRP  55           HH2      TRP  55  -6.240  -0.473 -11.049
  445    H    VAL  56           HN       VAL  56  -5.489   2.101  -3.608
  446    HA   VAL  56           HA       VAL  56  -6.857   4.283  -2.259
  447    HB   VAL  56           HB       VAL  56  -5.040   4.266  -0.479
  448   HG11  VAL  56          HG11      VAL  56  -6.051   2.495   0.878
  449   HG12  VAL  56          HG12      VAL  56  -6.810   1.825  -0.565
  450   HG13  VAL  56          HG13      VAL  56  -7.283   3.420   0.018
  451   HG21  VAL  56          HG21      VAL  56  -4.521   1.480  -1.529
  452   HG22  VAL  56          HG22      VAL  56  -3.797   2.202  -0.085
  453   HG23  VAL  56          HG23      VAL  56  -3.431   2.858  -1.670
  454    H    LYS  57           HN       LYS  57  -5.913   6.271  -2.645
  455    HA   LYS  57           HA       LYS  57  -3.900   6.333  -4.665
  456    HB2  LYS  57           HB2      LYS  57  -5.865   7.839  -4.621
  457    HB3  LYS  57           HB1      LYS  57  -5.273   8.532  -3.126
  458    HG2  LYS  57           HG2      LYS  57  -3.508   9.613  -4.191
  459    HG3  LYS  57           HG1      LYS  57  -3.659   8.625  -5.649
  460    HD2  LYS  57           HD2      LYS  57  -4.570  10.848  -6.049
  461    HD3  LYS  57           HD1      LYS  57  -5.821   9.594  -6.075
  462    HE2  LYS  57           HE2      LYS  57  -6.439  10.179  -3.782
  463    HE3  LYS  57           HE1      LYS  57  -5.251  11.484  -3.798
  464    HZ1  LYS  57           HZ1      LYS  57  -7.508  11.214  -5.675
  465    HZ2  LYS  57           HZ2      LYS  57  -6.487  12.558  -5.548
  466    HZ3  LYS  57           HZ3      LYS  57  -7.556  12.174  -4.296
  467    H    ALA  58           HN       ALA  58  -2.049   7.998  -4.295
  468    HA   ALA  58           HA       ALA  58  -0.270   6.829  -2.555
  469    HB1  ALA  58           HB1      ALA  58   0.433   8.036  -4.503
  470    HB2  ALA  58           HB2      ALA  58   1.243   8.676  -3.077
  471    HB3  ALA  58           HB3      ALA  58  -0.106   9.557  -3.800
  472    H    ASP  59           HN       ASP  59  -2.419   9.491  -2.056
  473    HA   ASP  59           HA       ASP  59  -1.067  10.601   0.246
  474    HB2  ASP  59           HB2      ASP  59  -2.813  12.197   0.329
  475    HB3  ASP  59           HB1      ASP  59  -2.538  11.896  -1.383
  476    H    ARG  60           HN       ARG  60  -3.273   8.118  -0.331
  477    HA   ARG  60           HA       ARG  60  -4.435   8.017   2.365
  478    HB2  ARG  60           HB2      ARG  60  -5.767   7.668   0.268
  479    HB3  ARG  60           HB1      ARG  60  -4.777   6.278  -0.090
  480    HG2  ARG  60           HG2      ARG  60  -6.821   5.486   0.771
  481    HG3  ARG  60           HG1      ARG  60  -5.620   5.256   2.041
  482    HD2  ARG  60           HD2      ARG  60  -6.420   7.205   3.204
  483    HD3  ARG  60           HD1      ARG  60  -7.538   7.581   1.887
  484    HE   ARG  60           HE       ARG  60  -7.643   5.130   3.464
  485   HH11  ARG  60          HH11      ARG  60  -9.263   8.037   2.322
  486   HH12  ARG  60          HH12      ARG  60 -10.848   7.429   2.466
  487   HH21  ARG  60          HH21      ARG  60  -9.924   4.240   3.642
  488   HH22  ARG  60          HH22      ARG  60 -11.222   5.258   3.215
  489    H    ILE  61           HN       ILE  61  -1.701   7.124   0.816
  490    HA   ILE  61           HA       ILE  61  -1.257   4.677   2.341
  491    HB   ILE  61           HB       ILE  61   0.125   5.789  -0.136
  492   HG12  ILE  61          HG12      ILE  61  -1.706   3.420   0.211
  493   HG13  ILE  61          HG11      ILE  61  -2.051   4.903  -0.669
  494   HG21  ILE  61          HG21      ILE  61   0.622   3.189   1.278
  495   HG22  ILE  61          HG22      ILE  61   1.717   4.577   1.255
  496   HG23  ILE  61          HG23      ILE  61   1.369   3.694  -0.239
  497   HD11  ILE  61          HD11      ILE  61  -1.532   3.083  -2.184
  498   HD12  ILE  61          HD12      ILE  61   0.003   2.832  -1.375
  499   HD13  ILE  61          HD13      ILE  61  -0.282   4.331  -2.280
  500    H    ILE  62           HN       ILE  62   0.653   4.621   3.549
  501    HA   ILE  62           HA       ILE  62   2.070   7.178   3.875
  502    HB   ILE  62           HB       ILE  62   2.209   4.782   5.756
  503   HG12  ILE  62          HG12      ILE  62   1.010   6.369   7.409
  504   HG13  ILE  62          HG11      ILE  62   0.423   7.209   5.968
  505   HG21  ILE  62          HG21      ILE  62   3.255   6.327   7.326
  506   HG22  ILE  62          HG22      ILE  62   3.200   7.581   6.087
  507   HG23  ILE  62          HG23      ILE  62   4.164   6.128   5.828
  508   HD11  ILE  62          HD11      ILE  62  -1.263   5.720   6.735
  509   HD12  ILE  62          HD12      ILE  62  -0.117   4.400   6.884
  510   HD13  ILE  62          HD13      ILE  62  -0.581   4.994   5.271
  511    H    TRP  63           HN       TRP  63   3.898   7.150   2.718
  512    HA   TRP  63           HA       TRP  63   4.894   4.664   1.724
  513    HB2  TRP  63           HB2      TRP  63   5.740   7.519   1.236
  514    HB3  TRP  63           HB1      TRP  63   6.554   6.134   0.495
  515    HD1  TRP  63           HD1      TRP  63   3.330   8.145   0.289
  516    HE1  TRP  63           HE1      TRP  63   1.937   7.308  -1.681
  517    HE3  TRP  63           HE3      TRP  63   6.122   4.066  -0.958
  518    HZ2  TRP  63           HZ2      TRP  63   2.022   5.163  -3.559
  519    HZ3  TRP  63           HZ3      TRP  63   5.412   2.675  -2.851
  520    HH2  TRP  63           HH2      TRP  63   3.418   3.190  -4.114
  521    HA   PRO  64           HA       PRO  64   7.608   4.472   5.287
  522    HB2  PRO  64           HB2      PRO  64   8.202   1.754   4.534
  523    HB3  PRO  64           HB1      PRO  64   7.275   2.339   5.918
  524    HG2  PRO  64           HG2      PRO  64   6.099   0.994   3.904
  525    HG3  PRO  64           HG1      PRO  64   5.310   2.322   4.798
  526    HD2  PRO  64           HD2      PRO  64   6.690   2.448   2.128
  527    HD3  PRO  64           HD1      PRO  64   5.073   3.029   2.621
  528    H    LEU  65           HN       LEU  65   9.418   5.446   5.129
  529    HA   LEU  65           HA       LEU  65  11.615   3.917   4.287
  530    HB2  LEU  65           HB2      LEU  65  11.128   5.072   2.177
  531    HB3  LEU  65           HB1      LEU  65  11.195   6.620   3.001
  532    HG   LEU  65           HG       LEU  65  13.547   6.399   3.401
  533   HD11  LEU  65          HD11      LEU  65  13.568   4.069   3.949
  534   HD12  LEU  65          HD12      LEU  65  14.788   4.374   2.698
  535   HD13  LEU  65          HD13      LEU  65  13.235   3.614   2.283
  536   HD21  LEU  65          HD21      LEU  65  12.876   7.176   1.184
  537   HD22  LEU  65          HD22      LEU  65  12.879   5.512   0.601
  538   HD23  LEU  65          HD23      LEU  65  14.392   6.273   1.112
  539    H    ASP  66           HN       ASP  66  12.011   3.809   6.299
  540    HA   ASP  66           HA       ASP  66  12.661   4.250   8.340
  541    HB2  ASP  66           HB2      ASP  66  14.722   5.016   7.173
  542    HB3  ASP  66           HB1      ASP  66  14.090   6.659   7.196
  543    H    LYS  67           HN       LYS  67  10.538   4.566   8.669
  544    HA   LYS  67           HA       LYS  67   9.477   7.219   9.044
  545    HB2  LYS  67           HB2      LYS  67   7.954   5.430   8.409
  546    HB3  LYS  67           HB1      LYS  67   8.384   4.507   9.836
  547    HG2  LYS  67           HG2      LYS  67   6.199   5.500  10.143
  548    HG3  LYS  67           HG1      LYS  67   7.360   6.228  11.247
  549    HD2  LYS  67           HD2      LYS  67   5.909   7.935  10.336
  550    HD3  LYS  67           HD1      LYS  67   7.550   8.174   9.751
  551    HE2  LYS  67           HE2      LYS  67   6.976   7.186   7.619
  552    HE3  LYS  67           HE1      LYS  67   5.361   6.793   8.204
  553    HZ1  LYS  67           HZ1      LYS  67   5.420   8.805   6.832
  554    HZ2  LYS  67           HZ2      LYS  67   6.443   9.538   7.941
  555    HZ3  LYS  67           HZ3      LYS  67   4.869   9.121   8.388
  556    H    GLY  68           HN       GLY  68  10.982   4.807  11.010
  557    HA2  GLY  68           HA2      GLY  68  12.237   5.513  12.948
  558    HA3  GLY  68           HA1      GLY  68  11.013   6.743  13.230
  559    H    LEU  69           HN       LEU  69   9.863   3.670  12.317
  560    HA   LEU  69           HA       LEU  69   9.398   3.000  15.118
  561    HB2  LEU  69           HB2      LEU  69   7.398   2.738  12.873
  562    HB3  LEU  69           HB1      LEU  69   7.275   1.874  14.386
  563    HG   LEU  69           HG       LEU  69   7.135   4.122  15.549
  564   HD11  LEU  69          HD11      LEU  69   8.072   5.519  13.780
  565   HD12  LEU  69          HD12      LEU  69   6.455   6.050  14.249
  566   HD13  LEU  69          HD13      LEU  69   6.685   5.131  12.762
  567   HD21  LEU  69          HD21      LEU  69   5.178   2.742  15.192
  568   HD22  LEU  69          HD22      LEU  69   4.982   3.409  13.572
  569   HD23  LEU  69          HD23      LEU  69   4.773   4.447  14.982
  570    H    GLU  70           HN       GLU  70  10.878   1.518  15.317
  571    HA   GLU  70           HA       GLU  70  10.901  -0.719  13.451
  572    HB2  GLU  70           HB2      GLU  70  13.070   0.232  14.344
  573    HB3  GLU  70           HB1      GLU  70  12.594  -0.326  15.940
  574    HG2  GLU  70           HG2      GLU  70  14.196  -1.812  14.775
  575    HG3  GLU  70           HG1      GLU  70  12.697  -2.609  15.251
  576    H    HIS  71           HN       HIS  71  10.029   0.212  16.648
  577    HA   HIS  71           HA       HIS  71   8.700  -2.325  17.140
  578    HB2  HIS  71           HB2      HIS  71   8.716   0.251  18.782
  579    HB3  HIS  71           HB1      HIS  71   7.957  -1.255  19.282
  580    HD1  HIS  71           HD1      HIS  71   9.452  -2.996  20.379
  581    HD2  HIS  71           HD2      HIS  71  11.591   0.209  18.839
  582    HE1  HIS  71           HE1      HIS  71  11.781  -3.264  21.230
  583    HE2  HIS  71           HE2      HIS  71  13.087  -1.432  20.137
  584    H    HIS  72           HN       HIS  72   7.339  -2.391  15.564
  585    HA   HIS  72           HA       HIS  72   6.218  -0.407  14.100
  586    HB2  HIS  72           HB2      HIS  72   6.046  -3.208  14.181
  587    HB3  HIS  72           HB1      HIS  72   4.424  -2.563  13.991
  588    HD1  HIS  72           HD1      HIS  72   7.696  -2.845  12.193
  589    HD2  HIS  72           HD2      HIS  72   3.943  -1.188  11.637
  590    HE1  HIS  72           HE1      HIS  72   7.578  -2.252   9.777
  591    HE2  HIS  72           HE2      HIS  72   5.121  -1.707   9.472
  592    H    HIS  73           HN       HIS  73   4.540  -1.998  16.789
  593    HA   HIS  73           HA       HIS  73   2.208  -0.443  16.168
  594    HB2  HIS  73           HB2      HIS  73   2.759  -2.447  18.329
  595    HB3  HIS  73           HB1      HIS  73   1.303  -1.460  18.350
  596    HD1  HIS  73           HD1      HIS  73  -0.604  -2.357  17.108
  597    HD2  HIS  73           HD2      HIS  73   2.947  -4.069  15.845
  598    HE1  HIS  73           HE1      HIS  73  -1.269  -4.167  15.489
  599    HE2  HIS  73           HE2      HIS  73   0.907  -5.050  14.597
  600    H    HIS  74           HN       HIS  74   4.804  -0.236  18.474
  601    HA   HIS  74           HA       HIS  74   5.452   1.378  19.962
  602    HB2  HIS  74           HB2      HIS  74   5.133   2.830  17.880
  603    HB3  HIS  74           HB1      HIS  74   3.522   3.209  18.467
  604    HD1  HIS  74           HD1      HIS  74   3.348   5.222  20.016
  605    HD2  HIS  74           HD2      HIS  74   7.255   3.869  19.582
  606    HE1  HIS  74           HE1      HIS  74   4.760   6.936  21.080
  607    HE2  HIS  74           HE2      HIS  74   7.058   6.313  20.360
  608    H    HIS  75           HN       HIS  75   3.183  -0.313  20.389
  609    HA   HIS  75           HA       HIS  75   1.728   1.138  22.490
  610    HB2  HIS  75           HB2      HIS  75   0.259   0.880  20.522
  611    HB3  HIS  75           HB1      HIS  75   0.615  -0.836  20.467
  612    HD1  HIS  75           HD1      HIS  75  -1.024  -2.287  21.603
  613    HD2  HIS  75           HD2      HIS  75  -1.238   1.621  22.957
  614    HE1  HIS  75           HE1      HIS  75  -2.997  -2.221  23.164
  615    HE2  HIS  75           HE2      HIS  75  -3.012   0.125  24.066
  616    H    HIS  76           HN       HIS  76   1.894   0.077  24.417
  617    HA   HIS  76           HA       HIS  76   2.410  -2.775  24.461
  618    HB2  HIS  76           HB2      HIS  76   4.223  -0.734  25.791
  619    HB3  HIS  76           HB1      HIS  76   4.229  -2.451  26.161
  620    HD1  HIS  76           HD1      HIS  76   5.508   0.044  23.774
  621    HD2  HIS  76           HD2      HIS  76   5.292  -4.084  24.074
  622    HE1  HIS  76           HE1      HIS  76   7.083  -0.825  22.048
  623    HE2  HIS  76           HE2      HIS  76   7.168  -3.284  22.476
  Start of MODEL   13
    1    H1   GLU   1           HT1      GLU   1  21.757   1.271 -12.753
    2    H2   GLU   1           HT2      GLU   1  21.496   0.076 -13.940
    3    H3   GLU   1           HT3      GLU   1  20.448   0.232 -12.629
    4    HA   GLU   1           HA       GLU   1  20.832   2.344 -14.629
    5    HB2  GLU   1           HB2      GLU   1  19.721   0.304 -15.571
    6    HB3  GLU   1           HB1      GLU   1  18.553   0.364 -14.269
    7    HG2  GLU   1           HG2      GLU   1  17.747   1.222 -16.472
    8    HG3  GLU   1           HG1      GLU   1  17.562   2.344 -15.134
    9    H    ASP   2           HN       ASP   2  19.302   4.110 -14.311
   10    HA   ASP   2           HA       ASP   2  18.993   4.688 -11.503
   11    HB2  ASP   2           HB2      ASP   2  18.335   6.292 -13.967
   12    HB3  ASP   2           HB1      ASP   2  17.951   6.849 -12.342
   13    H    MET   3           HN       MET   3  17.112   3.425 -13.938
   14    HA   MET   3           HA       MET   3  14.535   4.004 -12.883
   15    HB2  MET   3           HB2      MET   3  14.810   3.412 -15.242
   16    HB3  MET   3           HB1      MET   3  15.478   1.856 -14.787
   17    HG2  MET   3           HG2      MET   3  13.333   1.220 -13.793
   18    HG3  MET   3           HG1      MET   3  12.656   2.774 -14.268
   19    HE1  MET   3           HE1      MET   3  10.895   0.214 -16.677
   20    HE2  MET   3           HE2      MET   3  10.657   1.462 -15.453
   21    HE3  MET   3           HE3      MET   3  11.372  -0.084 -15.005
   22    H    GLU   4           HN       GLU   4  13.936   3.253 -10.963
   23    HA   GLU   4           HA       GLU   4  14.783   0.721  -9.972
   24    HB2  GLU   4           HB2      GLU   4  12.539   2.580  -9.116
   25    HB3  GLU   4           HB1      GLU   4  12.984   1.121  -8.242
   26    HG2  GLU   4           HG2      GLU   4  15.190   2.017  -7.794
   27    HG3  GLU   4           HG1      GLU   4  14.822   3.447  -8.746
   28    HA   PRO   5           HA       PRO   5  12.073  -1.236 -12.919
   29    HB2  PRO   5           HB2      PRO   5  12.745  -3.773 -11.611
   30    HB3  PRO   5           HB1      PRO   5  13.064  -3.245 -13.265
   31    HG2  PRO   5           HG2      PRO   5  15.039  -3.455 -11.455
   32    HG3  PRO   5           HG1      PRO   5  15.030  -2.185 -12.697
   33    HD2  PRO   5           HD2      PRO   5  14.280  -2.006  -9.801
   34    HD3  PRO   5           HD1      PRO   5  15.249  -0.905 -10.813
   35    H    CYS   6           HN       CYS   6  10.303  -0.254 -11.762
   36    HA   CYS   6           HA       CYS   6   8.110  -0.405 -11.283
   37    HB2  CYS   6           HB2      CYS   6   8.481  -3.397 -11.085
   38    HB3  CYS   6           HB1      CYS   6   6.952  -2.541 -11.240
   39    HG   CYS   6           HG       CYS   6   8.182  -1.400 -13.776
   40    H    LEU   7           HN       LEU   7   6.608  -1.017  -9.514
   41    HA   LEU   7           HA       LEU   7   8.085  -1.101  -6.994
   42    HB2  LEU   7           HB2      LEU   7   6.404   0.319  -5.971
   43    HB3  LEU   7           HB1      LEU   7   7.080   1.101  -7.372
   44    HG   LEU   7           HG       LEU   7   4.351  -0.219  -7.304
   45   HD11  LEU   7          HD11      LEU   7   3.474   2.054  -7.182
   46   HD12  LEU   7          HD12      LEU   7   5.116   2.681  -7.037
   47   HD13  LEU   7          HD13      LEU   7   4.448   1.653  -5.766
   48   HD21  LEU   7          HD21      LEU   7   3.940   1.206  -9.315
   49   HD22  LEU   7          HD22      LEU   7   5.107  -0.055  -9.592
   50   HD23  LEU   7          HD23      LEU   7   5.657   1.613  -9.344
   51    H    THR   8           HN       THR   8   6.911  -3.247  -8.652
   52    HA   THR   8           HA       THR   8   4.635  -4.261  -7.341
   53    HB   THR   8           HB       THR   8   5.511  -6.408  -8.545
   54    HG1  THR   8           HG1      THR   8   6.829  -5.497 -10.423
   55   HG21  THR   8          HG21      THR   8   4.629  -5.594 -10.677
   56   HG22  THR   8          HG22      THR   8   4.780  -3.931 -10.105
   57   HG23  THR   8          HG23      THR   8   3.636  -5.029  -9.334
   58    H    GLY   9           HN       GLY   9   4.681  -4.947  -5.298
   59    HA2  GLY   9           HA2      GLY   9   5.343  -6.535  -3.674
   60    HA3  GLY   9           HA1      GLY   9   6.898  -6.671  -4.482
   61    H    THR  10           HN       THR  10   6.086  -3.404  -4.215
   62    HA   THR  10           HA       THR  10   7.931  -3.047  -2.054
   63    HB   THR  10           HB       THR  10   6.099  -1.040  -3.375
   64    HG1  THR  10           HG1      THR  10   8.127  -2.302  -4.412
   65   HG21  THR  10          HG21      THR  10   7.679   0.664  -2.516
   66   HG22  THR  10          HG22      THR  10   8.584  -0.612  -1.702
   67   HG23  THR  10          HG23      THR  10   6.928  -0.254  -1.209
   68    H    LYS  11           HN       LYS  11   7.417  -2.897   0.002
   69    HA   LYS  11           HA       LYS  11   4.617  -3.239   0.680
   70    HB2  LYS  11           HB2      LYS  11   7.085  -3.813   2.309
   71    HB3  LYS  11           HB1      LYS  11   5.438  -4.013   2.900
   72    HG2  LYS  11           HG2      LYS  11   5.021  -5.561   0.996
   73    HG3  LYS  11           HG1      LYS  11   6.731  -5.455   0.609
   74    HD2  LYS  11           HD2      LYS  11   7.312  -6.455   2.727
   75    HD3  LYS  11           HD1      LYS  11   5.621  -6.432   3.242
   76    HE2  LYS  11           HE2      LYS  11   5.020  -7.916   1.419
   77    HE3  LYS  11           HE1      LYS  11   6.681  -7.928   0.844
   78    HZ1  LYS  11           HZ1      LYS  11   5.811  -8.923   3.502
   79    HZ2  LYS  11           HZ2      LYS  11   7.356  -9.084   2.821
   80    HZ3  LYS  11           HZ3      LYS  11   6.051  -9.891   2.157
   81    H    VAL  12           HN       VAL  12   3.459  -1.843   1.618
   82    HA   VAL  12           HA       VAL  12   4.673   0.604   2.707
   83    HB   VAL  12           HB       VAL  12   2.904   1.905   1.616
   84   HG11  VAL  12          HG11      VAL  12   3.653   1.730  -0.708
   85   HG12  VAL  12          HG12      VAL  12   4.399   0.177  -0.342
   86   HG13  VAL  12          HG13      VAL  12   5.008   1.645   0.416
   87   HG21  VAL  12          HG21      VAL  12   1.172   0.176   1.528
   88   HG22  VAL  12          HG22      VAL  12   2.085  -0.693   0.294
   89   HG23  VAL  12          HG23      VAL  12   1.415   0.903  -0.058
   90    H    LYS  13           HN       LYS  13   2.661   1.900   3.702
   91    HA   LYS  13           HA       LYS  13   0.911  -0.006   4.998
   92    HB2  LYS  13           HB2      LYS  13   2.621   0.686   6.615
   93    HB3  LYS  13           HB1      LYS  13   2.297   2.373   6.272
   94    HG2  LYS  13           HG2      LYS  13   0.249   2.324   7.394
   95    HG3  LYS  13           HG1      LYS  13   0.204   0.562   7.415
   96    HD2  LYS  13           HD2      LYS  13   0.798   1.636   9.603
   97    HD3  LYS  13           HD1      LYS  13   1.972   0.455   9.024
   98    HE2  LYS  13           HE2      LYS  13   3.362   2.234   8.189
   99    HE3  LYS  13           HE1      LYS  13   2.207   3.458   8.735
  100    HZ1  LYS  13           HZ1      LYS  13   2.630   2.685  11.032
  101    HZ2  LYS  13           HZ2      LYS  13   4.037   3.224  10.275
  102    HZ3  LYS  13           HZ3      LYS  13   3.774   1.582  10.443
  103    H    VAL  14           HN       VAL  14  -1.199   0.838   5.413
  104    HA   VAL  14           HA       VAL  14  -1.854   3.117   3.682
  105    HB   VAL  14           HB       VAL  14  -3.276   0.431   3.812
  106   HG11  VAL  14          HG11      VAL  14  -4.006   2.841   2.155
  107   HG12  VAL  14          HG12      VAL  14  -4.860   2.292   3.598
  108   HG13  VAL  14          HG13      VAL  14  -4.801   1.260   2.165
  109   HG21  VAL  14          HG21      VAL  14  -1.250   0.363   2.447
  110   HG22  VAL  14          HG22      VAL  14  -1.807   1.754   1.519
  111   HG23  VAL  14          HG23      VAL  14  -2.689   0.234   1.439
  112    H    LYS  15           HN       LYS  15  -3.384   4.441   4.427
  113    HA   LYS  15           HA       LYS  15  -4.516   3.963   7.102
  114    HB2  LYS  15           HB2      LYS  15  -2.967   5.848   6.955
  115    HB3  LYS  15           HB1      LYS  15  -3.846   6.474   5.565
  116    HG2  LYS  15           HG2      LYS  15  -5.791   6.843   7.046
  117    HG3  LYS  15           HG1      LYS  15  -4.794   6.338   8.416
  118    HD2  LYS  15           HD2      LYS  15  -3.230   8.134   7.991
  119    HD3  LYS  15           HD1      LYS  15  -4.114   8.598   6.538
  120    HE2  LYS  15           HE2      LYS  15  -6.062   9.130   7.911
  121    HE3  LYS  15           HE1      LYS  15  -5.157   8.691   9.357
  122    HZ1  LYS  15           HZ1      LYS  15  -5.147  11.066   9.018
  123    HZ2  LYS  15           HZ2      LYS  15  -4.481  10.898   7.483
  124    HZ3  LYS  15           HZ3      LYS  15  -3.587  10.464   8.846
  125    H    TYR  16           HN       TYR  16  -6.625   3.230   6.724
  126    HA   TYR  16           HA       TYR  16  -8.179   4.707   4.693
  127    HB2  TYR  16           HB2      TYR  16  -7.264   2.308   4.124
  128    HB3  TYR  16           HB1      TYR  16  -8.558   1.776   5.176
  129    HD1  TYR  16           HD1      TYR  16 -10.916   3.086   4.518
  130    HD2  TYR  16           HD2      TYR  16  -7.691   2.197   1.923
  131    HE1  TYR  16           HE1      TYR  16 -12.456   3.120   2.586
  132    HE2  TYR  16           HE2      TYR  16  -9.211   2.236  -0.011
  133    HH   TYR  16           HH       TYR  16 -11.547   1.934  -0.469
  134    H    GLY  17           HN       GLY  17  -9.740   5.757   5.882
  135    HA2  GLY  17           HA2      GLY  17 -11.301   4.096   7.670
  136    HA3  GLY  17           HA1      GLY  17 -10.501   5.475   8.389
  137    H    ARG  18           HN       ARG  18 -13.170   4.897   8.399
  138    HA   ARG  18           HA       ARG  18 -14.098   7.388   7.411
  139    HB2  ARG  18           HB2      ARG  18 -16.189   6.345   6.505
  140    HB3  ARG  18           HB1      ARG  18 -14.744   6.009   5.575
  141    HG2  ARG  18           HG2      ARG  18 -14.656   3.747   6.666
  142    HG3  ARG  18           HG1      ARG  18 -16.190   4.116   7.435
  143    HD2  ARG  18           HD2      ARG  18 -15.663   4.026   4.470
  144    HD3  ARG  18           HD1      ARG  18 -16.599   2.862   5.404
  145    HE   ARG  18           HE       ARG  18 -17.981   4.984   5.952
  146   HH11  ARG  18          HH11      ARG  18 -16.623   4.198   2.772
  147   HH12  ARG  18          HH12      ARG  18 -17.803   5.045   1.908
  148   HH21  ARG  18          HH21      ARG  18 -19.571   6.140   4.780
  149   HH22  ARG  18          HH22      ARG  18 -19.513   6.224   3.082
  150    H    GLY  19           HN       GLY  19 -14.520   8.288   9.226
  151    HA2  GLY  19           HA2      GLY  19 -15.766   8.828  11.070
  152    HA3  GLY  19           HA1      GLY  19 -16.670   7.328  10.866
  153    H    LYS  20           HN       LYS  20 -16.491   6.113  12.549
  154    HA   LYS  20           HA       LYS  20 -14.250   6.247  14.318
  155    HB2  LYS  20           HB2      LYS  20 -16.518   5.979  15.218
  156    HB3  LYS  20           HB1      LYS  20 -16.724   4.500  14.312
  157    HG2  LYS  20           HG2      LYS  20 -16.389   3.792  16.519
  158    HG3  LYS  20           HG1      LYS  20 -14.831   3.548  15.746
  159    HD2  LYS  20           HD2      LYS  20 -15.512   5.972  17.429
  160    HD3  LYS  20           HD1      LYS  20 -14.777   4.520  18.080
  161    HE2  LYS  20           HE2      LYS  20 -12.837   4.865  16.574
  162    HE3  LYS  20           HE1      LYS  20 -13.591   6.346  15.986
  163    HZ1  LYS  20           HZ1      LYS  20 -11.995   6.866  17.629
  164    HZ2  LYS  20           HZ2      LYS  20 -12.714   5.832  18.745
  165    HZ3  LYS  20           HZ3      LYS  20 -13.538   7.218  18.214
  166    H    THR  21           HN       THR  21 -15.421   4.323  11.769
  167    HA   THR  21           HA       THR  21 -13.735   2.059  12.253
  168    HB   THR  21           HB       THR  21 -15.586   2.839  10.004
  169    HG1  THR  21           HG1      THR  21 -15.809   1.396  12.392
  170   HG21  THR  21          HG21      THR  21 -15.467   0.438   9.353
  171   HG22  THR  21          HG22      THR  21 -14.146   0.212  10.512
  172   HG23  THR  21          HG23      THR  21 -13.956   1.302   9.128
  173    H    GLN  22           HN       GLN  22 -11.644   2.750  12.122
  174    HA   GLN  22           HA       GLN  22 -10.684   3.476   9.463
  175    HB2  GLN  22           HB2      GLN  22 -10.863   5.569  10.740
  176    HB3  GLN  22           HB1      GLN  22  -9.886   4.875  12.020
  177    HG2  GLN  22           HG2      GLN  22  -7.961   4.853  10.668
  178    HG3  GLN  22           HG1      GLN  22  -8.832   5.251   9.203
  179   HE21  GLN  22          HE21      GLN  22  -7.861   7.144   8.731
  180   HE22  GLN  22          HE22      GLN  22  -7.880   8.535   9.738
  181    H    LYS  23           HN       LYS  23  -8.982   2.250   8.866
  182    HA   LYS  23           HA       LYS  23  -7.531   0.900  11.030
  183    HB2  LYS  23           HB2      LYS  23  -7.935  -0.327   8.303
  184    HB3  LYS  23           HB1      LYS  23  -7.280  -1.079   9.733
  185    HG2  LYS  23           HG2      LYS  23  -9.312  -2.082   9.630
  186    HG3  LYS  23           HG1      LYS  23  -9.745  -0.682  10.615
  187    HD2  LYS  23           HD2      LYS  23 -10.629   0.469   8.739
  188    HD3  LYS  23           HD1      LYS  23  -9.969  -0.717   7.612
  189    HE2  LYS  23           HE2      LYS  23 -11.418  -2.424   8.649
  190    HE3  LYS  23           HE1      LYS  23 -12.161  -1.153   9.626
  191    HZ1  LYS  23           HZ1      LYS  23 -12.915  -0.082   7.580
  192    HZ2  LYS  23           HZ2      LYS  23 -13.458  -1.674   7.629
  193    HZ3  LYS  23           HZ3      LYS  23 -12.147  -1.264   6.661
  194    H    ILE  24           HN       ILE  24  -5.385   1.209  10.916
  195    HA   ILE  24           HA       ILE  24  -4.259   2.045   8.359
  196    HB   ILE  24           HB       ILE  24  -3.015   2.125  11.135
  197   HG12  ILE  24          HG12      ILE  24  -4.017   4.482   9.538
  198   HG13  ILE  24          HG11      ILE  24  -5.019   3.664  10.736
  199   HG21  ILE  24          HG21      ILE  24  -1.298   3.519  10.050
  200   HG22  ILE  24          HG22      ILE  24  -2.160   3.377   8.512
  201   HG23  ILE  24          HG23      ILE  24  -1.430   1.955   9.230
  202   HD11  ILE  24          HD11      ILE  24  -3.974   5.653  11.651
  203   HD12  ILE  24          HD12      ILE  24  -2.374   4.988  11.268
  204   HD13  ILE  24          HD13      ILE  24  -3.425   4.172  12.439
  205    H    TYR  25           HN       TYR  25  -3.599   0.347   7.319
  206    HA   TYR  25           HA       TYR  25  -2.442  -1.856   8.814
  207    HB2  TYR  25           HB2      TYR  25  -3.553  -3.326   6.880
  208    HB3  TYR  25           HB1      TYR  25  -4.368  -2.984   8.389
  209    HD1  TYR  25           HD1      TYR  25  -4.085  -0.570   5.519
  210    HD2  TYR  25           HD2      TYR  25  -6.533  -3.306   7.649
  211    HE1  TYR  25           HE1      TYR  25  -6.056   0.187   4.234
  212    HE2  TYR  25           HE2      TYR  25  -8.486  -2.570   6.388
  213    HH   TYR  25           HH       TYR  25  -8.287  -0.812   3.564
  214    H    GLU  26           HN       GLU  26  -1.243  -3.414   7.359
  215    HA   GLU  26           HA       GLU  26   0.385  -1.715   5.613
  216    HB2  GLU  26           HB2      GLU  26   1.159  -4.170   7.167
  217    HB3  GLU  26           HB1      GLU  26   2.225  -3.265   6.103
  218    HG2  GLU  26           HG2      GLU  26   2.079  -1.316   7.550
  219    HG3  GLU  26           HG1      GLU  26   0.904  -2.149   8.567
  220    H    ALA  27           HN       ALA  27   0.996  -2.399   3.611
  221    HA   ALA  27           HA       ALA  27  -0.036  -4.929   2.630
  222    HB1  ALA  27           HB1      ALA  27  -1.256  -3.879   0.804
  223    HB2  ALA  27           HB2      ALA  27  -0.864  -2.284   1.449
  224    HB3  ALA  27           HB3      ALA  27  -1.903  -3.374   2.366
  225    H    SER  28           HN       SER  28   0.448  -4.941   0.134
  226    HA   SER  28           HA       SER  28   3.037  -3.670  -0.390
  227    HB2  SER  28           HB2      SER  28   2.191  -6.411  -1.309
  228    HB3  SER  28           HB1      SER  28   3.803  -5.676  -1.368
  229    HG   SER  28           HG       SER  28   3.093  -5.560   1.111
  230    H    ILE  29           HN       ILE  29   3.180  -2.758  -2.386
  231    HA   ILE  29           HA       ILE  29   0.783  -2.293  -3.841
  232    HB   ILE  29           HB       ILE  29   3.616  -1.734  -4.765
  233   HG12  ILE  29          HG12      ILE  29   3.314  -0.696  -2.581
  234   HG13  ILE  29          HG11      ILE  29   3.314   0.543  -3.827
  235   HG21  ILE  29          HG21      ILE  29   2.562   0.049  -6.108
  236   HG22  ILE  29          HG22      ILE  29   0.981  -0.479  -5.539
  237   HG23  ILE  29          HG23      ILE  29   1.958  -1.554  -6.534
  238   HD11  ILE  29          HD11      ILE  29   1.636   1.045  -2.199
  239   HD12  ILE  29          HD12      ILE  29   0.938  -0.561  -2.347
  240   HD13  ILE  29          HD13      ILE  29   0.827   0.578  -3.699
  241    H    LYS  30           HN       LYS  30  -0.041  -3.374  -5.491
  242    HA   LYS  30           HA       LYS  30   1.515  -5.595  -6.598
  243    HB2  LYS  30           HB2      LYS  30  -0.928  -5.741  -5.546
  244    HB3  LYS  30           HB1      LYS  30  -1.418  -5.175  -7.129
  245    HG2  LYS  30           HG2      LYS  30   0.222  -7.665  -6.645
  246    HG3  LYS  30           HG1      LYS  30  -1.524  -7.654  -6.820
  247    HD2  LYS  30           HD2      LYS  30   0.376  -6.637  -8.930
  248    HD3  LYS  30           HD1      LYS  30  -0.206  -8.299  -8.881
  249    HE2  LYS  30           HE2      LYS  30  -2.505  -7.503  -9.078
  250    HE3  LYS  30           HE1      LYS  30  -1.931  -5.837  -9.088
  251    HZ1  LYS  30           HZ1      LYS  30  -1.212  -7.861 -11.137
  252    HZ2  LYS  30           HZ2      LYS  30  -0.804  -6.225 -11.141
  253    HZ3  LYS  30           HZ3      LYS  30  -2.405  -6.688 -11.324
  254    H    SER  31           HN       SER  31  -0.542  -2.810  -7.545
  255    HA   SER  31           HA       SER  31   1.077  -2.358  -9.880
  256    HB2  SER  31           HB2      SER  31  -1.871  -3.021 -10.182
  257    HB3  SER  31           HB1      SER  31  -0.801  -2.456 -11.473
  258    HG   SER  31           HG       SER  31   0.443  -4.439 -10.463
  259    H    THR  32           HN       THR  32   0.259  -0.312 -11.033
  260    HA   THR  32           HA       THR  32  -1.401   1.371  -9.312
  261    HB   THR  32           HB       THR  32   1.026   2.523 -10.627
  262    HG1  THR  32           HG1      THR  32   0.885   0.831  -8.423
  263   HG21  THR  32          HG21      THR  32   0.800   4.127  -8.832
  264   HG22  THR  32          HG22      THR  32  -0.549   3.195  -8.178
  265   HG23  THR  32          HG23      THR  32  -0.688   3.956  -9.761
  266    H    GLU  33           HN       GLU  33  -2.492   2.985 -10.513
  267    HA   GLU  33           HA       GLU  33  -1.902   3.408 -13.282
  268    HB2  GLU  33           HB2      GLU  33  -4.096   2.898 -14.048
  269    HB3  GLU  33           HB1      GLU  33  -3.270   1.475 -13.345
  270    HG2  GLU  33           HG2      GLU  33  -4.604   1.722 -11.327
  271    HG3  GLU  33           HG1      GLU  33  -5.461   3.082 -12.055
  272    H    ILE  34           HN       ILE  34  -3.326   5.174 -14.123
  273    HA   ILE  34           HA       ILE  34  -4.007   6.918 -11.876
  274    HB   ILE  34           HB       ILE  34  -3.004   7.727 -14.612
  275   HG12  ILE  34          HG12      ILE  34  -1.099   8.796 -13.337
  276   HG13  ILE  34          HG11      ILE  34  -1.711   8.017 -11.891
  277   HG21  ILE  34          HG21      ILE  34  -4.641   9.332 -13.874
  278   HG22  ILE  34          HG22      ILE  34  -3.041  10.060 -13.774
  279   HG23  ILE  34          HG23      ILE  34  -3.842   9.480 -12.311
  280   HD11  ILE  34          HD11      ILE  34  -1.338   5.857 -12.936
  281   HD12  ILE  34          HD12      ILE  34   0.151   6.782 -12.730
  282   HD13  ILE  34          HD13      ILE  34  -0.601   6.646 -14.335
  283    H    ASP  35           HN       ASP  35  -6.032   7.545 -11.771
  284    HA   ASP  35           HA       ASP  35  -7.652   7.428 -14.203
  285    HB2  ASP  35           HB2      ASP  35  -8.156   5.398 -12.843
  286    HB3  ASP  35           HB1      ASP  35  -8.629   6.440 -11.511
  287    H    ASP  36           HN       ASP  36  -8.047   9.370 -14.611
  288    HA   ASP  36           HA       ASP  36  -8.788  11.444 -14.579
  289    HB2  ASP  36           HB2      ASP  36 -10.912  10.343 -13.882
  290    HB3  ASP  36           HB1      ASP  36 -10.486  10.650 -12.203
  291    H    GLY  37           HN       GLY  37  -6.550  11.739 -13.949
  292    HA2  GLY  37           HA2      GLY  37  -5.206  13.442 -13.148
  293    HA3  GLY  37           HA1      GLY  37  -6.513  13.938 -12.096
  294    H    GLU  38           HN       GLU  38  -6.580  11.107 -10.944
  295    HA   GLU  38           HA       GLU  38  -4.241  11.479  -9.231
  296    HB2  GLU  38           HB2      GLU  38  -5.681  10.447  -7.414
  297    HB3  GLU  38           HB1      GLU  38  -6.082  12.083  -7.929
  298    HG2  GLU  38           HG2      GLU  38  -7.927  11.262  -9.237
  299    HG3  GLU  38           HG1      GLU  38  -7.489   9.601  -8.853
  300    H    VAL  39           HN       VAL  39  -3.270   9.706  -8.330
  301    HA   VAL  39           HA       VAL  39  -3.380   7.439 -10.144
  302    HB   VAL  39           HB       VAL  39  -1.256   8.630 -10.052
  303   HG11  VAL  39          HG11      VAL  39  -1.227   8.014  -7.133
  304   HG12  VAL  39          HG12      VAL  39  -1.294   9.596  -7.909
  305   HG13  VAL  39          HG13      VAL  39   0.165   8.604  -8.049
  306   HG21  VAL  39          HG21      VAL  39  -1.210   6.227 -10.493
  307   HG22  VAL  39          HG22      VAL  39  -1.052   5.884  -8.786
  308   HG23  VAL  39          HG23      VAL  39   0.242   6.706  -9.637
  309    H    LEU  40           HN       LEU  40  -4.011   5.563  -9.533
  310    HA   LEU  40           HA       LEU  40  -4.662   5.098  -6.720
  311    HB2  LEU  40           HB2      LEU  40  -5.882   3.872  -9.186
  312    HB3  LEU  40           HB1      LEU  40  -6.380   3.594  -7.531
  313    HG   LEU  40           HG       LEU  40  -6.654   6.164  -9.082
  314   HD11  LEU  40          HD11      LEU  40  -8.221   4.461  -9.754
  315   HD12  LEU  40          HD12      LEU  40  -9.036   5.747  -8.860
  316   HD13  LEU  40          HD13      LEU  40  -8.697   4.206  -8.072
  317   HD21  LEU  40          HD21      LEU  40  -7.861   7.005  -7.119
  318   HD22  LEU  40          HD22      LEU  40  -6.175   6.642  -6.754
  319   HD23  LEU  40          HD23      LEU  40  -7.446   5.535  -6.232
  320    H    TYR  41           HN       TYR  41  -3.915   3.378  -5.819
  321    HA   TYR  41           HA       TYR  41  -2.090   1.635  -7.303
  322    HB2  TYR  41           HB2      TYR  41  -2.130   2.424  -4.378
  323    HB3  TYR  41           HB1      TYR  41  -1.037   1.241  -5.080
  324    HD1  TYR  41           HD2      TYR  41  -2.046   4.846  -5.443
  325    HD2  TYR  41           HD1      TYR  41   1.063   1.957  -5.788
  326    HE1  TYR  41           HE2      TYR  41  -0.497   6.592  -5.950
  327    HE2  TYR  41           HE1      TYR  41   2.655   3.771  -6.298
  328    HH   TYR  41           HH       TYR  41   2.558   6.106  -7.218
  329    H    LEU  42           HN       LEU  42  -2.284  -0.520  -6.981
  330    HA   LEU  42           HA       LEU  42  -4.634  -1.420  -5.484
  331    HB2  LEU  42           HB2      LEU  42  -4.709  -2.051  -7.840
  332    HB3  LEU  42           HB1      LEU  42  -3.094  -2.725  -7.737
  333    HG   LEU  42           HG       LEU  42  -3.911  -4.482  -6.240
  334   HD11  LEU  42          HD11      LEU  42  -6.314  -4.784  -5.881
  335   HD12  LEU  42          HD12      LEU  42  -6.622  -3.236  -6.663
  336   HD13  LEU  42          HD13      LEU  42  -5.727  -3.296  -5.149
  337   HD21  LEU  42          HD21      LEU  42  -5.512  -4.221  -8.783
  338   HD22  LEU  42          HD22      LEU  42  -5.249  -5.713  -7.881
  339   HD23  LEU  42          HD23      LEU  42  -3.886  -4.890  -8.636
  340    H    VAL  43           HN       VAL  43  -4.162  -2.369  -3.635
  341    HA   VAL  43           HA       VAL  43  -1.403  -3.301  -3.279
  342    HB   VAL  43           HB       VAL  43  -1.402  -2.462  -1.029
  343   HG11  VAL  43          HG11      VAL  43  -2.615  -0.339  -2.742
  344   HG12  VAL  43          HG12      VAL  43  -0.938  -0.849  -2.762
  345   HG13  VAL  43          HG13      VAL  43  -1.612  -0.104  -1.307
  346   HG21  VAL  43          HG21      VAL  43  -4.307  -1.687  -1.419
  347   HG22  VAL  43          HG22      VAL  43  -3.334  -1.350   0.014
  348   HG23  VAL  43          HG23      VAL  43  -3.731  -3.014  -0.412
  349    H    HIS  44           HN       HIS  44  -1.120  -5.091  -2.013
  350    HA   HIS  44           HA       HIS  44  -3.521  -6.592  -1.288
  351    HB2  HIS  44           HB2      HIS  44  -2.508  -8.705  -1.987
  352    HB3  HIS  44           HB1      HIS  44  -2.522  -7.610  -3.354
  353    HD1  HIS  44           HD1      HIS  44  -0.125  -6.610  -4.036
  354    HD2  HIS  44           HD2      HIS  44  -0.064  -9.700  -1.268
  355    HE1  HIS  44           HE1      HIS  44   2.233  -7.454  -4.022
  356    HE2  HIS  44           HE2      HIS  44   2.070  -9.562  -2.679
  357    H    TYR  45           HN       TYR  45  -3.330  -7.692   0.659
  358    HA   TYR  45           HA       TYR  45  -1.501  -6.220   2.254
  359    HB2  TYR  45           HB2      TYR  45  -3.939  -7.794   3.005
  360    HB3  TYR  45           HB1      TYR  45  -2.875  -7.057   4.213
  361    HD1  TYR  45           HD1      TYR  45  -4.957  -6.260   1.226
  362    HD2  TYR  45           HD2      TYR  45  -2.988  -4.760   4.672
  363    HE1  TYR  45           HE1      TYR  45  -5.948  -4.050   0.815
  364    HE2  TYR  45           HE2      TYR  45  -3.981  -2.557   4.278
  365    HH   TYR  45           HH       TYR  45  -6.492  -1.892   2.106
  366    H    TYR  46           HN       TYR  46   0.233  -6.682   3.026
  367    HA   TYR  46           HA       TYR  46   2.068  -7.603   3.733
  368    HB2  TYR  46           HB2      TYR  46   0.175  -9.671   4.735
  369    HB3  TYR  46           HB1      TYR  46   1.913  -9.899   4.922
  370    HD1  TYR  46           HD1      TYR  46   3.221  -8.010   6.024
  371    HD2  TYR  46           HD2      TYR  46  -1.002  -8.380   6.299
  372    HE1  TYR  46           HE1      TYR  46   3.260  -6.609   8.007
  373    HE2  TYR  46           HE2      TYR  46  -0.999  -6.965   8.303
  374    HH   TYR  46           HH       TYR  46   1.712  -5.141   9.319
  375    H    GLY  47           HN       GLY  47   0.357 -10.027   1.894
  376    HA2  GLY  47           HA2      GLY  47   1.694 -10.518  -0.222
  377    HA3  GLY  47           HA1      GLY  47   3.001 -10.887   0.901
  378    H    TRP  48           HN       TRP  48   1.261 -12.038   2.859
  379    HA   TRP  48           HA       TRP  48   1.167 -14.716   1.991
  380    HB2  TRP  48           HB2      TRP  48   1.356 -14.024   4.378
  381    HB3  TRP  48           HB1      TRP  48  -0.301 -13.437   4.324
  382    HD1  TRP  48           HD1      TRP  48  -2.128 -15.148   4.990
  383    HE1  TRP  48           HE1      TRP  48  -2.168 -17.688   5.460
  384    HE3  TRP  48           HE3      TRP  48   2.618 -16.334   3.489
  385    HZ2  TRP  48           HZ2      TRP  48  -0.431 -19.889   5.210
  386    HZ3  TRP  48           HZ3      TRP  48   3.343 -18.681   3.632
  387    HH2  TRP  48           HH2      TRP  48   1.851 -20.416   4.471
  388    H    ASN  49           HN       ASN  49  -1.374 -12.285   2.458
  389    HA   ASN  49           HA       ASN  49  -3.123 -13.954   0.833
  390    HB2  ASN  49           HB2      ASN  49  -4.097 -13.475   3.031
  391    HB3  ASN  49           HB1      ASN  49  -3.868 -11.749   2.772
  392   HD21  ASN  49          HD21      ASN  49  -6.128 -11.535   3.142
  393   HD22  ASN  49          HD22      ASN  49  -7.269 -11.883   1.884
  394    H    VAL  50           HN       VAL  50  -2.783 -13.446  -1.127
  395    HA   VAL  50           HA       VAL  50  -2.201 -10.734  -1.947
  396    HB   VAL  50           HB       VAL  50  -2.378 -13.256  -3.626
  397   HG11  VAL  50          HG11      VAL  50  -1.018 -12.038  -5.264
  398   HG12  VAL  50          HG12      VAL  50  -1.097 -10.598  -4.251
  399   HG13  VAL  50          HG13      VAL  50  -2.568 -11.248  -4.977
  400   HG21  VAL  50          HG21      VAL  50   0.032 -11.970  -2.357
  401   HG22  VAL  50          HG22      VAL  50   0.085 -13.302  -3.508
  402   HG23  VAL  50          HG23      VAL  50  -0.673 -13.528  -1.932
  403    H    ARG  51           HN       ARG  51  -4.860 -12.883  -1.705
  404    HA   ARG  51           HA       ARG  51  -6.308 -11.714  -3.876
  405    HB2  ARG  51           HB2      ARG  51  -6.589 -14.122  -3.130
  406    HB3  ARG  51           HB1      ARG  51  -7.460 -13.501  -1.730
  407    HG2  ARG  51           HG2      ARG  51  -9.101 -12.461  -3.197
  408    HG3  ARG  51           HG1      ARG  51  -8.221 -13.043  -4.599
  409    HD2  ARG  51           HD2      ARG  51  -8.632 -15.342  -3.886
  410    HD3  ARG  51           HD1      ARG  51  -9.569 -14.744  -2.506
  411    HE   ARG  51           HE       ARG  51 -10.728 -13.533  -4.591
  412   HH11  ARG  51          HH11      ARG  51 -10.043 -16.937  -3.954
  413   HH12  ARG  51          HH12      ARG  51 -11.255 -17.513  -4.997
  414   HH21  ARG  51          HH21      ARG  51 -12.383 -14.291  -5.958
  415   HH22  ARG  51          HH22      ARG  51 -12.660 -15.961  -6.168
  416    H    TYR  52           HN       TYR  52  -5.684 -10.761  -0.723
  417    HA   TYR  52           HA       TYR  52  -8.133  -9.276  -0.369
  418    HB2  TYR  52           HB2      TYR  52  -6.371  -9.945   1.485
  419    HB3  TYR  52           HB1      TYR  52  -5.519  -8.506   0.938
  420    HD1  TYR  52           HD1      TYR  52  -7.333  -6.407   0.647
  421    HD2  TYR  52           HD2      TYR  52  -7.599  -9.627   3.401
  422    HE1  TYR  52           HE1      TYR  52  -8.727  -5.019   2.115
  423    HE2  TYR  52           HE2      TYR  52  -9.003  -8.253   4.875
  424    HH   TYR  52           HH       TYR  52 -10.331  -5.267   3.853
  425    H    ASP  53           HN       ASP  53  -8.557  -7.946  -1.854
  426    HA   ASP  53           HA       ASP  53  -6.453  -6.511  -3.333
  427    HB2  ASP  53           HB2      ASP  53  -7.755  -8.249  -4.502
  428    HB3  ASP  53           HB1      ASP  53  -9.229  -7.385  -4.110
  429    H    GLU  54           HN       GLU  54  -6.430  -4.349  -2.826
  430    HA   GLU  54           HA       GLU  54  -8.958  -2.961  -2.788
  431    HB2  GLU  54           HB2      GLU  54  -8.613  -3.579  -0.397
  432    HB3  GLU  54           HB1      GLU  54  -7.043  -2.800  -0.437
  433    HG2  GLU  54           HG2      GLU  54  -8.003  -0.649  -0.604
  434    HG3  GLU  54           HG1      GLU  54  -9.600  -1.312  -0.941
  435    H    TRP  55           HN       TRP  55  -8.918  -0.891  -3.299
  436    HA   TRP  55           HA       TRP  55  -6.479  -0.023  -4.655
  437    HB2  TRP  55           HB2      TRP  55  -9.382   0.624  -5.124
  438    HB3  TRP  55           HB1      TRP  55  -8.055   1.410  -5.964
  439    HD1  TRP  55           HD1      TRP  55  -9.749  -2.023  -5.637
  440    HE1  TRP  55           HE1      TRP  55  -9.190  -3.377  -7.780
  441    HE3  TRP  55           HE3      TRP  55  -6.424   1.195  -7.757
  442    HZ2  TRP  55           HZ2      TRP  55  -7.520  -3.090 -10.047
  443    HZ3  TRP  55           HZ3      TRP  55  -5.373   0.596  -9.879
  444    HH2  TRP  55           HH2      TRP  55  -5.906  -1.495 -11.010
  445    H    VAL  56           HN       VAL  56  -5.456   1.612  -3.842
  446    HA   VAL  56           HA       VAL  56  -6.922   3.636  -2.363
  447    HB   VAL  56           HB       VAL  56  -5.024   3.788  -0.701
  448   HG11  VAL  56          HG11      VAL  56  -6.525   1.178  -0.772
  449   HG12  VAL  56          HG12      VAL  56  -7.133   2.715  -0.153
  450   HG13  VAL  56          HG13      VAL  56  -5.789   1.912   0.654
  451   HG21  VAL  56          HG21      VAL  56  -3.559   1.864  -0.421
  452   HG22  VAL  56          HG22      VAL  56  -3.354   2.569  -2.029
  453   HG23  VAL  56          HG23      VAL  56  -4.291   1.091  -1.828
  454    H    LYS  57           HN       LYS  57  -6.134   5.668  -2.532
  455    HA   LYS  57           HA       LYS  57  -4.476   6.203  -4.796
  456    HB2  LYS  57           HB2      LYS  57  -6.540   7.403  -4.408
  457    HB3  LYS  57           HB1      LYS  57  -5.987   7.906  -2.824
  458    HG2  LYS  57           HG2      LYS  57  -4.433   9.407  -3.746
  459    HG3  LYS  57           HG1      LYS  57  -4.622   8.718  -5.361
  460    HD2  LYS  57           HD2      LYS  57  -5.836  10.829  -5.190
  461    HD3  LYS  57           HD1      LYS  57  -6.904   9.436  -5.409
  462    HE2  LYS  57           HE2      LYS  57  -7.560   9.473  -3.115
  463    HE3  LYS  57           HE1      LYS  57  -6.367  10.719  -2.738
  464    HZ1  LYS  57           HZ1      LYS  57  -7.550  12.294  -3.978
  465    HZ2  LYS  57           HZ2      LYS  57  -8.742  11.524  -3.075
  466    HZ3  LYS  57           HZ3      LYS  57  -8.530  11.161  -4.712
  467    H    ALA  58           HN       ALA  58  -2.660   7.768  -4.639
  468    HA   ALA  58           HA       ALA  58  -0.602   6.966  -2.957
  469    HB1  ALA  58           HB1      ALA  58  -0.327   8.187  -5.079
  470    HB2  ALA  58           HB2      ALA  58   0.639   8.867  -3.775
  471    HB3  ALA  58           HB3      ALA  58  -0.856   9.662  -4.277
  472    H    ASP  59           HN       ASP  59  -2.961   9.427  -2.513
  473    HA   ASP  59           HA       ASP  59  -1.738  10.775  -0.279
  474    HB2  ASP  59           HB2      ASP  59  -4.610  10.849  -1.231
  475    HB3  ASP  59           HB1      ASP  59  -3.873  11.966  -0.096
  476    H    ARG  60           HN       ARG  60  -3.087   7.786  -0.487
  477    HA   ARG  60           HA       ARG  60  -4.435   7.885   2.139
  478    HB2  ARG  60           HB2      ARG  60  -5.599   7.212  -0.070
  479    HB3  ARG  60           HB1      ARG  60  -4.623   5.768   0.006
  480    HG2  ARG  60           HG2      ARG  60  -6.817   5.291   0.820
  481    HG3  ARG  60           HG1      ARG  60  -5.691   5.231   2.181
  482    HD2  ARG  60           HD2      ARG  60  -6.400   7.291   3.010
  483    HD3  ARG  60           HD1      ARG  60  -7.223   7.726   1.507
  484    HE   ARG  60           HE       ARG  60  -8.333   5.394   2.543
  485   HH11  ARG  60          HH11      ARG  60  -8.076   8.779   3.500
  486   HH12  ARG  60          HH12      ARG  60  -9.659   8.927   4.074
  487   HH21  ARG  60          HH21      ARG  60 -10.622   5.572   3.373
  488   HH22  ARG  60          HH22      ARG  60 -11.124   7.048   3.998
  489    H    ILE  61           HN       ILE  61  -1.500   7.237   0.835
  490    HA   ILE  61           HA       ILE  61  -1.103   4.703   2.249
  491    HB   ILE  61           HB       ILE  61   0.370   5.727  -0.206
  492   HG12  ILE  61          HG12      ILE  61  -1.714   3.553   0.063
  493   HG13  ILE  61          HG11      ILE  61  -1.925   5.105  -0.739
  494   HG21  ILE  61          HG21      ILE  61   1.783   4.294   1.180
  495   HG22  ILE  61          HG22      ILE  61   1.349   3.488  -0.331
  496   HG23  ILE  61          HG23      ILE  61   0.535   3.044   1.170
  497   HD11  ILE  61          HD11      ILE  61  -0.189   4.441  -2.373
  498   HD12  ILE  61          HD12      ILE  61  -1.598   3.384  -2.374
  499   HD13  ILE  61          HD13      ILE  61  -0.113   2.865  -1.574
  500    H    ILE  62           HN       ILE  62   0.832   4.400   3.329
  501    HA   ILE  62           HA       ILE  62   2.441   6.740   4.046
  502    HB   ILE  62           HB       ILE  62   2.103   4.045   5.398
  503   HG12  ILE  62          HG12      ILE  62   1.323   5.317   7.396
  504   HG13  ILE  62          HG11      ILE  62   1.260   6.782   6.410
  505   HG21  ILE  62          HG21      ILE  62   4.390   4.749   5.625
  506   HG22  ILE  62          HG22      ILE  62   3.584   4.848   7.191
  507   HG23  ILE  62          HG23      ILE  62   3.885   6.318   6.264
  508   HD11  ILE  62          HD11      ILE  62  -0.449   5.689   5.024
  509   HD12  ILE  62          HD12      ILE  62  -0.938   5.792   6.721
  510   HD13  ILE  62          HD13      ILE  62  -0.352   4.264   6.053
  511    H    TRP  63           HN       TRP  63   4.207   6.756   2.888
  512    HA   TRP  63           HA       TRP  63   5.092   4.348   1.581
  513    HB2  TRP  63           HB2      TRP  63   5.747   7.256   1.139
  514    HB3  TRP  63           HB1      TRP  63   6.532   5.935   0.274
  515    HD1  TRP  63           HD1      TRP  63   3.324   7.949   0.341
  516    HE1  TRP  63           HE1      TRP  63   1.801   7.152  -1.579
  517    HE3  TRP  63           HE3      TRP  63   5.954   3.827  -1.093
  518    HZ2  TRP  63           HZ2      TRP  63   1.747   5.035  -3.452
  519    HZ3  TRP  63           HZ3      TRP  63   5.109   2.460  -2.951
  520    HH2  TRP  63           HH2      TRP  63   3.061   3.037  -4.097
  521    HA   PRO  64           HA       PRO  64   8.674   4.104   4.288
  522    HB2  PRO  64           HB2      PRO  64   9.823   2.522   2.092
  523    HB3  PRO  64           HB1      PRO  64   9.519   2.041   3.767
  524    HG2  PRO  64           HG2      PRO  64   8.050   1.046   1.765
  525    HG3  PRO  64           HG1      PRO  64   7.343   1.440   3.349
  526    HD2  PRO  64           HD2      PRO  64   7.240   3.005   0.796
  527    HD3  PRO  64           HD1      PRO  64   5.961   2.654   1.988
  528    H    LEU  65           HN       LEU  65   9.952   5.688   4.368
  529    HA   LEU  65           HA       LEU  65  11.419   7.269   3.968
  530    HB2  LEU  65           HB2      LEU  65  12.606   5.535   2.546
  531    HB3  LEU  65           HB1      LEU  65  11.777   6.173   1.154
  532    HG   LEU  65           HG       LEU  65  14.161   6.893   1.335
  533   HD11  LEU  65          HD11      LEU  65  13.840   9.274   0.897
  534   HD12  LEU  65          HD12      LEU  65  12.190   9.154   1.515
  535   HD13  LEU  65          HD13      LEU  65  12.648   8.280   0.056
  536   HD21  LEU  65          HD21      LEU  65  14.304   7.013   3.755
  537   HD22  LEU  65          HD22      LEU  65  13.201   8.386   3.762
  538   HD23  LEU  65          HD23      LEU  65  14.797   8.542   3.021
  539    H    ASP  66           HN       ASP  66  10.088   8.819   4.273
  540    HA   ASP  66           HA       ASP  66   9.135  10.818   3.921
  541    HB2  ASP  66           HB2      ASP  66  10.796  10.984   1.959
  542    HB3  ASP  66           HB1      ASP  66   9.487  10.445   0.918
  543    H    LYS  67           HN       LYS  67   7.208  11.691   2.099
  544    HA   LYS  67           HA       LYS  67   5.193   9.556   2.146
  545    HB2  LYS  67           HB2      LYS  67   3.504  10.980   3.099
  546    HB3  LYS  67           HB1      LYS  67   4.885  10.930   4.171
  547    HG2  LYS  67           HG2      LYS  67   4.221  13.155   4.249
  548    HG3  LYS  67           HG1      LYS  67   5.529  13.168   3.058
  549    HD2  LYS  67           HD2      LYS  67   3.932  13.089   1.264
  550    HD3  LYS  67           HD1      LYS  67   2.600  12.979   2.402
  551    HE2  LYS  67           HE2      LYS  67   3.161  15.206   3.281
  552    HE3  LYS  67           HE1      LYS  67   4.482  15.328   2.118
  553    HZ1  LYS  67           HZ1      LYS  67   2.829  15.228   0.320
  554    HZ2  LYS  67           HZ2      LYS  67   2.510  16.501   1.363
  555    HZ3  LYS  67           HZ3      LYS  67   1.592  15.112   1.455
  556    H    GLY  68           HN       GLY  68   6.756  11.858   0.381
  557    HA2  GLY  68           HA2      GLY  68   5.959  11.534  -2.051
  558    HA3  GLY  68           HA1      GLY  68   4.476  12.248  -1.440
  559    H    LEU  69           HN       LEU  69   7.292  13.533   0.052
  560    HA   LEU  69           HA       LEU  69   6.994  16.044  -1.374
  561    HB2  LEU  69           HB2      LEU  69   8.823  15.188   0.875
  562    HB3  LEU  69           HB1      LEU  69   8.685  16.828   0.268
  563    HG   LEU  69           HG       LEU  69   6.527  15.275   1.699
  564   HD11  LEU  69          HD11      LEU  69   8.379  15.874   3.158
  565   HD12  LEU  69          HD12      LEU  69   6.952  16.841   3.533
  566   HD13  LEU  69          HD13      LEU  69   8.283  17.546   2.616
  567   HD21  LEU  69          HD21      LEU  69   5.362  17.428   1.781
  568   HD22  LEU  69          HD22      LEU  69   5.598  16.878   0.123
  569   HD23  LEU  69          HD23      LEU  69   6.628  18.147   0.792
  570    H    GLU  70           HN       GLU  70   8.809  13.226  -1.296
  571    HA   GLU  70           HA       GLU  70  11.258  13.822  -2.460
  572    HB2  GLU  70           HB2      GLU  70  10.422  11.619  -1.508
  573    HB3  GLU  70           HB1      GLU  70   9.472  11.413  -2.959
  574    HG2  GLU  70           HG2      GLU  70  12.483  11.569  -2.891
  575    HG3  GLU  70           HG1      GLU  70  11.565  10.074  -2.850
  576    H    HIS  71           HN       HIS  71  11.233  15.272  -4.086
  577    HA   HIS  71           HA       HIS  71   9.228  15.037  -6.121
  578    HB2  HIS  71           HB2      HIS  71   9.820  17.189  -6.940
  579    HB3  HIS  71           HB1      HIS  71   9.911  17.268  -5.203
  580    HD1  HIS  71           HD1      HIS  71  11.434  18.832  -7.716
  581    HD2  HIS  71           HD2      HIS  71  13.025  16.481  -4.706
  582    HE1  HIS  71           HE1      HIS  71  13.820  19.578  -7.481
  583    HE2  HIS  71           HE2      HIS  71  14.532  18.470  -5.364
  584    H    HIS  72           HN       HIS  72   9.496  14.572  -8.211
  585    HA   HIS  72           HA       HIS  72  11.526  12.613  -8.564
  586    HB2  HIS  72           HB2      HIS  72   9.194  13.329 -10.307
  587    HB3  HIS  72           HB1      HIS  72  10.335  12.034 -10.676
  588    HD1  HIS  72           HD1      HIS  72   7.430  12.838  -8.568
  589    HD2  HIS  72           HD2      HIS  72  10.367   9.917  -8.760
  590    HE1  HIS  72           HE1      HIS  72   6.670  11.012  -7.021
  591    HE2  HIS  72           HE2      HIS  72   8.725   9.559  -6.857
  592    H    HIS  73           HN       HIS  73  11.846  15.706  -9.055
  593    HA   HIS  73           HA       HIS  73  13.614  15.238 -11.287
  594    HB2  HIS  73           HB2      HIS  73  12.579  17.761 -10.086
  595    HB3  HIS  73           HB1      HIS  73  14.154  17.804 -10.874
  596    HD1  HIS  73           HD1      HIS  73  13.878  18.621 -13.171
  597    HD2  HIS  73           HD2      HIS  73  10.780  16.100 -12.081
  598    HE1  HIS  73           HE1      HIS  73  12.519  18.313 -15.233
  599    HE2  HIS  73           HE2      HIS  73  10.926  16.505 -14.624
  600    H    HIS  74           HN       HIS  74  13.979  14.082  -8.633
  601    HA   HIS  74           HA       HIS  74  16.515  15.080  -7.774
  602    HB2  HIS  74           HB2      HIS  74  15.055  12.480  -7.276
  603    HB3  HIS  74           HB1      HIS  74  16.765  12.599  -6.896
  604    HD1  HIS  74           HD1      HIS  74  13.591  12.916  -5.307
  605    HD2  HIS  74           HD2      HIS  74  17.189  14.997  -5.107
  606    HE1  HIS  74           HE1      HIS  74  13.558  14.104  -3.129
  607    HE2  HIS  74           HE2      HIS  74  15.916  14.909  -2.891
  608    H    HIS  75           HN       HIS  75  15.343  12.801 -10.110
  609    HA   HIS  75           HA       HIS  75  18.021  12.423 -11.124
  610    HB2  HIS  75           HB2      HIS  75  15.361  11.417 -12.175
  611    HB3  HIS  75           HB1      HIS  75  16.881  11.179 -13.021
  612    HD1  HIS  75           HD1      HIS  75  18.755   9.891 -11.384
  613    HD2  HIS  75           HD2      HIS  75  14.719   9.360 -10.571
  614    HE1  HIS  75           HE1      HIS  75  18.599   7.793 -10.022
  615    HE2  HIS  75           HE2      HIS  75  16.215   7.839  -9.209
  616    H    HIS  76           HN       HIS  76  18.332  14.574 -11.297
  617    HA   HIS  76           HA       HIS  76  16.916  15.954 -13.398
  618    HB2  HIS  76           HB2      HIS  76  18.357  17.948 -12.736
  619    HB3  HIS  76           HB1      HIS  76  17.213  17.394 -11.532
  620    HD1  HIS  76           HD1      HIS  76  20.937  17.556 -12.214
  621    HD2  HIS  76           HD2      HIS  76  18.327  16.535  -9.148
  622    HE1  HIS  76           HE1      HIS  76  22.343  17.366 -10.170
  623    HE2  HIS  76           HE2      HIS  76  20.787  16.310  -8.513
  Start of MODEL   14
    1    H1   GLU   1           HT1      GLU   1  10.472   1.284 -22.193
    2    H2   GLU   1           HT2      GLU   1  11.967   1.547 -22.871
    3    H3   GLU   1           HT3      GLU   1  11.232   2.772 -21.962
    4    HA   GLU   1           HA       GLU   1  12.997   1.724 -20.729
    5    HB2  GLU   1           HB2      GLU   1  11.001   2.559 -19.519
    6    HB3  GLU   1           HB1      GLU   1  10.237   0.989 -19.716
    7    HG2  GLU   1           HG2      GLU   1  11.151   1.284 -17.477
    8    HG3  GLU   1           HG1      GLU   1  11.946  -0.037 -18.330
    9    H    ASP   2           HN       ASP   2  14.081  -0.063 -20.151
   10    HA   ASP   2           HA       ASP   2  13.338  -2.524 -21.546
   11    HB2  ASP   2           HB2      ASP   2  15.839  -1.785 -20.015
   12    HB3  ASP   2           HB1      ASP   2  15.569  -3.369 -20.708
   13    H    MET   3           HN       MET   3  14.512  -1.691 -18.347
   14    HA   MET   3           HA       MET   3  12.840  -3.835 -17.247
   15    HB2  MET   3           HB2      MET   3  15.251  -4.233 -16.913
   16    HB3  MET   3           HB1      MET   3  15.412  -2.646 -16.172
   17    HG2  MET   3           HG2      MET   3  13.852  -3.387 -14.377
   18    HG3  MET   3           HG1      MET   3  13.862  -4.994 -15.088
   19    HE1  MET   3           HE1      MET   3  16.929  -5.286 -16.017
   20    HE2  MET   3           HE2      MET   3  16.025  -6.559 -15.195
   21    HE3  MET   3           HE3      MET   3  17.612  -6.079 -14.597
   22    H    GLU   4           HN       GLU   4  11.057  -2.844 -16.527
   23    HA   GLU   4           HA       GLU   4  11.151  -0.144 -15.564
   24    HB2  GLU   4           HB2      GLU   4   8.920  -2.179 -15.383
   25    HB3  GLU   4           HB1      GLU   4   8.776  -0.474 -15.005
   26    HG2  GLU   4           HG2      GLU   4   9.317   0.031 -17.376
   27    HG3  GLU   4           HG1      GLU   4   9.283  -1.703 -17.703
   28    HA   PRO   5           HA       PRO   5  12.186  -1.463 -11.376
   29    HB2  PRO   5           HB2      PRO   5  11.346   1.301 -10.698
   30    HB3  PRO   5           HB1      PRO   5  12.889   0.508 -10.379
   31    HG2  PRO   5           HG2      PRO   5  12.677   2.407 -12.243
   32    HG3  PRO   5           HG1      PRO   5  13.733   0.996 -12.465
   33    HD2  PRO   5           HD2      PRO   5  11.025   1.536 -13.630
   34    HD3  PRO   5           HD1      PRO   5  12.472   0.824 -14.384
   35    H    CYS   6           HN       CYS   6  10.502  -2.789 -10.977
   36    HA   CYS   6           HA       CYS   6   7.828  -1.882 -11.096
   37    HB2  CYS   6           HB2      CYS   6   8.890  -4.537 -10.162
   38    HB3  CYS   6           HB1      CYS   6   7.210  -4.136 -10.534
   39    HG   CYS   6           HG       CYS   6   9.533  -3.636 -12.949
   40    H    LEU   7           HN       LEU   7   6.689  -1.072  -9.666
   41    HA   LEU   7           HA       LEU   7   7.499  -0.763  -6.972
   42    HB2  LEU   7           HB2      LEU   7   5.052   0.169  -6.827
   43    HB3  LEU   7           HB1      LEU   7   6.316   1.071  -7.626
   44    HG   LEU   7           HG       LEU   7   5.463   0.317  -9.822
   45   HD11  LEU   7          HD11      LEU   7   4.461  -1.799  -9.246
   46   HD12  LEU   7          HD12      LEU   7   3.279  -0.760 -10.035
   47   HD13  LEU   7          HD13      LEU   7   3.226  -0.992  -8.284
   48   HD21  LEU   7          HD21      LEU   7   3.406   1.615  -8.059
   49   HD22  LEU   7          HD22      LEU   7   3.433   1.668  -9.822
   50   HD23  LEU   7          HD23      LEU   7   4.729   2.427  -8.899
   51    H    THR   8           HN       THR   8   5.819  -3.187  -8.658
   52    HA   THR   8           HA       THR   8   4.162  -4.228  -6.702
   53    HB   THR   8           HB       THR   8   5.756  -5.743  -8.763
   54    HG1  THR   8           HG1      THR   8   3.220  -4.782  -9.417
   55   HG21  THR   8          HG21      THR   8   2.977  -6.106  -7.641
   56   HG22  THR   8          HG22      THR   8   4.383  -7.090  -7.212
   57   HG23  THR   8          HG23      THR   8   3.726  -7.148  -8.853
   58    H    GLY   9           HN       GLY   9   4.818  -4.849  -4.754
   59    HA2  GLY   9           HA2      GLY   9   6.136  -6.575  -3.544
   60    HA3  GLY   9           HA1      GLY   9   7.524  -6.004  -4.468
   61    H    THR  10           HN       THR  10   6.581  -3.191  -4.183
   62    HA   THR  10           HA       THR  10   8.023  -2.492  -1.901
   63    HB   THR  10           HB       THR  10   5.978  -1.000  -3.481
   64    HG1  THR  10           HG1      THR  10   7.957  -0.091  -4.467
   65   HG21  THR  10          HG21      THR  10   7.079   1.073  -2.645
   66   HG22  THR  10          HG22      THR  10   8.048   0.079  -1.552
   67   HG23  THR  10          HG23      THR  10   6.287   0.140  -1.381
   68    H    LYS  11           HN       LYS  11   7.459  -2.486   0.052
   69    HA   LYS  11           HA       LYS  11   4.671  -2.955   0.729
   70    HB2  LYS  11           HB2      LYS  11   5.432  -3.795   2.993
   71    HB3  LYS  11           HB1      LYS  11   5.830  -4.816   1.640
   72    HG2  LYS  11           HG2      LYS  11   7.801  -2.903   2.894
   73    HG3  LYS  11           HG1      LYS  11   7.577  -4.544   3.486
   74    HD2  LYS  11           HD2      LYS  11   8.475  -3.781   0.678
   75    HD3  LYS  11           HD1      LYS  11   9.515  -4.335   1.977
   76    HE2  LYS  11           HE2      LYS  11   8.498  -6.487   1.981
   77    HE3  LYS  11           HE1      LYS  11   7.224  -5.957   0.889
   78    HZ1  LYS  11           HZ1      LYS  11   8.894  -7.229  -0.263
   79    HZ2  LYS  11           HZ2      LYS  11  10.109  -6.125   0.152
   80    HZ3  LYS  11           HZ3      LYS  11   8.830  -5.659  -0.839
   81    H    VAL  12           HN       VAL  12   3.528  -1.643   1.705
   82    HA   VAL  12           HA       VAL  12   4.734   0.766   2.837
   83    HB   VAL  12           HB       VAL  12   2.913   2.058   1.756
   84   HG11  VAL  12          HG11      VAL  12   3.859   2.063  -0.495
   85   HG12  VAL  12          HG12      VAL  12   4.630   0.513  -0.170
   86   HG13  VAL  12          HG13      VAL  12   5.136   1.951   0.721
   87   HG21  VAL  12          HG21      VAL  12   1.634   1.047  -0.082
   88   HG22  VAL  12          HG22      VAL  12   1.312   0.227   1.446
   89   HG23  VAL  12          HG23      VAL  12   2.382  -0.514   0.258
   90    H    LYS  13           HN       LYS  13   2.788   2.061   3.739
   91    HA   LYS  13           HA       LYS  13   1.166   0.323   5.464
   92    HB2  LYS  13           HB2      LYS  13   3.005   2.422   5.908
   93    HB3  LYS  13           HB1      LYS  13   1.404   3.081   6.176
   94    HG2  LYS  13           HG2      LYS  13   2.367   0.595   7.502
   95    HG3  LYS  13           HG1      LYS  13   2.626   2.218   8.189
   96    HD2  LYS  13           HD2      LYS  13   0.078   2.415   7.926
   97    HD3  LYS  13           HD1      LYS  13   0.112   0.653   7.776
   98    HE2  LYS  13           HE2      LYS  13   1.280   2.249  10.036
   99    HE3  LYS  13           HE1      LYS  13  -0.258   1.403  10.095
  100    HZ1  LYS  13           HZ1      LYS  13   0.835  -0.667   9.931
  101    HZ2  LYS  13           HZ2      LYS  13   1.631   0.200  11.131
  102    HZ3  LYS  13           HZ3      LYS  13   2.345  -0.003   9.624
  103    H    VAL  14           HN       VAL  14  -1.123   0.857   5.385
  104    HA   VAL  14           HA       VAL  14  -1.897   2.959   3.479
  105    HB   VAL  14           HB       VAL  14  -2.960   0.106   3.555
  106   HG11  VAL  14          HG11      VAL  14  -4.336   0.741   1.642
  107   HG12  VAL  14          HG12      VAL  14  -3.800   2.416   1.825
  108   HG13  VAL  14          HG13      VAL  14  -4.754   1.652   3.092
  109   HG21  VAL  14          HG21      VAL  14  -2.041  -0.109   1.317
  110   HG22  VAL  14          HG22      VAL  14  -0.772   0.331   2.456
  111   HG23  VAL  14          HG23      VAL  14  -1.444   1.549   1.374
  112    H    LYS  15           HN       LYS  15  -3.697   4.116   4.065
  113    HA   LYS  15           HA       LYS  15  -5.102   3.334   6.546
  114    HB2  LYS  15           HB2      LYS  15  -5.001   6.029   5.167
  115    HB3  LYS  15           HB1      LYS  15  -5.772   5.679   6.707
  116    HG2  LYS  15           HG2      LYS  15  -3.574   5.169   7.664
  117    HG3  LYS  15           HG1      LYS  15  -2.855   5.566   6.094
  118    HD2  LYS  15           HD2      LYS  15  -3.689   7.848   6.270
  119    HD3  LYS  15           HD1      LYS  15  -4.466   7.462   7.805
  120    HE2  LYS  15           HE2      LYS  15  -2.214   6.915   8.737
  121    HE3  LYS  15           HE1      LYS  15  -1.507   7.450   7.217
  122    HZ1  LYS  15           HZ1      LYS  15  -3.062   9.135   9.087
  123    HZ2  LYS  15           HZ2      LYS  15  -2.410   9.660   7.625
  124    HZ3  LYS  15           HZ3      LYS  15  -1.395   9.162   8.869
  125    H    TYR  16           HN       TYR  16  -7.387   3.119   6.414
  126    HA   TYR  16           HA       TYR  16  -8.738   4.123   4.068
  127    HB2  TYR  16           HB2      TYR  16  -7.725   1.832   3.500
  128    HB3  TYR  16           HB1      TYR  16  -8.946   1.180   4.585
  129    HD1  TYR  16           HD2      TYR  16 -11.414   1.943   4.072
  130    HD2  TYR  16           HD1      TYR  16  -8.201   2.134   1.367
  131    HE1  TYR  16           HE2      TYR  16 -13.038   2.042   2.221
  132    HE2  TYR  16           HE1      TYR  16  -9.789   2.251  -0.541
  133    HH   TYR  16           HH       TYR  16 -12.087   1.629  -1.005
  134    H    GLY  17           HN       GLY  17 -10.433   5.080   5.040
  135    HA2  GLY  17           HA2      GLY  17 -12.479   3.457   5.964
  136    HA3  GLY  17           HA1      GLY  17 -11.733   4.210   7.352
  137    H    ARG  18           HN       ARG  18 -14.285   4.749   6.856
  138    HA   ARG  18           HA       ARG  18 -14.042   7.540   6.063
  139    HB2  ARG  18           HB2      ARG  18 -16.469   7.515   5.534
  140    HB3  ARG  18           HB1      ARG  18 -15.596   6.372   4.538
  141    HG2  ARG  18           HG2      ARG  18 -16.405   4.516   5.927
  142    HG3  ARG  18           HG1      ARG  18 -17.226   5.656   6.980
  143    HD2  ARG  18           HD2      ARG  18 -18.793   4.664   5.437
  144    HD3  ARG  18           HD1      ARG  18 -18.609   6.380   5.093
  145    HE   ARG  18           HE       ARG  18 -17.035   4.448   3.581
  146   HH11  ARG  18          HH11      ARG  18 -19.656   6.830   3.642
  147   HH12  ARG  18          HH12      ARG  18 -19.786   6.895   1.941
  148   HH21  ARG  18          HH21      ARG  18 -17.221   4.594   1.280
  149   HH22  ARG  18          HH22      ARG  18 -18.364   5.632   0.570
  150    H    GLY  19           HN       GLY  19 -13.688   8.549   7.895
  151    HA2  GLY  19           HA2      GLY  19 -13.895   9.278  10.044
  152    HA3  GLY  19           HA1      GLY  19 -15.571   8.768   9.934
  153    H    LYS  20           HN       LYS  20 -16.164   6.814  10.741
  154    HA   LYS  20           HA       LYS  20 -14.617   5.903  12.946
  155    HB2  LYS  20           HB2      LYS  20 -17.046   6.205  13.099
  156    HB3  LYS  20           HB1      LYS  20 -17.284   4.926  11.921
  157    HG2  LYS  20           HG2      LYS  20 -17.687   4.161  14.217
  158    HG3  LYS  20           HG1      LYS  20 -16.338   3.302  13.461
  159    HD2  LYS  20           HD2      LYS  20 -14.750   4.714  14.633
  160    HD3  LYS  20           HD1      LYS  20 -16.068   5.652  15.338
  161    HE2  LYS  20           HE2      LYS  20 -16.824   3.686  16.542
  162    HE3  LYS  20           HE1      LYS  20 -15.571   2.718  15.772
  163    HZ1  LYS  20           HZ1      LYS  20 -15.031   3.487  18.064
  164    HZ2  LYS  20           HZ2      LYS  20 -14.929   5.084  17.445
  165    HZ3  LYS  20           HZ3      LYS  20 -13.897   3.888  16.896
  166    H    THR  21           HN       THR  21 -15.272   4.584   9.703
  167    HA   THR  21           HA       THR  21 -14.369   1.939  10.461
  168    HB   THR  21           HB       THR  21 -14.616   1.505   7.974
  169    HG1  THR  21           HG1      THR  21 -15.464   3.059   6.741
  170   HG21  THR  21          HG21      THR  21 -17.056   1.583   8.020
  171   HG22  THR  21          HG22      THR  21 -16.995   2.689   9.386
  172   HG23  THR  21          HG23      THR  21 -16.429   1.022   9.576
  173    H    GLN  22           HN       GLN  22 -12.546   4.144  10.738
  174    HA   GLN  22           HA       GLN  22 -10.509   4.037   8.682
  175    HB2  GLN  22           HB2      GLN  22 -11.127   6.047  10.075
  176    HB3  GLN  22           HB1      GLN  22 -10.417   5.220  11.445
  177    HG2  GLN  22           HG2      GLN  22  -8.855   6.804  10.575
  178    HG3  GLN  22           HG1      GLN  22  -8.256   5.176  10.248
  179   HE21  GLN  22          HE21      GLN  22  -6.950   6.014   8.620
  180   HE22  GLN  22          HE22      GLN  22  -7.581   6.543   7.097
  181    H    LYS  23           HN       LYS  23  -9.379   2.251   8.515
  182    HA   LYS  23           HA       LYS  23  -8.003   1.416  10.931
  183    HB2  LYS  23           HB2      LYS  23  -7.950  -0.965  10.196
  184    HB3  LYS  23           HB1      LYS  23  -9.603  -0.425  10.417
  185    HG2  LYS  23           HG2      LYS  23  -8.297  -0.525   7.744
  186    HG3  LYS  23           HG1      LYS  23  -9.111  -1.914   8.467
  187    HD2  LYS  23           HD2      LYS  23 -11.146  -0.596   8.666
  188    HD3  LYS  23           HD1      LYS  23 -10.334   0.780   7.924
  189    HE2  LYS  23           HE2      LYS  23  -9.916  -0.602   5.940
  190    HE3  LYS  23           HE1      LYS  23 -10.841  -1.895   6.716
  191    HZ1  LYS  23           HZ1      LYS  23 -12.785  -0.539   6.703
  192    HZ2  LYS  23           HZ2      LYS  23 -12.176  -0.525   5.119
  193    HZ3  LYS  23           HZ3      LYS  23 -11.927   0.794   6.152
  194    H    ILE  24           HN       ILE  24  -5.870   0.769  10.618
  195    HA   ILE  24           HA       ILE  24  -4.816   1.727   8.073
  196    HB   ILE  24           HB       ILE  24  -3.410   1.986  10.771
  197   HG12  ILE  24          HG12      ILE  24  -3.738   4.531  10.359
  198   HG13  ILE  24          HG11      ILE  24  -4.997   4.064   9.232
  199   HG21  ILE  24          HG21      ILE  24  -1.852   3.433   9.564
  200   HG22  ILE  24          HG22      ILE  24  -2.758   3.153   8.075
  201   HG23  ILE  24          HG23      ILE  24  -1.928   1.818   8.864
  202   HD11  ILE  24          HD11      ILE  24  -5.945   4.696  11.382
  203   HD12  ILE  24          HD12      ILE  24  -4.955   3.488  12.199
  204   HD13  ILE  24          HD13      ILE  24  -6.217   2.980  11.080
  205    H    TYR  25           HN       TYR  25  -3.880   0.167   7.013
  206    HA   TYR  25           HA       TYR  25  -2.773  -2.087   8.487
  207    HB2  TYR  25           HB2      TYR  25  -3.520  -3.382   6.224
  208    HB3  TYR  25           HB1      TYR  25  -4.433  -3.367   7.713
  209    HD1  TYR  25           HD2      TYR  25  -4.276  -0.719   4.986
  210    HD2  TYR  25           HD1      TYR  25  -6.585  -3.637   7.065
  211    HE1  TYR  25           HE2      TYR  25  -6.348  -0.005   3.748
  212    HE2  TYR  25           HE1      TYR  25  -8.585  -2.939   5.857
  213    HH   TYR  25           HH       TYR  25  -8.590  -1.090   3.113
  214    H    GLU  26           HN       GLU  26  -1.295  -3.481   7.133
  215    HA   GLU  26           HA       GLU  26   0.311  -1.648   5.527
  216    HB2  GLU  26           HB2      GLU  26   1.240  -4.179   6.894
  217    HB3  GLU  26           HB1      GLU  26   2.240  -2.964   6.105
  218    HG2  GLU  26           HG2      GLU  26   1.297  -1.322   7.795
  219    HG3  GLU  26           HG1      GLU  26   0.710  -2.732   8.662
  220    H    ALA  27           HN       ALA  27   1.065  -2.384   3.511
  221    HA   ALA  27           HA       ALA  27   0.146  -4.939   2.526
  222    HB1  ALA  27           HB1      ALA  27  -0.903  -2.347   1.391
  223    HB2  ALA  27           HB2      ALA  27  -1.845  -3.518   2.309
  224    HB3  ALA  27           HB3      ALA  27  -1.186  -3.958   0.731
  225    H    SER  28           HN       SER  28   0.758  -5.056   0.129
  226    HA   SER  28           HA       SER  28   3.057  -3.356  -0.366
  227    HB2  SER  28           HB2      SER  28   4.062  -5.324  -1.567
  228    HB3  SER  28           HB1      SER  28   3.900  -5.555   0.172
  229    HG   SER  28           HG       SER  28   2.280  -6.993  -0.151
  230    H    ILE  29           HN       ILE  29   3.352  -2.713  -2.499
  231    HA   ILE  29           HA       ILE  29   0.953  -2.208  -3.895
  232    HB   ILE  29           HB       ILE  29   3.726  -2.001  -5.080
  233   HG12  ILE  29          HG12      ILE  29   3.844  -0.878  -2.919
  234   HG13  ILE  29          HG11      ILE  29   3.834   0.316  -4.207
  235   HG21  ILE  29          HG21      ILE  29   1.918  -1.657  -6.637
  236   HG22  ILE  29          HG22      ILE  29   2.756  -0.127  -6.339
  237   HG23  ILE  29          HG23      ILE  29   1.200  -0.444  -5.577
  238   HD11  ILE  29          HD11      ILE  29   2.510   1.035  -2.356
  239   HD12  ILE  29          HD12      ILE  29   1.547  -0.442  -2.415
  240   HD13  ILE  29          HD13      ILE  29   1.443   0.734  -3.738
  241    H    LYS  30           HN       LYS  30  -0.017  -3.313  -5.451
  242    HA   LYS  30           HA       LYS  30   1.248  -5.741  -6.500
  243    HB2  LYS  30           HB2      LYS  30  -1.126  -5.595  -5.300
  244    HB3  LYS  30           HB1      LYS  30  -1.658  -4.991  -6.850
  245    HG2  LYS  30           HG2      LYS  30  -0.311  -7.671  -6.484
  246    HG3  LYS  30           HG1      LYS  30  -2.049  -7.447  -6.418
  247    HD2  LYS  30           HD2      LYS  30  -0.338  -6.739  -8.803
  248    HD3  LYS  30           HD1      LYS  30  -1.153  -8.286  -8.606
  249    HE2  LYS  30           HE2      LYS  30  -2.484  -5.576  -8.750
  250    HE3  LYS  30           HE1      LYS  30  -2.425  -6.765 -10.044
  251    HZ1  LYS  30           HZ1      LYS  30  -3.748  -8.289  -8.566
  252    HZ2  LYS  30           HZ2      LYS  30  -4.528  -6.900  -8.999
  253    HZ3  LYS  30           HZ3      LYS  30  -3.946  -7.024  -7.457
  254    H    SER  31           HN       SER  31  -0.558  -2.792  -7.395
  255    HA   SER  31           HA       SER  31   0.899  -2.425  -9.789
  256    HB2  SER  31           HB2      SER  31  -0.689  -4.236 -10.527
  257    HB3  SER  31           HB1      SER  31  -2.036  -3.195 -10.079
  258    HG   SER  31           HG       SER  31  -0.803  -3.282 -12.379
  259    H    THR  32           HN       THR  32  -0.601  -0.626 -11.093
  260    HA   THR  32           HA       THR  32  -1.957   1.139  -9.287
  261    HB   THR  32           HB       THR  32   0.343   1.961  -8.906
  262    HG1  THR  32           HG1      THR  32  -1.383   3.450  -9.152
  263   HG21  THR  32          HG21      THR  32   1.693   2.857 -10.718
  264   HG22  THR  32          HG22      THR  32   0.494   2.321 -11.891
  265   HG23  THR  32          HG23      THR  32   1.420   1.127 -10.970
  266    H    GLU  33           HN       GLU  33  -2.735   3.002 -10.476
  267    HA   GLU  33           HA       GLU  33  -2.897   3.021 -13.326
  268    HB2  GLU  33           HB2      GLU  33  -5.293   2.106 -11.774
  269    HB3  GLU  33           HB1      GLU  33  -5.471   3.049 -13.238
  270    HG2  GLU  33           HG2      GLU  33  -4.242   1.313 -14.468
  271    HG3  GLU  33           HG1      GLU  33  -4.180   0.346 -12.991
  272    H    ILE  34           HN       ILE  34  -4.341   4.725 -14.077
  273    HA   ILE  34           HA       ILE  34  -4.442   6.898 -12.145
  274    HB   ILE  34           HB       ILE  34  -4.380   6.895 -15.159
  275   HG12  ILE  34          HG12      ILE  34  -2.347   8.324 -14.957
  276   HG13  ILE  34          HG11      ILE  34  -2.432   8.154 -13.218
  277   HG21  ILE  34          HG21      ILE  34  -5.933   8.607 -14.488
  278   HG22  ILE  34          HG22      ILE  34  -4.462   9.375 -15.097
  279   HG23  ILE  34          HG23      ILE  34  -4.754   9.281 -13.361
  280   HD11  ILE  34          HD11      ILE  34  -1.916   5.945 -15.213
  281   HD12  ILE  34          HD12      ILE  34  -2.014   5.753 -13.465
  282   HD13  ILE  34          HD13      ILE  34  -0.713   6.718 -14.169
  283    H    ASP  35           HN       ASP  35  -6.339   7.244 -11.487
  284    HA   ASP  35           HA       ASP  35  -8.675   6.619 -13.144
  285    HB2  ASP  35           HB2      ASP  35  -8.431   4.758 -11.556
  286    HB3  ASP  35           HB1      ASP  35  -8.367   5.901 -10.223
  287    H    ASP  36           HN       ASP  36  -9.623   8.362 -13.497
  288    HA   ASP  36           HA       ASP  36 -10.714  10.298 -13.319
  289    HB2  ASP  36           HB2      ASP  36 -11.689   9.192 -11.233
  290    HB3  ASP  36           HB1      ASP  36 -10.487  10.076 -10.303
  291    H    GLY  37           HN       GLY  37  -7.798  10.038 -13.296
  292    HA2  GLY  37           HA2      GLY  37  -6.395  11.861 -13.913
  293    HA3  GLY  37           HA1      GLY  37  -7.277  12.876 -12.785
  294    H    GLU  38           HN       GLU  38  -6.953  10.451 -10.857
  295    HA   GLU  38           HA       GLU  38  -4.274  11.274 -10.051
  296    HB2  GLU  38           HB2      GLU  38  -4.996  10.655  -7.723
  297    HB3  GLU  38           HB1      GLU  38  -5.783  12.056  -8.417
  298    HG2  GLU  38           HG2      GLU  38  -7.700  10.452  -9.021
  299    HG3  GLU  38           HG1      GLU  38  -6.886   9.323  -7.927
  300    H    VAL  39           HN       VAL  39  -3.034   9.696  -8.816
  301    HA   VAL  39           HA       VAL  39  -3.216   7.150 -10.230
  302    HB   VAL  39           HB       VAL  39  -0.889   8.320  -8.686
  303   HG11  VAL  39          HG11      VAL  39  -0.826   5.842  -8.737
  304   HG12  VAL  39          HG12      VAL  39   0.444   6.503  -9.745
  305   HG13  VAL  39          HG13      VAL  39  -1.016   5.871 -10.475
  306   HG21  VAL  39          HG21      VAL  39  -1.308   8.067 -11.642
  307   HG22  VAL  39          HG22      VAL  39   0.138   8.719 -10.863
  308   HG23  VAL  39          HG23      VAL  39  -1.407   9.573 -10.734
  309    H    LEU  40           HN       LEU  40  -4.041   5.567  -9.203
  310    HA   LEU  40           HA       LEU  40  -3.720   5.478  -6.319
  311    HB2  LEU  40           HB2      LEU  40  -5.896   4.262  -7.980
  312    HB3  LEU  40           HB1      LEU  40  -5.607   3.843  -6.309
  313    HG   LEU  40           HG       LEU  40  -5.951   6.442  -5.953
  314   HD11  LEU  40          HD11      LEU  40  -6.055   7.073  -8.207
  315   HD12  LEU  40          HD12      LEU  40  -7.650   7.306  -7.449
  316   HD13  LEU  40          HD13      LEU  40  -7.348   5.912  -8.496
  317   HD21  LEU  40          HD21      LEU  40  -7.234   4.672  -4.967
  318   HD22  LEU  40          HD22      LEU  40  -8.152   4.466  -6.460
  319   HD23  LEU  40          HD23      LEU  40  -8.307   5.963  -5.525
  320    H    TYR  41           HN       TYR  41  -3.458   3.475  -5.456
  321    HA   TYR  41           HA       TYR  41  -1.955   1.755  -7.261
  322    HB2  TYR  41           HB2      TYR  41  -1.400   2.414  -4.364
  323    HB3  TYR  41           HB1      TYR  41  -0.511   1.233  -5.321
  324    HD1  TYR  41           HD1      TYR  41  -1.198   4.847  -4.881
  325    HD2  TYR  41           HD2      TYR  41   1.129   1.926  -6.920
  326    HE1  TYR  41           HE1      TYR  41   0.277   6.589  -5.654
  327    HE2  TYR  41           HE2      TYR  41   2.637   3.703  -7.718
  328    HH   TYR  41           HH       TYR  41   2.660   6.779  -6.435
  329    H    LEU  42           HN       LEU  42  -2.103  -0.364  -6.864
  330    HA   LEU  42           HA       LEU  42  -4.470  -1.178  -5.362
  331    HB2  LEU  42           HB2      LEU  42  -4.558  -1.630  -7.754
  332    HB3  LEU  42           HB1      LEU  42  -2.986  -2.391  -7.696
  333    HG   LEU  42           HG       LEU  42  -3.893  -4.279  -6.472
  334   HD11  LEU  42          HD11      LEU  42  -6.280  -4.449  -6.018
  335   HD12  LEU  42          HD12      LEU  42  -6.516  -2.797  -6.599
  336   HD13  LEU  42          HD13      LEU  42  -5.569  -3.095  -5.144
  337   HD21  LEU  42          HD21      LEU  42  -5.330  -5.167  -8.182
  338   HD22  LEU  42          HD22      LEU  42  -4.039  -4.217  -8.934
  339   HD23  LEU  42          HD23      LEU  42  -5.661  -3.548  -8.785
  340    H    VAL  43           HN       VAL  43  -3.960  -2.097  -3.549
  341    HA   VAL  43           HA       VAL  43  -1.238  -3.155  -3.247
  342    HB   VAL  43           HB       VAL  43  -1.255  -2.358  -0.935
  343   HG11  VAL  43          HG11      VAL  43  -1.132   0.030  -1.323
  344   HG12  VAL  43          HG12      VAL  43  -2.005  -0.165  -2.841
  345   HG13  VAL  43          HG13      VAL  43  -0.403  -0.873  -2.655
  346   HG21  VAL  43          HG21      VAL  43  -3.988  -1.230  -1.587
  347   HG22  VAL  43          HG22      VAL  43  -3.081  -0.855  -0.136
  348   HG23  VAL  43          HG23      VAL  43  -3.643  -2.505  -0.420
  349    H    HIS  44           HN       HIS  44  -0.979  -4.958  -2.096
  350    HA   HIS  44           HA       HIS  44  -3.414  -6.367  -1.310
  351    HB2  HIS  44           HB2      HIS  44  -2.370  -8.546  -1.913
  352    HB3  HIS  44           HB1      HIS  44  -2.522  -7.507  -3.310
  353    HD1  HIS  44           HD1      HIS  44  -0.253  -9.866  -1.944
  354    HD2  HIS  44           HD2      HIS  44   0.227  -6.145  -3.748
  355    HE1  HIS  44           HE1      HIS  44   2.060  -9.836  -2.810
  356    HE2  HIS  44           HE2      HIS  44   2.335  -7.635  -3.953
  357    H    TYR  45           HN       TYR  45  -3.503  -7.043   0.621
  358    HA   TYR  45           HA       TYR  45  -1.855  -5.776   2.473
  359    HB2  TYR  45           HB2      TYR  45  -3.920  -7.898   2.894
  360    HB3  TYR  45           HB1      TYR  45  -3.267  -6.838   4.156
  361    HD1  TYR  45           HD1      TYR  45  -3.473  -4.263   3.586
  362    HD2  TYR  45           HD2      TYR  45  -5.874  -7.317   1.871
  363    HE1  TYR  45           HE1      TYR  45  -5.172  -2.593   3.013
  364    HE2  TYR  45           HE2      TYR  45  -7.588  -5.653   1.290
  365    HH   TYR  45           HH       TYR  45  -7.060  -2.328   1.381
  366    H    TYR  46           HN       TYR  46  -0.426  -6.461   3.940
  367    HA   TYR  46           HA       TYR  46   1.097  -8.771   3.083
  368    HB2  TYR  46           HB2      TYR  46   2.074  -6.450   3.483
  369    HB3  TYR  46           HB1      TYR  46   1.795  -6.722   5.190
  370    HD1  TYR  46           HD1      TYR  46   3.786  -7.680   2.275
  371    HD2  TYR  46           HD2      TYR  46   3.229  -8.240   6.455
  372    HE1  TYR  46           HE1      TYR  46   5.999  -8.730   2.419
  373    HE2  TYR  46           HE2      TYR  46   5.442  -9.304   6.608
  374    HH   TYR  46           HH       TYR  46   7.078 -10.361   5.262
  375    H    GLY  47           HN       GLY  47   0.290 -10.599   3.925
  376    HA2  GLY  47           HA2      GLY  47   0.174 -12.197   5.621
  377    HA3  GLY  47           HA1      GLY  47   0.360 -10.915   6.810
  378    H    TRP  48           HN       TRP  48  -1.991 -10.625   4.324
  379    HA   TRP  48           HA       TRP  48  -4.138 -11.430   6.153
  380    HB2  TRP  48           HB2      TRP  48  -4.075  -8.831   4.592
  381    HB3  TRP  48           HB1      TRP  48  -5.464  -9.432   5.484
  382    HD1  TRP  48           HD1      TRP  48  -2.082  -7.762   5.970
  383    HE1  TRP  48           HE1      TRP  48  -1.890  -6.935   8.379
  384    HE3  TRP  48           HE3      TRP  48  -6.315  -9.884   7.876
  385    HZ2  TRP  48           HZ2      TRP  48  -3.343  -7.146  10.792
  386    HZ3  TRP  48           HZ3      TRP  48  -6.846  -9.510  10.251
  387    HH2  TRP  48           HH2      TRP  48  -5.393  -8.173  11.675
  388    H    ASN  49           HN       ASN  49  -6.275 -10.753   4.467
  389    HA   ASN  49           HA       ASN  49  -6.315 -12.976   2.763
  390    HB2  ASN  49           HB2      ASN  49  -8.366 -12.086   3.711
  391    HB3  ASN  49           HB1      ASN  49  -8.130 -10.560   2.874
  392   HD21  ASN  49          HD21      ASN  49  -8.927 -13.904   2.513
  393   HD22  ASN  49          HD22      ASN  49  -9.681 -13.813   0.984
  394    H    VAL  50           HN       VAL  50  -5.648 -13.283   0.789
  395    HA   VAL  50           HA       VAL  50  -4.305 -11.124  -0.592
  396    HB   VAL  50           HB       VAL  50  -4.464 -14.093  -1.191
  397   HG11  VAL  50          HG11      VAL  50  -2.602 -13.720  -2.759
  398   HG12  VAL  50          HG12      VAL  50  -2.769 -11.978  -2.512
  399   HG13  VAL  50          HG13      VAL  50  -4.076 -12.892  -3.261
  400   HG21  VAL  50          HG21      VAL  50  -2.132 -14.127  -0.417
  401   HG22  VAL  50          HG22      VAL  50  -3.245 -13.601   0.845
  402   HG23  VAL  50          HG23      VAL  50  -2.260 -12.417  -0.017
  403    H    ARG  51           HN       ARG  51  -7.161 -13.040  -0.859
  404    HA   ARG  51           HA       ARG  51  -7.872 -12.869  -3.514
  405    HB2  ARG  51           HB2      ARG  51  -9.172 -14.162  -1.964
  406    HB3  ARG  51           HB1      ARG  51  -9.640 -12.723  -1.079
  407    HG2  ARG  51           HG2      ARG  51 -10.832 -11.922  -3.130
  408    HG3  ARG  51           HG1      ARG  51 -10.486 -13.486  -3.869
  409    HD2  ARG  51           HD2      ARG  51 -11.769 -14.625  -2.189
  410    HD3  ARG  51           HD1      ARG  51 -11.971 -13.132  -1.273
  411    HE   ARG  51           HE       ARG  51 -12.986 -13.158  -3.984
  412   HH11  ARG  51          HH11      ARG  51 -13.743 -13.608  -0.554
  413   HH12  ARG  51          HH12      ARG  51 -15.397 -13.235  -0.714
  414   HH21  ARG  51          HH21      ARG  51 -15.294 -12.652  -4.204
  415   HH22  ARG  51          HH22      ARG  51 -16.301 -12.669  -2.836
  416    H    TYR  52           HN       TYR  52  -8.662 -10.522  -0.997
  417    HA   TYR  52           HA       TYR  52  -9.518  -8.745  -3.138
  418    HB2  TYR  52           HB2      TYR  52 -11.271  -9.225  -1.528
  419    HB3  TYR  52           HB1      TYR  52 -10.246  -8.674  -0.211
  420    HD1  TYR  52           HD2      TYR  52 -11.596  -7.397  -3.465
  421    HD2  TYR  52           HD1      TYR  52 -10.601  -6.529   0.577
  422    HE1  TYR  52           HE2      TYR  52 -12.486  -5.121  -3.738
  423    HE2  TYR  52           HE1      TYR  52 -11.487  -4.254   0.307
  424    HH   TYR  52           HH       TYR  52 -11.992  -2.675  -1.341
  425    H    ASP  53           HN       ASP  53  -7.802  -7.722  -3.789
  426    HA   ASP  53           HA       ASP  53  -6.305  -6.197  -1.849
  427    HB2  ASP  53           HB2      ASP  53  -4.677  -5.777  -3.766
  428    HB3  ASP  53           HB1      ASP  53  -4.795  -7.449  -3.266
  429    H    GLU  54           HN       GLU  54  -6.079  -3.901  -2.154
  430    HA   GLU  54           HA       GLU  54  -8.504  -2.826  -3.485
  431    HB2  GLU  54           HB2      GLU  54  -8.962  -3.281  -1.088
  432    HB3  GLU  54           HB1      GLU  54  -7.596  -2.281  -0.647
  433    HG2  GLU  54           HG2      GLU  54  -8.698  -0.314  -1.180
  434    HG3  GLU  54           HG1      GLU  54  -9.885  -1.141  -2.187
  435    H    TRP  55           HN       TRP  55  -8.602  -0.576  -3.793
  436    HA   TRP  55           HA       TRP  55  -6.028   0.422  -4.723
  437    HB2  TRP  55           HB2      TRP  55  -8.861   1.132  -5.457
  438    HB3  TRP  55           HB1      TRP  55  -7.440   1.949  -6.088
  439    HD1  TRP  55           HD1      TRP  55  -9.192  -1.478  -6.189
  440    HE1  TRP  55           HE1      TRP  55  -8.432  -2.676  -8.362
  441    HE3  TRP  55           HE3      TRP  55  -5.633   1.836  -7.727
  442    HZ2  TRP  55           HZ2      TRP  55  -6.536  -2.251 -10.424
  443    HZ3  TRP  55           HZ3      TRP  55  -4.377   1.367  -9.780
  444    HH2  TRP  55           HH2      TRP  55  -4.820  -0.632 -11.098
  445    H    VAL  56           HN       VAL  56  -5.110   2.049  -3.827
  446    HA   VAL  56           HA       VAL  56  -6.625   4.085  -2.388
  447    HB   VAL  56           HB       VAL  56  -4.829   4.073  -0.571
  448   HG11  VAL  56          HG11      VAL  56  -7.064   3.166  -0.159
  449   HG12  VAL  56          HG12      VAL  56  -5.837   2.235   0.702
  450   HG13  VAL  56          HG13      VAL  56  -6.549   1.595  -0.777
  451   HG21  VAL  56          HG21      VAL  56  -3.555   2.001  -0.238
  452   HG22  VAL  56          HG22      VAL  56  -3.167   2.747  -1.786
  453   HG23  VAL  56          HG23      VAL  56  -4.233   1.348  -1.730
  454    H    LYS  57           HN       LYS  57  -5.720   6.136  -2.580
  455    HA   LYS  57           HA       LYS  57  -3.803   6.482  -4.677
  456    HB2  LYS  57           HB2      LYS  57  -5.784   7.922  -4.354
  457    HB3  LYS  57           HB1      LYS  57  -5.132   8.433  -2.813
  458    HG2  LYS  57           HG2      LYS  57  -3.389   9.658  -3.850
  459    HG3  LYS  57           HG1      LYS  57  -3.726   8.910  -5.418
  460    HD2  LYS  57           HD2      LYS  57  -4.626  11.178  -5.337
  461    HD3  LYS  57           HD1      LYS  57  -5.880   9.938  -5.470
  462    HE2  LYS  57           HE2      LYS  57  -6.269  10.137  -3.029
  463    HE3  LYS  57           HE1      LYS  57  -5.120  11.474  -2.996
  464    HZ1  LYS  57           HZ1      LYS  57  -7.557  11.396  -4.669
  465    HZ2  LYS  57           HZ2      LYS  57  -6.540  12.723  -4.462
  466    HZ3  LYS  57           HZ3      LYS  57  -7.479  12.178  -3.175
  467    H    ALA  58           HN       ALA  58  -1.890   7.975  -4.377
  468    HA   ALA  58           HA       ALA  58  -0.033   6.881  -2.636
  469    HB1  ALA  58           HB1      ALA  58   0.524   8.163  -4.688
  470    HB2  ALA  58           HB2      ALA  58   1.474   8.627  -3.284
  471    HB3  ALA  58           HB3      ALA  58   0.143   9.648  -3.815
  472    H    ASP  59           HN       ASP  59  -2.125   9.602  -2.218
  473    HA   ASP  59           HA       ASP  59  -1.051  10.827   0.116
  474    HB2  ASP  59           HB2      ASP  59  -3.846  10.731  -1.000
  475    HB3  ASP  59           HB1      ASP  59  -3.408  11.688   0.402
  476    H    ARG  60           HN       ARG  60  -2.888   7.997  -0.373
  477    HA   ARG  60           HA       ARG  60  -4.084   7.938   2.293
  478    HB2  ARG  60           HB2      ARG  60  -5.248   7.535   0.072
  479    HB3  ARG  60           HB1      ARG  60  -4.340   6.046  -0.027
  480    HG2  ARG  60           HG2      ARG  60  -6.546   5.600   0.731
  481    HG3  ARG  60           HG1      ARG  60  -5.414   5.306   2.051
  482    HD2  ARG  60           HD2      ARG  60  -6.058   7.211   3.204
  483    HD3  ARG  60           HD1      ARG  60  -6.746   7.969   1.764
  484    HE   ARG  60           HE       ARG  60  -8.149   5.693   2.157
  485   HH11  ARG  60          HH11      ARG  60  -7.520   8.559   4.133
  486   HH12  ARG  60          HH12      ARG  60  -9.084   8.681   4.761
  487   HH21  ARG  60          HH21      ARG  60 -10.351   5.869   2.950
  488   HH22  ARG  60          HH22      ARG  60 -10.756   7.083   4.089
  489    H    ILE  61           HN       ILE  61  -1.303   7.047   0.769
  490    HA   ILE  61           HA       ILE  61  -0.911   4.569   2.265
  491    HB   ILE  61           HB       ILE  61   0.523   5.664  -0.180
  492   HG12  ILE  61          HG12      ILE  61  -1.440   3.380   0.073
  493   HG13  ILE  61          HG11      ILE  61  -1.739   4.928  -0.708
  494   HG21  ILE  61          HG21      ILE  61   1.619   3.500  -0.313
  495   HG22  ILE  61          HG22      ILE  61   0.815   3.001   1.171
  496   HG23  ILE  61          HG23      ILE  61   1.997   4.316   1.210
  497   HD11  ILE  61          HD11      ILE  61  -0.036   4.400  -2.384
  498   HD12  ILE  61          HD12      ILE  61  -1.309   3.180  -2.342
  499   HD13  ILE  61          HD13      ILE  61   0.250   2.852  -1.587
  500    H    ILE  62           HN       ILE  62   0.967   4.443   3.529
  501    HA   ILE  62           HA       ILE  62   2.475   6.938   3.851
  502    HB   ILE  62           HB       ILE  62   2.488   4.573   5.765
  503   HG12  ILE  62          HG12      ILE  62   1.351   6.304   7.359
  504   HG13  ILE  62          HG11      ILE  62   0.838   7.085   5.871
  505   HG21  ILE  62          HG21      ILE  62   4.512   5.828   5.821
  506   HG22  ILE  62          HG22      ILE  62   3.612   6.089   7.318
  507   HG23  ILE  62          HG23      ILE  62   3.622   7.330   6.066
  508   HD11  ILE  62          HD11      ILE  62   0.146   4.288   6.791
  509   HD12  ILE  62          HD12      ILE  62  -0.297   4.946   5.220
  510   HD13  ILE  62          HD13      ILE  62  -0.927   5.667   6.700
  511    H    TRP  63           HN       TRP  63   4.091   6.819   2.554
  512    HA   TRP  63           HA       TRP  63   5.259   4.316   1.822
  513    HB2  TRP  63           HB2      TRP  63   5.974   7.160   1.038
  514    HB3  TRP  63           HB1      TRP  63   6.703   5.716   0.343
  515    HD1  TRP  63           HD1      TRP  63   3.404   7.673   0.373
  516    HE1  TRP  63           HE1      TRP  63   1.957   6.907  -1.586
  517    HE3  TRP  63           HE3      TRP  63   6.302   3.800  -1.277
  518    HZ2  TRP  63           HZ2      TRP  63   2.035   4.901  -3.612
  519    HZ3  TRP  63           HZ3      TRP  63   5.545   2.510  -3.233
  520    HH2  TRP  63           HH2      TRP  63   3.466   3.034  -4.364
  521    HA   PRO  64           HA       PRO  64   8.289   4.331   5.077
  522    HB2  PRO  64           HB2      PRO  64   9.985   3.009   3.025
  523    HB3  PRO  64           HB1      PRO  64   9.594   2.477   4.666
  524    HG2  PRO  64           HG2      PRO  64   8.458   1.296   2.581
  525    HG3  PRO  64           HG1      PRO  64   7.511   1.652   4.039
  526    HD2  PRO  64           HD2      PRO  64   7.558   3.095   1.417
  527    HD3  PRO  64           HD1      PRO  64   6.192   2.713   2.492
  528    H    LEU  65           HN       LEU  65   9.368   5.974   5.613
  529    HA   LEU  65           HA       LEU  65  11.495   7.178   4.260
  530    HB2  LEU  65           HB2      LEU  65   9.410   7.825   2.845
  531    HB3  LEU  65           HB1      LEU  65   8.851   8.660   4.270
  532    HG   LEU  65           HG       LEU  65  11.468   9.430   2.997
  533   HD11  LEU  65          HD11      LEU  65   9.758   9.411   1.250
  534   HD12  LEU  65          HD12      LEU  65  10.212  11.064   1.674
  535   HD13  LEU  65          HD13      LEU  65   8.694  10.374   2.273
  536   HD21  LEU  65          HD21      LEU  65  10.919  11.590   3.981
  537   HD22  LEU  65          HD22      LEU  65  10.870  10.322   5.214
  538   HD23  LEU  65          HD23      LEU  65   9.369  10.949   4.538
  539    H    ASP  66           HN       ASP  66  12.321   8.737   5.667
  540    HA   ASP  66           HA       ASP  66  11.780   8.233   8.378
  541    HB2  ASP  66           HB2      ASP  66  13.956   8.958   7.414
  542    HB3  ASP  66           HB1      ASP  66  13.273  10.565   7.197
  543    H    LYS  67           HN       LYS  67   9.906   8.757   9.156
  544    HA   LYS  67           HA       LYS  67   8.543  11.134   8.232
  545    HB2  LYS  67           HB2      LYS  67   7.420   8.990   8.120
  546    HB3  LYS  67           HB1      LYS  67   7.582   8.808   9.856
  547    HG2  LYS  67           HG2      LYS  67   6.011  10.464  10.291
  548    HG3  LYS  67           HG1      LYS  67   6.111  11.110   8.657
  549    HD2  LYS  67           HD2      LYS  67   4.038   9.927   8.855
  550    HD3  LYS  67           HD1      LYS  67   5.142   9.029   7.818
  551    HE2  LYS  67           HE2      LYS  67   4.721   8.353  10.743
  552    HE3  LYS  67           HE1      LYS  67   3.739   7.652   9.468
  553    HZ1  LYS  67           HZ1      LYS  67   6.670   7.279   9.874
  554    HZ2  LYS  67           HZ2      LYS  67   5.854   6.737   8.512
  555    HZ3  LYS  67           HZ3      LYS  67   5.458   6.131  10.027
  556    H    GLY  68           HN       GLY  68   9.528  12.761   9.342
  557    HA2  GLY  68           HA2      GLY  68   9.422  12.677  12.293
  558    HA3  GLY  68           HA1      GLY  68  10.518  13.688  11.360
  559    H    LEU  69           HN       LEU  69   7.993  14.040   9.579
  560    HA   LEU  69           HA       LEU  69   6.379  15.435   9.166
  561    HB2  LEU  69           HB2      LEU  69   6.106  15.254  12.069
  562    HB3  LEU  69           HB1      LEU  69   5.044  16.365  11.197
  563    HG   LEU  69           HG       LEU  69   3.793  14.402  11.596
  564   HD11  LEU  69          HD11      LEU  69   3.521  15.186   9.340
  565   HD12  LEU  69          HD12      LEU  69   3.332  13.441   9.441
  566   HD13  LEU  69          HD13      LEU  69   4.820  14.121   8.791
  567   HD21  LEU  69          HD21      LEU  69   4.563  12.127  11.089
  568   HD22  LEU  69          HD22      LEU  69   5.585  12.923  12.289
  569   HD23  LEU  69          HD23      LEU  69   6.135  12.777  10.622
  570    H    GLU  70           HN       GLU  70   8.393  16.772  11.707
  571    HA   GLU  70           HA       GLU  70   7.732  19.405  10.701
  572    HB2  GLU  70           HB2      GLU  70   7.762  19.109  13.129
  573    HB3  GLU  70           HB1      GLU  70   9.460  18.664  13.056
  574    HG2  GLU  70           HG2      GLU  70   9.209  20.955  13.816
  575    HG3  GLU  70           HG1      GLU  70  10.018  20.897  12.250
  576    H    HIS  71           HN       HIS  71   8.660  19.564   8.802
  577    HA   HIS  71           HA       HIS  71  11.569  19.841   8.812
  578    HB2  HIS  71           HB2      HIS  71   9.683  19.156   6.538
  579    HB3  HIS  71           HB1      HIS  71  11.273  19.823   6.223
  580    HD1  HIS  71           HD1      HIS  71  11.927  17.589   4.993
  581    HD2  HIS  71           HD2      HIS  71  11.015  17.129   9.016
  582    HE1  HIS  71           HE1      HIS  71  12.784  15.335   5.626
  583    HE2  HIS  71           HE2      HIS  71  12.345  15.139   8.087
  584    H    HIS  72           HN       HIS  72  11.806  21.882   9.418
  585    HA   HIS  72           HA       HIS  72   9.670  23.713   9.043
  586    HB2  HIS  72           HB2      HIS  72  11.301  23.601  11.028
  587    HB3  HIS  72           HB1      HIS  72  12.379  24.566  10.023
  588    HD1  HIS  72           HD1      HIS  72   9.178  24.739  11.940
  589    HD2  HIS  72           HD2      HIS  72  11.589  27.266   9.693
  590    HE1  HIS  72           HE1      HIS  72   8.287  27.046  12.323
  591    HE2  HIS  72           HE2      HIS  72   9.602  28.503  10.759
  592    H    HIS  73           HN       HIS  73  12.607  23.165   7.273
  593    HA   HIS  73           HA       HIS  73  12.263  25.633   5.792
  594    HB2  HIS  73           HB2      HIS  73  14.103  23.275   5.325
  595    HB3  HIS  73           HB1      HIS  73  13.890  24.522   4.113
  596    HD1  HIS  73           HD1      HIS  73  14.930  26.840   4.607
  597    HD2  HIS  73           HD2      HIS  73  15.647  23.971   7.526
  598    HE1  HIS  73           HE1      HIS  73  16.687  27.820   6.081
  599    HE2  HIS  73           HE2      HIS  73  17.203  26.036   7.769
  600    H    HIS  74           HN       HIS  74  11.370  22.336   5.579
  601    HA   HIS  74           HA       HIS  74   9.901  21.163   4.389
  602    HB2  HIS  74           HB2      HIS  74   8.291  22.955   4.826
  603    HB3  HIS  74           HB1      HIS  74   8.889  23.869   3.450
  604    HD1  HIS  74           HD1      HIS  74   6.785  23.912   2.083
  605    HD2  HIS  74           HD2      HIS  74   7.791  20.067   3.279
  606    HE1  HIS  74           HE1      HIS  74   5.168  22.384   0.902
  607    HE2  HIS  74           HE2      HIS  74   5.623  20.130   1.892
  608    H    HIS  75           HN       HIS  75  11.172  23.731   2.369
  609    HA   HIS  75           HA       HIS  75  11.454  21.927   0.111
  610    HB2  HIS  75           HB2      HIS  75  10.871  24.404  -0.148
  611    HB3  HIS  75           HB1      HIS  75  12.494  24.760   0.410
  612    HD1  HIS  75           HD1      HIS  75  14.513  24.179  -1.266
  613    HD2  HIS  75           HD2      HIS  75  10.685  23.552  -2.801
  614    HE1  HIS  75           HE1      HIS  75  14.797  23.946  -3.725
  615    HE2  HIS  75           HE2      HIS  75  12.564  23.144  -4.503
  616    H    HIS  76           HN       HIS  76  13.544  21.303  -0.653
  617    HA   HIS  76           HA       HIS  76  15.683  21.622   1.320
  618    HB2  HIS  76           HB2      HIS  76  15.539  19.776  -1.100
  619    HB3  HIS  76           HB1      HIS  76  16.873  19.844   0.036
  620    HD1  HIS  76           HD1      HIS  76  16.443  18.827   2.425
  621    HD2  HIS  76           HD2      HIS  76  13.367  18.249  -0.308
  622    HE1  HIS  76           HE1      HIS  76  14.963  17.084   3.434
  623    HE2  HIS  76           HE2      HIS  76  13.032  16.863   1.835
  Start of MODEL   15
    1    H1   GLU   1           HT1      GLU   1   0.291  -7.673 -17.344
    2    H2   GLU   1           HT2      GLU   1   0.160  -7.914 -15.666
    3    H3   GLU   1           HT3      GLU   1   0.372  -9.229 -16.699
    4    HA   GLU   1           HA       GLU   1   2.551  -8.529 -17.269
    5    HB2  GLU   1           HB2      GLU   1   2.025  -6.323 -15.275
    6    HB3  GLU   1           HB1      GLU   1   3.567  -6.652 -16.043
    7    HG2  GLU   1           HG2      GLU   1   2.516  -6.155 -18.230
    8    HG3  GLU   1           HG1      GLU   1   1.039  -5.729 -17.371
    9    H    ASP   2           HN       ASP   2   3.470 -10.246 -16.386
   10    HA   ASP   2           HA       ASP   2   2.990 -10.800 -13.590
   11    HB2  ASP   2           HB2      ASP   2   2.920 -12.671 -15.193
   12    HB3  ASP   2           HB1      ASP   2   4.581 -12.325 -15.657
   13    H    MET   3           HN       MET   3   4.285 -10.239 -12.059
   14    HA   MET   3           HA       MET   3   5.890  -9.234 -10.918
   15    HB2  MET   3           HB2      MET   3   7.391 -11.071 -11.669
   16    HB3  MET   3           HB1      MET   3   7.778 -10.150 -13.114
   17    HG2  MET   3           HG2      MET   3   8.814  -8.411 -11.728
   18    HG3  MET   3           HG1      MET   3   8.411  -9.324 -10.282
   19    HE1  MET   3           HE1      MET   3  10.569  -9.201 -13.560
   20    HE2  MET   3           HE2      MET   3   9.732 -10.743 -13.762
   21    HE3  MET   3           HE3      MET   3  11.467 -10.712 -13.471
   22    H    GLU   4           HN       GLU   4   4.912  -7.322 -11.165
   23    HA   GLU   4           HA       GLU   4   5.528  -5.611 -13.362
   24    HB2  GLU   4           HB2      GLU   4   3.949  -5.194 -10.834
   25    HB3  GLU   4           HB1      GLU   4   4.145  -3.968 -12.077
   26    HG2  GLU   4           HG2      GLU   4   3.011  -5.295 -13.679
   27    HG3  GLU   4           HG1      GLU   4   2.990  -6.689 -12.601
   28    HA   PRO   5           HA       PRO   5   9.144  -3.984 -11.196
   29    HB2  PRO   5           HB2      PRO   5   9.405  -2.230 -13.534
   30    HB3  PRO   5           HB1      PRO   5  10.509  -3.479 -12.956
   31    HG2  PRO   5           HG2      PRO   5   9.108  -3.850 -15.203
   32    HG3  PRO   5           HG1      PRO   5   9.357  -5.178 -14.053
   33    HD2  PRO   5           HD2      PRO   5   6.965  -3.388 -14.351
   34    HD3  PRO   5           HD1      PRO   5   7.062  -5.170 -14.307
   35    H    CYS   6           HN       CYS   6   6.496  -2.095 -12.440
   36    HA   CYS   6           HA       CYS   6   7.520   0.400 -11.511
   37    HB2  CYS   6           HB2      CYS   6   4.797  -0.324 -12.495
   38    HB3  CYS   6           HB1      CYS   6   5.383   1.313 -12.246
   39    HG   CYS   6           HG       CYS   6   5.563   1.159 -14.925
   40    H    LEU   7           HN       LEU   7   7.790   0.313  -9.323
   41    HA   LEU   7           HA       LEU   7   7.255   0.817  -7.176
   42    HB2  LEU   7           HB2      LEU   7   4.461   1.146  -8.258
   43    HB3  LEU   7           HB1      LEU   7   4.963   1.632  -6.648
   44    HG   LEU   7           HG       LEU   7   6.212   2.756  -9.161
   45   HD11  LEU   7          HD11      LEU   7   4.834   4.706  -8.861
   46   HD12  LEU   7          HD12      LEU   7   4.033   3.967  -7.479
   47   HD13  LEU   7          HD13      LEU   7   3.814   3.285  -9.095
   48   HD21  LEU   7          HD21      LEU   7   7.590   2.961  -7.184
   49   HD22  LEU   7          HD22      LEU   7   6.234   3.618  -6.275
   50   HD23  LEU   7          HD23      LEU   7   6.923   4.539  -7.607
   51    H    THR   8           HN       THR   8   5.488  -1.693  -8.677
   52    HA   THR   8           HA       THR   8   4.264  -3.016  -6.634
   53    HB   THR   8           HB       THR   8   5.673  -4.056  -9.075
   54    HG1  THR   8           HG1      THR   8   2.974  -3.880  -9.200
   55   HG21  THR   8          HG21      THR   8   4.068  -5.919  -8.937
   56   HG22  THR   8          HG22      THR   8   3.469  -5.231  -7.421
   57   HG23  THR   8          HG23      THR   8   5.117  -5.861  -7.508
   58    H    GLY   9           HN       GLY   9   4.910  -4.437  -5.104
   59    HA2  GLY   9           HA2      GLY   9   6.414  -6.056  -4.193
   60    HA3  GLY   9           HA1      GLY   9   7.739  -5.242  -5.018
   61    H    THR  10           HN       THR  10   6.339  -2.670  -4.093
   62    HA   THR  10           HA       THR  10   7.967  -2.277  -1.812
   63    HB   THR  10           HB       THR  10   5.721  -0.576  -2.840
   64    HG1  THR  10           HG1      THR  10   7.052  -0.456  -4.492
   65   HG21  THR  10          HG21      THR  10   6.965   1.303  -1.769
   66   HG22  THR  10          HG22      THR  10   8.097   0.132  -1.090
   67   HG23  THR  10          HG23      THR  10   6.401   0.109  -0.605
   68    H    LYS  11           HN       LYS  11   7.501  -2.667   0.168
   69    HA   LYS  11           HA       LYS  11   4.802  -3.398   1.005
   70    HB2  LYS  11           HB2      LYS  11   7.439  -3.589   2.501
   71    HB3  LYS  11           HB1      LYS  11   5.884  -4.214   3.050
   72    HG2  LYS  11           HG2      LYS  11   5.832  -5.797   1.218
   73    HG3  LYS  11           HG1      LYS  11   7.336  -5.133   0.583
   74    HD2  LYS  11           HD2      LYS  11   8.516  -5.852   2.587
   75    HD3  LYS  11           HD1      LYS  11   7.012  -6.472   3.270
   76    HE2  LYS  11           HE2      LYS  11   6.821  -8.045   1.409
   77    HE3  LYS  11           HE1      LYS  11   8.317  -7.427   0.720
   78    HZ1  LYS  11           HZ1      LYS  11   8.724  -9.449   1.929
   79    HZ2  LYS  11           HZ2      LYS  11   8.022  -8.856   3.312
   80    HZ3  LYS  11           HZ3      LYS  11   9.471  -8.187   2.753
   81    H    VAL  12           HN       VAL  12   3.616  -1.792   1.680
   82    HA   VAL  12           HA       VAL  12   4.930   0.525   2.932
   83    HB   VAL  12           HB       VAL  12   4.244   0.751   0.526
   84   HG11  VAL  12          HG11      VAL  12   1.968   1.168  -0.054
   85   HG12  VAL  12          HG12      VAL  12   1.477   0.611   1.551
   86   HG13  VAL  12          HG13      VAL  12   2.282  -0.492   0.439
   87   HG21  VAL  12          HG21      VAL  12   3.576   2.923   0.655
   88   HG22  VAL  12          HG22      VAL  12   4.606   2.623   2.060
   89   HG23  VAL  12          HG23      VAL  12   2.850   2.708   2.244
   90    H    LYS  13           HN       LYS  13   3.152   1.855   3.874
   91    HA   LYS  13           HA       LYS  13   1.193   0.115   5.167
   92    HB2  LYS  13           HB2      LYS  13   2.737   1.070   6.845
   93    HB3  LYS  13           HB1      LYS  13   2.326   2.693   6.306
   94    HG2  LYS  13           HG2      LYS  13   0.286   2.694   7.341
   95    HG3  LYS  13           HG1      LYS  13   0.125   0.941   7.259
   96    HD2  LYS  13           HD2      LYS  13   0.464   1.793   9.561
   97    HD3  LYS  13           HD1      LYS  13   1.706   0.658   9.052
   98    HE2  LYS  13           HE2      LYS  13   3.174   2.535   8.538
   99    HE3  LYS  13           HE1      LYS  13   1.947   3.665   9.121
  100    HZ1  LYS  13           HZ1      LYS  13   3.273   1.539  10.711
  101    HZ2  LYS  13           HZ2      LYS  13   2.100   2.601  11.308
  102    HZ3  LYS  13           HZ3      LYS  13   3.594   3.190  10.832
  103    H    VAL  14           HN       VAL  14  -0.946   0.810   5.353
  104    HA   VAL  14           HA       VAL  14  -1.663   2.852   3.402
  105    HB   VAL  14           HB       VAL  14  -2.775   0.059   3.776
  106   HG11  VAL  14          HG11      VAL  14  -4.590   1.680   3.452
  107   HG12  VAL  14          HG12      VAL  14  -4.410   0.573   2.097
  108   HG13  VAL  14          HG13      VAL  14  -3.806   2.233   1.968
  109   HG21  VAL  14          HG21      VAL  14  -0.766   0.175   2.392
  110   HG22  VAL  14          HG22      VAL  14  -1.524   1.399   1.370
  111   HG23  VAL  14          HG23      VAL  14  -2.179  -0.237   1.421
  112    H    LYS  15           HN       LYS  15  -3.044   4.278   4.195
  113    HA   LYS  15           HA       LYS  15  -4.558   3.646   6.625
  114    HB2  LYS  15           HB2      LYS  15  -3.017   5.641   6.629
  115    HB3  LYS  15           HB1      LYS  15  -4.016   6.275   5.289
  116    HG2  LYS  15           HG2      LYS  15  -5.906   6.436   6.759
  117    HG3  LYS  15           HG1      LYS  15  -4.994   5.701   8.077
  118    HD2  LYS  15           HD2      LYS  15  -3.383   7.588   7.929
  119    HD3  LYS  15           HD1      LYS  15  -4.444   8.346   6.743
  120    HE2  LYS  15           HE2      LYS  15  -6.245   8.396   8.384
  121    HE3  LYS  15           HE1      LYS  15  -5.203   7.605   9.561
  122    HZ1  LYS  15           HZ1      LYS  15  -3.697   9.545   9.386
  123    HZ2  LYS  15           HZ2      LYS  15  -5.210   9.915   9.992
  124    HZ3  LYS  15           HZ3      LYS  15  -4.836  10.316   8.407
  125    H    TYR  16           HN       TYR  16  -6.601   3.015   6.008
  126    HA   TYR  16           HA       TYR  16  -7.773   4.450   3.764
  127    HB2  TYR  16           HB2      TYR  16  -6.859   2.174   3.103
  128    HB3  TYR  16           HB1      TYR  16  -8.027   1.484   4.225
  129    HD1  TYR  16           HD2      TYR  16  -7.804   3.673   1.248
  130    HD2  TYR  16           HD1      TYR  16 -10.092   0.923   3.483
  131    HE1  TYR  16           HE2      TYR  16  -9.485   3.661  -0.550
  132    HE2  TYR  16           HE1      TYR  16 -11.816   0.891   1.694
  133    HH   TYR  16           HH       TYR  16 -11.240   1.970  -1.339
  134    H    GLY  17           HN       GLY  17  -9.285   5.605   4.822
  135    HA2  GLY  17           HA2      GLY  17 -11.280   4.108   6.240
  136    HA3  GLY  17           HA1      GLY  17 -10.305   5.216   7.202
  137    H    ARG  18           HN       ARG  18 -13.117   4.996   6.360
  138    HA   ARG  18           HA       ARG  18 -13.498   7.831   5.999
  139    HB2  ARG  18           HB2      ARG  18 -15.320   7.453   4.327
  140    HB3  ARG  18           HB1      ARG  18 -13.711   7.114   3.707
  141    HG2  ARG  18           HG2      ARG  18 -14.114   4.754   3.804
  142    HG3  ARG  18           HG1      ARG  18 -15.615   4.985   4.691
  143    HD2  ARG  18           HD2      ARG  18 -16.518   6.221   2.731
  144    HD3  ARG  18           HD1      ARG  18 -15.041   5.843   1.855
  145    HE   ARG  18           HE       ARG  18 -15.657   3.453   2.219
  146   HH11  ARG  18          HH11      ARG  18 -18.237   5.918   2.195
  147   HH12  ARG  18          HH12      ARG  18 -19.397   4.863   1.538
  148   HH21  ARG  18          HH21      ARG  18 -17.274   2.034   1.399
  149   HH22  ARG  18          HH22      ARG  18 -18.850   2.581   1.109
  150    H    GLY  19           HN       GLY  19 -14.645   8.362   7.714
  151    HA2  GLY  19           HA2      GLY  19 -16.378   8.432   9.227
  152    HA3  GLY  19           HA1      GLY  19 -17.166   7.146   8.321
  153    H    LYS  20           HN       LYS  20 -17.496   5.396   9.513
  154    HA   LYS  20           HA       LYS  20 -15.771   4.882  11.770
  155    HB2  LYS  20           HB2      LYS  20 -18.222   4.662  12.066
  156    HB3  LYS  20           HB1      LYS  20 -18.246   3.382  10.862
  157    HG2  LYS  20           HG2      LYS  20 -18.327   2.531  13.194
  158    HG3  LYS  20           HG1      LYS  20 -16.934   1.954  12.263
  159    HD2  LYS  20           HD2      LYS  20 -15.520   3.655  13.303
  160    HD3  LYS  20           HD1      LYS  20 -16.899   4.225  14.249
  161    HE2  LYS  20           HE2      LYS  20 -16.964   2.205  15.478
  162    HE3  LYS  20           HE1      LYS  20 -15.840   1.411  14.372
  163    HZ1  LYS  20           HZ1      LYS  20 -15.180   3.741  16.085
  164    HZ2  LYS  20           HZ2      LYS  20 -14.107   2.908  15.093
  165    HZ3  LYS  20           HZ3      LYS  20 -14.764   2.157  16.443
  166    H    THR  21           HN       THR  21 -16.134   3.960   8.568
  167    HA   THR  21           HA       THR  21 -14.784   1.441   8.734
  168    HB   THR  21           HB       THR  21 -15.475   3.236   6.385
  169    HG1  THR  21           HG1      THR  21 -16.818   0.957   7.392
  170   HG21  THR  21          HG21      THR  21 -15.310   1.163   5.023
  171   HG22  THR  21          HG22      THR  21 -14.705   0.295   6.442
  172   HG23  THR  21          HG23      THR  21 -13.769   1.614   5.743
  173    H    GLN  22           HN       GLN  22 -13.073   2.646  10.047
  174    HA   GLN  22           HA       GLN  22 -10.974   3.755   8.294
  175    HB2  GLN  22           HB2      GLN  22 -11.877   5.479   9.787
  176    HB3  GLN  22           HB1      GLN  22 -11.611   4.439  11.172
  177    HG2  GLN  22           HG2      GLN  22  -9.923   6.153  11.107
  178    HG3  GLN  22           HG1      GLN  22  -9.190   4.580  10.785
  179   HE21  GLN  22          HE21      GLN  22  -8.228   4.233   8.818
  180   HE22  GLN  22          HE22      GLN  22  -8.017   5.492   7.645
  181    H    LYS  23           HN       LYS  23  -9.335   2.332   8.080
  182    HA   LYS  23           HA       LYS  23  -8.519   0.870  10.417
  183    HB2  LYS  23           HB2      LYS  23 -10.223  -0.487   9.227
  184    HB3  LYS  23           HB1      LYS  23  -9.259  -0.360   7.767
  185    HG2  LYS  23           HG2      LYS  23  -7.523  -1.643   8.732
  186    HG3  LYS  23           HG1      LYS  23  -8.355  -1.672  10.294
  187    HD2  LYS  23           HD2      LYS  23 -10.218  -2.911   9.312
  188    HD3  LYS  23           HD1      LYS  23  -9.455  -2.828   7.724
  189    HE2  LYS  23           HE2      LYS  23  -7.583  -4.169   8.561
  190    HE3  LYS  23           HE1      LYS  23  -8.339  -4.242  10.147
  191    HZ1  LYS  23           HZ1      LYS  23  -8.708  -6.235   8.771
  192    HZ2  LYS  23           HZ2      LYS  23  -9.557  -5.328   7.657
  193    HZ3  LYS  23           HZ3      LYS  23 -10.154  -5.513   9.227
  194    H    ILE  24           HN       ILE  24  -6.351   0.946  10.482
  195    HA   ILE  24           HA       ILE  24  -4.961   1.578   8.000
  196    HB   ILE  24           HB       ILE  24  -4.008   2.118  10.841
  197   HG12  ILE  24          HG12      ILE  24  -4.148   4.587   9.668
  198   HG13  ILE  24          HG11      ILE  24  -5.396   3.710   8.802
  199   HG21  ILE  24          HG21      ILE  24  -2.143   3.352   9.781
  200   HG22  ILE  24          HG22      ILE  24  -2.693   2.799   8.195
  201   HG23  ILE  24          HG23      ILE  24  -2.121   1.638   9.377
  202   HD11  ILE  24          HD11      ILE  24  -6.310   4.954  10.705
  203   HD12  ILE  24          HD12      ILE  24  -5.347   3.954  11.794
  204   HD13  ILE  24          HD13      ILE  24  -6.601   3.218  10.800
  205    H    TYR  25           HN       TYR  25  -3.496   0.288   7.230
  206    HA   TYR  25           HA       TYR  25  -2.602  -1.995   8.697
  207    HB2  TYR  25           HB2      TYR  25  -3.434  -3.360   6.505
  208    HB3  TYR  25           HB1      TYR  25  -4.309  -3.304   8.016
  209    HD1  TYR  25           HD2      TYR  25  -4.388  -0.378   5.645
  210    HD2  TYR  25           HD1      TYR  25  -6.353  -3.917   6.965
  211    HE1  TYR  25           HE2      TYR  25  -6.466   0.306   4.459
  212    HE2  TYR  25           HE1      TYR  25  -8.393  -3.224   5.780
  213    HH   TYR  25           HH       TYR  25  -8.440  -1.046   3.438
  214    H    GLU  26           HN       GLU  26  -1.164  -3.393   7.287
  215    HA   GLU  26           HA       GLU  26   0.440  -1.587   5.622
  216    HB2  GLU  26           HB2      GLU  26   1.300  -3.905   7.370
  217    HB3  GLU  26           HB1      GLU  26   2.384  -3.008   6.308
  218    HG2  GLU  26           HG2      GLU  26   2.118  -1.010   7.572
  219    HG3  GLU  26           HG1      GLU  26   0.768  -1.691   8.467
  220    H    ALA  27           HN       ALA  27   1.081  -2.256   3.605
  221    HA   ALA  27           HA       ALA  27   0.116  -4.862   2.727
  222    HB1  ALA  27           HB1      ALA  27  -1.702  -3.279   2.331
  223    HB2  ALA  27           HB2      ALA  27  -1.029  -3.895   0.821
  224    HB3  ALA  27           HB3      ALA  27  -0.609  -2.276   1.379
  225    H    SER  28           HN       SER  28   0.638  -5.079   0.292
  226    HA   SER  28           HA       SER  28   3.187  -3.810  -0.305
  227    HB2  SER  28           HB2      SER  28   2.225  -6.549  -1.154
  228    HB3  SER  28           HB1      SER  28   3.830  -5.843  -1.389
  229    HG   SER  28           HG       SER  28   3.584  -5.608   1.078
  230    H    ILE  29           HN       ILE  29   3.287  -2.863  -2.244
  231    HA   ILE  29           HA       ILE  29   0.879  -2.305  -3.696
  232    HB   ILE  29           HB       ILE  29   3.755  -1.717  -4.464
  233   HG12  ILE  29          HG12      ILE  29   3.266  -0.652  -2.340
  234   HG13  ILE  29          HG11      ILE  29   3.320   0.575  -3.595
  235   HG21  ILE  29          HG21      ILE  29   1.205  -0.529  -5.528
  236   HG22  ILE  29          HG22      ILE  29   2.314  -1.604  -6.383
  237   HG23  ILE  29          HG23      ILE  29   2.835   0.022  -5.926
  238   HD11  ILE  29          HD11      ILE  29   0.836   0.534  -3.648
  239   HD12  ILE  29          HD12      ILE  29   1.520   1.048  -2.111
  240   HD13  ILE  29          HD13      ILE  29   0.872  -0.584  -2.277
  241    H    LYS  30           HN       LYS  30   0.049  -3.424  -5.367
  242    HA   LYS  30           HA       LYS  30   1.792  -5.441  -6.547
  243    HB2  LYS  30           HB2      LYS  30  -0.519  -5.943  -5.298
  244    HB3  LYS  30           HB1      LYS  30  -1.165  -5.597  -6.891
  245    HG2  LYS  30           HG2      LYS  30   0.919  -7.720  -6.314
  246    HG3  LYS  30           HG1      LYS  30  -0.805  -8.019  -6.454
  247    HD2  LYS  30           HD2      LYS  30   0.928  -6.885  -8.662
  248    HD3  LYS  30           HD1      LYS  30   0.498  -8.589  -8.501
  249    HE2  LYS  30           HE2      LYS  30  -1.878  -7.985  -8.683
  250    HE3  LYS  30           HE1      LYS  30  -1.428  -6.295  -8.868
  251    HZ1  LYS  30           HZ1      LYS  30  -1.872  -7.313 -10.989
  252    HZ2  LYS  30           HZ2      LYS  30  -0.651  -8.470 -10.738
  253    HZ3  LYS  30           HZ3      LYS  30  -0.262  -6.850 -10.896
  254    H    SER  31           HN       SER  31  -0.629  -2.919  -7.314
  255    HA   SER  31           HA       SER  31   0.623  -2.561  -9.924
  256    HB2  SER  31           HB2      SER  31  -2.364  -3.084  -9.623
  257    HB3  SER  31           HB1      SER  31  -1.569  -2.594 -11.114
  258    HG   SER  31           HG       SER  31  -0.307  -4.542 -10.916
  259    H    THR  32           HN       THR  32  -0.359  -0.471 -11.016
  260    HA   THR  32           HA       THR  32  -1.681   1.306  -9.118
  261    HB   THR  32           HB       THR  32   0.586   2.469 -10.662
  262    HG1  THR  32           HG1      THR  32   0.726   0.718  -8.482
  263   HG21  THR  32          HG21      THR  32   0.632   4.010  -8.799
  264   HG22  THR  32          HG22      THR  32  -0.607   3.064  -7.983
  265   HG23  THR  32          HG23      THR  32  -0.979   3.881  -9.503
  266    H    GLU  33           HN       GLU  33  -2.927   2.810 -10.144
  267    HA   GLU  33           HA       GLU  33  -2.803   2.996 -13.048
  268    HB2  GLU  33           HB2      GLU  33  -5.280   2.283 -11.504
  269    HB3  GLU  33           HB1      GLU  33  -5.342   2.998 -13.104
  270    HG2  GLU  33           HG2      GLU  33  -3.871   1.157 -13.846
  271    HG3  GLU  33           HG1      GLU  33  -4.213   0.332 -12.314
  272    H    ILE  34           HN       ILE  34  -3.500   4.849 -13.866
  273    HA   ILE  34           HA       ILE  34  -4.075   6.942 -11.885
  274    HB   ILE  34           HB       ILE  34  -2.774   7.279 -14.586
  275   HG12  ILE  34          HG12      ILE  34  -0.815   8.270 -13.323
  276   HG13  ILE  34          HG11      ILE  34  -1.598   7.782 -11.836
  277   HG21  ILE  34          HG21      ILE  34  -4.220   9.162 -14.174
  278   HG22  ILE  34          HG22      ILE  34  -2.548   9.700 -14.025
  279   HG23  ILE  34          HG23      ILE  34  -3.509   9.408 -12.578
  280   HD11  ILE  34          HD11      ILE  34  -1.391   5.490 -12.445
  281   HD12  ILE  34          HD12      ILE  34   0.194   6.270 -12.460
  282   HD13  ILE  34          HD13      ILE  34  -0.638   5.906 -13.987
  283    H    ASP  35           HN       ASP  35  -6.107   7.476 -12.034
  284    HA   ASP  35           HA       ASP  35  -7.413   7.684 -14.623
  285    HB2  ASP  35           HB2      ASP  35  -7.661   5.262 -13.877
  286    HB3  ASP  35           HB1      ASP  35  -8.624   5.862 -12.533
  287    H    ASP  36           HN       ASP  36  -8.837   9.252 -14.619
  288    HA   ASP  36           HA       ASP  36 -10.253  10.893 -14.036
  289    HB2  ASP  36           HB2      ASP  36 -11.404   9.116 -12.643
  290    HB3  ASP  36           HB1      ASP  36 -10.419   9.620 -11.284
  291    H    GLY  37           HN       GLY  37  -7.370  10.906 -13.589
  292    HA2  GLY  37           HA2      GLY  37  -5.965  12.712 -13.198
  293    HA3  GLY  37           HA1      GLY  37  -7.254  13.491 -12.299
  294    H    GLU  38           HN       GLU  38  -6.892  10.387 -11.111
  295    HA   GLU  38           HA       GLU  38  -4.846  11.228  -9.203
  296    HB2  GLU  38           HB2      GLU  38  -6.109  10.123  -7.434
  297    HB3  GLU  38           HB1      GLU  38  -6.987  11.498  -8.124
  298    HG2  GLU  38           HG2      GLU  38  -8.311   9.787  -9.444
  299    HG3  GLU  38           HG1      GLU  38  -7.531   8.553  -8.458
  300    H    VAL  39           HN       VAL  39  -3.792   9.482  -8.117
  301    HA   VAL  39           HA       VAL  39  -3.645   7.225  -9.902
  302    HB   VAL  39           HB       VAL  39  -1.610   8.562  -9.977
  303   HG11  VAL  39          HG11      VAL  39  -0.135   8.819  -8.045
  304   HG12  VAL  39          HG12      VAL  39  -1.406   8.113  -7.031
  305   HG13  VAL  39          HG13      VAL  39  -1.695   9.638  -7.875
  306   HG21  VAL  39          HG21      VAL  39  -1.418   6.149 -10.274
  307   HG22  VAL  39          HG22      VAL  39  -1.201   5.913  -8.559
  308   HG23  VAL  39          HG23      VAL  39   0.029   6.760  -9.490
  309    H    LEU  40           HN       LEU  40  -4.244   5.482  -9.206
  310    HA   LEU  40           HA       LEU  40  -4.714   5.145  -6.356
  311    HB2  LEU  40           HB2      LEU  40  -6.032   3.807  -8.704
  312    HB3  LEU  40           HB1      LEU  40  -6.441   3.537  -7.016
  313    HG   LEU  40           HG       LEU  40  -8.181   4.934  -7.784
  314   HD11  LEU  40          HD11      LEU  40  -7.960   7.008  -6.720
  315   HD12  LEU  40          HD12      LEU  40  -6.207   6.783  -6.613
  316   HD13  LEU  40          HD13      LEU  40  -7.286   5.689  -5.755
  317   HD21  LEU  40          HD21      LEU  40  -7.100   5.379  -9.974
  318   HD22  LEU  40          HD22      LEU  40  -6.184   6.681  -9.216
  319   HD23  LEU  40          HD23      LEU  40  -7.957   6.744  -9.288
  320    H    TYR  41           HN       TYR  41  -3.901   3.458  -5.444
  321    HA   TYR  41           HA       TYR  41  -2.119   1.792  -7.047
  322    HB2  TYR  41           HB2      TYR  41  -2.073   2.589  -4.152
  323    HB3  TYR  41           HB1      TYR  41  -1.116   1.257  -4.779
  324    HD1  TYR  41           HD2      TYR  41  -1.732   4.896  -5.309
  325    HD2  TYR  41           HD1      TYR  41   0.984   1.654  -5.589
  326    HE1  TYR  41           HE2      TYR  41   0.065   6.457  -5.922
  327    HE2  TYR  41           HE1      TYR  41   2.778   3.182  -6.201
  328    HH   TYR  41           HH       TYR  41   2.932   5.457  -7.269
  329    H    LEU  42           HN       LEU  42  -2.194  -0.326  -6.792
  330    HA   LEU  42           HA       LEU  42  -4.566  -1.291  -5.456
  331    HB2  LEU  42           HB2      LEU  42  -4.471  -1.638  -7.921
  332    HB3  LEU  42           HB1      LEU  42  -2.956  -2.490  -7.719
  333    HG   LEU  42           HG       LEU  42  -5.108  -3.861  -8.115
  334   HD11  LEU  42          HD11      LEU  42  -3.038  -4.902  -7.519
  335   HD12  LEU  42          HD12      LEU  42  -4.363  -5.664  -6.633
  336   HD13  LEU  42          HD13      LEU  42  -3.290  -4.524  -5.813
  337   HD21  LEU  42          HD21      LEU  42  -6.284  -4.440  -6.010
  338   HD22  LEU  42          HD22      LEU  42  -6.551  -2.788  -6.546
  339   HD23  LEU  42          HD23      LEU  42  -5.442  -3.119  -5.223
  340    H    VAL  43           HN       VAL  43  -4.132  -2.185  -3.650
  341    HA   VAL  43           HA       VAL  43  -1.407  -3.170  -3.149
  342    HB   VAL  43           HB       VAL  43  -1.528  -2.317  -0.947
  343   HG11  VAL  43          HG11      VAL  43  -2.741  -0.193  -2.674
  344   HG12  VAL  43          HG12      VAL  43  -1.049  -0.633  -2.632
  345   HG13  VAL  43          HG13      VAL  43  -1.810   0.069  -1.197
  346   HG21  VAL  43          HG21      VAL  43  -3.853  -2.921  -0.381
  347   HG22  VAL  43          HG22      VAL  43  -4.445  -1.628  -1.416
  348   HG23  VAL  43          HG23      VAL  43  -3.533  -1.238   0.040
  349    H    HIS  44           HN       HIS  44  -1.259  -5.015  -2.020
  350    HA   HIS  44           HA       HIS  44  -3.704  -6.235  -1.046
  351    HB2  HIS  44           HB2      HIS  44  -3.059  -7.435  -3.158
  352    HB3  HIS  44           HB1      HIS  44  -1.488  -7.793  -2.441
  353    HD1  HIS  44           HD1      HIS  44  -5.172  -8.674  -2.030
  354    HD2  HIS  44           HD2      HIS  44  -1.446  -9.930  -0.660
  355    HE1  HIS  44           HE1      HIS  44  -5.587 -10.727  -0.695
  356    HE2  HIS  44           HE2      HIS  44  -3.378 -11.381   0.237
  357    H    TYR  45           HN       TYR  45  -3.429  -7.151   0.936
  358    HA   TYR  45           HA       TYR  45  -1.158  -6.046   2.202
  359    HB2  TYR  45           HB2      TYR  45  -3.546  -7.529   3.349
  360    HB3  TYR  45           HB1      TYR  45  -2.351  -6.632   4.293
  361    HD1  TYR  45           HD2      TYR  45  -5.026  -6.238   1.718
  362    HD2  TYR  45           HD1      TYR  45  -2.433  -4.259   4.443
  363    HE1  TYR  45           HE2      TYR  45  -6.160  -4.104   1.240
  364    HE2  TYR  45           HE1      TYR  45  -3.561  -2.137   3.959
  365    HH   TYR  45           HH       TYR  45  -6.481  -1.852   2.160
  366    H    TYR  46           HN       TYR  46   0.610  -7.041   1.815
  367    HA   TYR  46           HA       TYR  46   2.194  -8.534   1.568
  368    HB2  TYR  46           HB2      TYR  46   0.939  -9.291   4.133
  369    HB3  TYR  46           HB1      TYR  46   2.297 -10.260   3.523
  370    HD1  TYR  46           HD1      TYR  46   1.275  -6.789   4.462
  371    HD2  TYR  46           HD2      TYR  46   4.481  -9.491   3.775
  372    HE1  TYR  46           HE1      TYR  46   2.864  -5.114   5.313
  373    HE2  TYR  46           HE2      TYR  46   6.073  -7.838   4.625
  374    HH   TYR  46           HH       TYR  46   5.125  -5.014   6.260
  375    H    GLY  47           HN       GLY  47   1.649  -9.347  -0.396
  376    HA2  GLY  47           HA2      GLY  47   1.912 -11.812  -1.068
  377    HA3  GLY  47           HA1      GLY  47   0.277 -11.925  -0.421
  378    H    TRP  48           HN       TRP  48  -0.003 -12.642  -2.744
  379    HA   TRP  48           HA       TRP  48  -0.187 -10.417  -4.618
  380    HB2  TRP  48           HB2      TRP  48  -0.408 -12.182  -6.347
  381    HB3  TRP  48           HB1      TRP  48   1.019 -12.436  -5.364
  382    HD1  TRP  48           HD1      TRP  48  -2.123 -14.088  -6.504
  383    HE1  TRP  48           HE1      TRP  48  -2.299 -16.461  -5.522
  384    HE3  TRP  48           HE3      TRP  48   1.668 -13.844  -3.074
  385    HZ2  TRP  48           HZ2      TRP  48  -1.015 -18.020  -3.565
  386    HZ3  TRP  48           HZ3      TRP  48   2.126 -15.822  -1.690
  387    HH2  TRP  48           HH2      TRP  48   0.813 -17.865  -1.929
  388    H    ASN  49           HN       ASN  49  -2.249 -10.266  -5.937
  389    HA   ASN  49           HA       ASN  49  -4.426 -10.821  -4.075
  390    HB2  ASN  49           HB2      ASN  49  -5.762  -9.038  -5.144
  391    HB3  ASN  49           HB1      ASN  49  -4.281  -8.439  -4.431
  392   HD21  ASN  49          HD21      ASN  49  -6.144  -7.551  -6.669
  393   HD22  ASN  49          HD22      ASN  49  -5.087  -7.203  -7.974
  394    H    VAL  50           HN       VAL  50  -5.149 -12.744  -4.568
  395    HA   VAL  50           HA       VAL  50  -6.126 -13.151  -7.255
  396    HB   VAL  50           HB       VAL  50  -6.998 -15.383  -6.393
  397   HG11  VAL  50          HG11      VAL  50  -4.052 -14.867  -6.079
  398   HG12  VAL  50          HG12      VAL  50  -4.893 -15.230  -7.587
  399   HG13  VAL  50          HG13      VAL  50  -4.801 -16.444  -6.315
  400   HG21  VAL  50          HG21      VAL  50  -7.134 -14.823  -4.007
  401   HG22  VAL  50          HG22      VAL  50  -5.377 -14.672  -3.939
  402   HG23  VAL  50          HG23      VAL  50  -6.118 -16.238  -4.275
  403    H    ARG  51           HN       ARG  51  -7.427 -12.807  -4.010
  404    HA   ARG  51           HA       ARG  51 -10.078 -12.326  -5.185
  405    HB2  ARG  51           HB2      ARG  51 -10.142 -14.191  -3.713
  406    HB3  ARG  51           HB1      ARG  51  -9.229 -13.340  -2.490
  407    HG2  ARG  51           HG2      ARG  51 -11.528 -13.572  -1.779
  408    HG3  ARG  51           HG1      ARG  51 -11.188 -11.874  -2.082
  409    HD2  ARG  51           HD2      ARG  51 -12.531 -13.688  -4.073
  410    HD3  ARG  51           HD1      ARG  51 -13.425 -12.741  -2.889
  411    HE   ARG  51           HE       ARG  51 -11.981 -10.851  -4.078
  412   HH11  ARG  51          HH11      ARG  51 -13.945 -13.441  -5.404
  413   HH12  ARG  51          HH12      ARG  51 -14.311 -12.629  -6.850
  414   HH21  ARG  51          HH21      ARG  51 -12.454  -9.724  -6.066
  415   HH22  ARG  51          HH22      ARG  51 -13.447 -10.455  -7.229
  416    H    TYR  52           HN       TYR  52  -8.043 -11.206  -2.508
  417    HA   TYR  52           HA       TYR  52  -9.822  -8.931  -2.253
  418    HB2  TYR  52           HB2      TYR  52  -8.973 -10.248  -0.258
  419    HB3  TYR  52           HB1      TYR  52  -7.407  -9.492  -0.538
  420    HD1  TYR  52           HD1      TYR  52 -10.871  -8.951   0.499
  421    HD2  TYR  52           HD2      TYR  52  -7.055  -7.134   0.037
  422    HE1  TYR  52           HE1      TYR  52 -11.621  -7.052   1.853
  423    HE2  TYR  52           HE2      TYR  52  -7.812  -5.217   1.395
  424    HH   TYR  52           HH       TYR  52  -9.931  -4.126   2.028
  425    H    ASP  53           HN       ASP  53  -9.488  -7.485  -3.730
  426    HA   ASP  53           HA       ASP  53  -6.780  -6.393  -4.043
  427    HB2  ASP  53           HB2      ASP  53  -7.322  -5.901  -6.388
  428    HB3  ASP  53           HB1      ASP  53  -7.950  -7.473  -6.050
  429    H    GLU  54           HN       GLU  54  -6.511  -4.273  -3.273
  430    HA   GLU  54           HA       GLU  54  -8.976  -2.755  -3.010
  431    HB2  GLU  54           HB2      GLU  54  -8.399  -3.791  -0.802
  432    HB3  GLU  54           HB1      GLU  54  -6.886  -2.903  -0.827
  433    HG2  GLU  54           HG2      GLU  54  -7.962  -0.839  -0.548
  434    HG3  GLU  54           HG1      GLU  54  -9.532  -1.507  -0.987
  435    H    TRP  55           HN       TRP  55  -8.888  -0.671  -3.432
  436    HA   TRP  55           HA       TRP  55  -6.383   0.274  -4.638
  437    HB2  TRP  55           HB2      TRP  55  -9.234   1.061  -5.272
  438    HB3  TRP  55           HB1      TRP  55  -7.799   1.696  -6.067
  439    HD1  TRP  55           HD1      TRP  55  -9.752  -1.610  -5.683
  440    HE1  TRP  55           HE1      TRP  55  -9.240  -3.105  -7.683
  441    HE3  TRP  55           HE3      TRP  55  -6.231   1.319  -7.953
  442    HZ2  TRP  55           HZ2      TRP  55  -7.567  -3.036  -9.986
  443    HZ3  TRP  55           HZ3      TRP  55  -5.225   0.528 -10.050
  444    HH2  TRP  55           HH2      TRP  55  -5.883  -1.602 -11.043
  445    H    VAL  56           HN       VAL  56  -5.417   1.828  -3.649
  446    HA   VAL  56           HA       VAL  56  -6.942   3.702  -1.949
  447    HB   VAL  56           HB       VAL  56  -4.112   2.756  -1.390
  448   HG11  VAL  56          HG11      VAL  56  -5.985   4.266   0.379
  449   HG12  VAL  56          HG12      VAL  56  -4.601   4.903  -0.508
  450   HG13  VAL  56          HG13      VAL  56  -4.342   3.730   0.765
  451   HG21  VAL  56          HG21      VAL  56  -5.002   1.360   0.394
  452   HG22  VAL  56          HG22      VAL  56  -5.617   0.837  -1.172
  453   HG23  VAL  56          HG23      VAL  56  -6.649   1.770  -0.083
  454    H    LYS  57           HN       LYS  57  -6.203   5.847  -2.066
  455    HA   LYS  57           HA       LYS  57  -4.776   6.527  -4.477
  456    HB2  LYS  57           HB2      LYS  57  -6.866   7.682  -3.646
  457    HB3  LYS  57           HB1      LYS  57  -5.926   8.292  -2.303
  458    HG2  LYS  57           HG2      LYS  57  -4.605   9.648  -3.767
  459    HG3  LYS  57           HG1      LYS  57  -5.355   8.926  -5.198
  460    HD2  LYS  57           HD2      LYS  57  -7.552   9.789  -4.485
  461    HD3  LYS  57           HD1      LYS  57  -6.808  10.515  -3.065
  462    HE2  LYS  57           HE2      LYS  57  -6.019  11.242  -5.881
  463    HE3  LYS  57           HE1      LYS  57  -7.310  12.062  -5.011
  464    HZ1  LYS  57           HZ1      LYS  57  -4.487  11.908  -4.046
  465    HZ2  LYS  57           HZ2      LYS  57  -5.748  12.811  -3.414
  466    HZ3  LYS  57           HZ3      LYS  57  -5.149  13.174  -4.937
  467    H    ALA  58           HN       ALA  58  -2.842   7.819  -4.451
  468    HA   ALA  58           HA       ALA  58  -0.739   6.766  -3.012
  469    HB1  ALA  58           HB1      ALA  58  -0.604   8.050  -5.130
  470    HB2  ALA  58           HB2      ALA  58   0.624   8.482  -3.938
  471    HB3  ALA  58           HB3      ALA  58  -0.773   9.527  -4.185
  472    H    ASP  59           HN       ASP  59  -2.685   9.466  -2.277
  473    HA   ASP  59           HA       ASP  59  -1.056  10.796  -0.377
  474    HB2  ASP  59           HB2      ASP  59  -4.049  10.909  -0.735
  475    HB3  ASP  59           HB1      ASP  59  -3.072  12.067   0.159
  476    H    ARG  60           HN       ARG  60  -3.191   8.105  -0.120
  477    HA   ARG  60           HA       ARG  60  -3.336   8.318   2.798
  478    HB2  ARG  60           HB2      ARG  60  -4.815   6.860   0.719
  479    HB3  ARG  60           HB1      ARG  60  -4.643   6.088   2.284
  480    HG2  ARG  60           HG2      ARG  60  -5.662   8.092   3.315
  481    HG3  ARG  60           HG1      ARG  60  -5.955   8.722   1.683
  482    HD2  ARG  60           HD2      ARG  60  -7.264   6.782   1.108
  483    HD3  ARG  60           HD1      ARG  60  -6.738   6.027   2.602
  484    HE   ARG  60           HE       ARG  60  -8.133   7.358   3.856
  485   HH11  ARG  60          HH11      ARG  60  -8.524   8.149   0.428
  486   HH12  ARG  60          HH12      ARG  60 -10.148   8.603   0.522
  487   HH21  ARG  60          HH21      ARG  60 -10.462   8.056   4.024
  488   HH22  ARG  60          HH22      ARG  60 -11.251   8.588   2.631
  489    H    ILE  61           HN       ILE  61  -1.117   7.306   0.824
  490    HA   ILE  61           HA       ILE  61  -0.710   4.765   2.178
  491    HB   ILE  61           HB       ILE  61   0.435   5.748  -0.476
  492   HG12  ILE  61          HG12      ILE  61  -1.759   3.765   0.144
  493   HG13  ILE  61          HG11      ILE  61  -1.964   5.340  -0.602
  494   HG21  ILE  61          HG21      ILE  61   0.499   3.060   0.841
  495   HG22  ILE  61          HG22      ILE  61   1.869   4.183   0.720
  496   HG23  ILE  61          HG23      ILE  61   1.193   3.446  -0.740
  497   HD11  ILE  61          HD11      ILE  61  -0.674   4.556  -2.540
  498   HD12  ILE  61          HD12      ILE  61  -2.114   3.584  -2.229
  499   HD13  ILE  61          HD13      ILE  61  -0.525   2.979  -1.759
  500    H    ILE  62           HN       ILE  62   1.530   4.400   3.018
  501    HA   ILE  62           HA       ILE  62   2.629   7.039   3.759
  502    HB   ILE  62           HB       ILE  62   2.696   4.440   5.350
  503   HG12  ILE  62          HG12      ILE  62   1.503   5.715   7.129
  504   HG13  ILE  62          HG11      ILE  62   1.290   7.061   6.003
  505   HG21  ILE  62          HG21      ILE  62   4.782   5.625   5.641
  506   HG22  ILE  62          HG22      ILE  62   3.836   5.673   7.126
  507   HG23  ILE  62          HG23      ILE  62   3.912   7.094   6.084
  508   HD11  ILE  62          HD11      ILE  62   0.104   4.285   5.806
  509   HD12  ILE  62          HD12      ILE  62  -0.115   5.565   4.616
  510   HD13  ILE  62          HD13      ILE  62  -0.746   5.764   6.251
  511    H    TRP  63           HN       TRP  63   4.297   7.346   2.513
  512    HA   TRP  63           HA       TRP  63   5.580   5.082   1.425
  513    HB2  TRP  63           HB2      TRP  63   5.950   8.013   0.840
  514    HB3  TRP  63           HB1      TRP  63   6.828   6.725   0.005
  515    HD1  TRP  63           HD1      TRP  63   3.605   8.586  -0.123
  516    HE1  TRP  63           HE1      TRP  63   2.009   7.510  -1.811
  517    HE3  TRP  63           HE3      TRP  63   6.143   4.226  -0.927
  518    HZ2  TRP  63           HZ2      TRP  63   1.852   5.087  -3.304
  519    HZ3  TRP  63           HZ3      TRP  63   5.200   2.578  -2.486
  520    HH2  TRP  63           HH2      TRP  63   3.109   2.993  -3.647
  521    HA   PRO  64           HA       PRO  64   8.729   4.988   4.503
  522    HB2  PRO  64           HB2      PRO  64  10.249   3.304   2.635
  523    HB3  PRO  64           HB1      PRO  64   9.627   2.917   4.240
  524    HG2  PRO  64           HG2      PRO  64   8.540   1.871   2.021
  525    HG3  PRO  64           HG1      PRO  64   7.562   2.305   3.437
  526    HD2  PRO  64           HD2      PRO  64   7.927   3.793   0.867
  527    HD3  PRO  64           HD1      PRO  64   6.462   3.498   1.832
  528    H    LEU  65           HN       LEU  65   9.936   6.629   4.793
  529    HA   LEU  65           HA       LEU  65  12.362   7.000   3.223
  530    HB2  LEU  65           HB2      LEU  65  10.368   8.723   2.674
  531    HB3  LEU  65           HB1      LEU  65  10.777   9.355   4.249
  532    HG   LEU  65           HG       LEU  65  11.775  10.682   2.455
  533   HD11  LEU  65          HD11      LEU  65  13.836   9.184   4.025
  534   HD12  LEU  65          HD12      LEU  65  12.988  10.656   4.515
  535   HD13  LEU  65          HD13      LEU  65  14.109  10.694   3.156
  536   HD21  LEU  65          HD21      LEU  65  13.246   8.167   1.691
  537   HD22  LEU  65          HD22      LEU  65  13.515   9.773   1.010
  538   HD23  LEU  65          HD23      LEU  65  11.969   8.959   0.767
  539    H    ASP  66           HN       ASP  66  12.847   5.577   4.816
  540    HA   ASP  66           HA       ASP  66  13.725   4.933   6.757
  541    HB2  ASP  66           HB2      ASP  66  13.680   7.865   7.178
  542    HB3  ASP  66           HB1      ASP  66  14.206   6.836   8.541
  543    H    LYS  67           HN       LYS  67  11.628   7.547   7.791
  544    HA   LYS  67           HA       LYS  67   9.709   7.693   8.983
  545    HB2  LYS  67           HB2      LYS  67   8.938   6.243   7.050
  546    HB3  LYS  67           HB1      LYS  67   9.182   4.843   8.075
  547    HG2  LYS  67           HG2      LYS  67   6.840   5.385   8.028
  548    HG3  LYS  67           HG1      LYS  67   7.470   5.738   9.635
  549    HD2  LYS  67           HD2      LYS  67   7.643   8.112   9.044
  550    HD3  LYS  67           HD1      LYS  67   7.008   7.761   7.438
  551    HE2  LYS  67           HE2      LYS  67   4.924   6.953   8.484
  552    HE3  LYS  67           HE1      LYS  67   5.584   7.363  10.066
  553    HZ1  LYS  67           HZ1      LYS  67   5.019   9.268   7.857
  554    HZ2  LYS  67           HZ2      LYS  67   5.716   9.695   9.308
  555    HZ3  LYS  67           HZ3      LYS  67   4.130   9.117   9.282
  556    H    GLY  68           HN       GLY  68  12.181   6.372  10.146
  557    HA2  GLY  68           HA2      GLY  68  10.959   4.815  12.292
  558    HA3  GLY  68           HA1      GLY  68  12.670   4.843  11.899
  559    H    LEU  69           HN       LEU  69  10.061   6.748  13.170
  560    HA   LEU  69           HA       LEU  69  11.785   8.778  14.232
  561    HB2  LEU  69           HB2      LEU  69   8.877   8.160  14.841
  562    HB3  LEU  69           HB1      LEU  69   9.744   9.495  15.553
  563    HG   LEU  69           HG       LEU  69   8.385  10.382  13.838
  564   HD11  LEU  69          HD11      LEU  69  10.547  11.391  13.974
  565   HD12  LEU  69          HD12      LEU  69   9.952  11.422  12.318
  566   HD13  LEU  69          HD13      LEU  69  11.188  10.253  12.786
  567   HD21  LEU  69          HD21      LEU  69   8.469   9.665  11.486
  568   HD22  LEU  69          HD22      LEU  69   7.925   8.361  12.540
  569   HD23  LEU  69          HD23      LEU  69   9.577   8.369  11.925
  570    H    GLU  70           HN       GLU  70  10.067   6.025  15.539
  571    HA   GLU  70           HA       GLU  70  11.961   6.086  17.681
  572    HB2  GLU  70           HB2      GLU  70  10.147   4.787  19.041
  573    HB3  GLU  70           HB1      GLU  70  10.094   6.535  18.936
  574    HG2  GLU  70           HG2      GLU  70   7.883   5.816  18.609
  575    HG3  GLU  70           HG1      GLU  70   8.656   6.284  17.071
  576    H    HIS  71           HN       HIS  71  12.706   3.920  18.389
  577    HA   HIS  71           HA       HIS  71  12.051   1.998  16.309
  578    HB2  HIS  71           HB2      HIS  71  14.737   2.466  17.544
  579    HB3  HIS  71           HB1      HIS  71  14.340   0.944  16.762
  580    HD1  HIS  71           HD1      HIS  71  16.588   2.547  15.601
  581    HD2  HIS  71           HD2      HIS  71  12.647   3.047  14.386
  582    HE1  HIS  71           HE1      HIS  71  16.697   3.505  13.273
  583    HE2  HIS  71           HE2      HIS  71  14.319   3.590  12.503
  584    H    HIS  72           HN       HIS  72  10.349   1.331  17.541
  585    HA   HIS  72           HA       HIS  72  11.161  -0.589  19.597
  586    HB2  HIS  72           HB2      HIS  72   8.387   0.278  18.704
  587    HB3  HIS  72           HB1      HIS  72   8.703  -0.940  19.938
  588    HD1  HIS  72           HD1      HIS  72   8.587   2.688  19.347
  589    HD2  HIS  72           HD2      HIS  72   9.707   0.121  22.402
  590    HE1  HIS  72           HE1      HIS  72   8.847   4.129  21.382
  591    HE2  HIS  72           HE2      HIS  72   9.986   2.611  22.982
  592    H    HIS  73           HN       HIS  73  10.359  -0.200  16.368
  593    HA   HIS  73           HA       HIS  73  10.380  -3.107  15.919
  594    HB2  HIS  73           HB2      HIS  73   9.660  -0.893  13.959
  595    HB3  HIS  73           HB1      HIS  73   9.608  -2.614  13.635
  596    HD1  HIS  73           HD1      HIS  73   7.609   0.188  14.761
  597    HD2  HIS  73           HD2      HIS  73   7.408  -3.946  15.036
  598    HE1  HIS  73           HE1      HIS  73   5.230  -0.332  15.264
  599    HE2  HIS  73           HE2      HIS  73   5.109  -2.823  15.011
  600    H    HIS  74           HN       HIS  74  12.675  -3.069  16.328
  601    HA   HIS  74           HA       HIS  74  14.254  -1.481  14.458
  602    HB2  HIS  74           HB2      HIS  74  15.084  -1.521  16.754
  603    HB3  HIS  74           HB1      HIS  74  15.170  -3.279  16.714
  604    HD1  HIS  74           HD1      HIS  74  17.401  -4.226  16.091
  605    HD2  HIS  74           HD2      HIS  74  16.944  -0.320  14.753
  606    HE1  HIS  74           HE1      HIS  74  19.554  -3.636  15.006
  607    HE2  HIS  74           HE2      HIS  74  19.124  -1.409  13.946
  608    H    HIS  75           HN       HIS  75  13.778  -4.834  15.347
  609    HA   HIS  75           HA       HIS  75  14.019  -6.769  14.301
  610    HB2  HIS  75           HB2      HIS  75  14.060  -5.138  11.750
  611    HB3  HIS  75           HB1      HIS  75  13.952  -6.894  11.812
  612    HD1  HIS  75           HD1      HIS  75  11.926  -3.955  11.622
  613    HD2  HIS  75           HD2      HIS  75  11.518  -7.721  13.286
  614    HE1  HIS  75           HE1      HIS  75   9.461  -4.274  11.967
  615    HE2  HIS  75           HE2      HIS  75   9.315  -6.416  13.269
  616    H    HIS  76           HN       HIS  76  16.026  -4.862  12.122
  617    HA   HIS  76           HA       HIS  76  18.506  -5.855  13.064
  618    HB2  HIS  76           HB2      HIS  76  17.715  -7.936  12.004
  619    HB3  HIS  76           HB1      HIS  76  17.314  -7.074  10.537
  620    HD1  HIS  76           HD1      HIS  76  19.205  -6.723   8.838
  621    HD2  HIS  76           HD2      HIS  76  20.512  -8.385  12.419
  622    HE1  HIS  76           HE1      HIS  76  21.536  -7.469   8.420
  623    HE2  HIS  76           HE2      HIS  76  22.390  -8.147  10.661
  Start of MODEL   16
    1    H1   GLU   1           HT1      GLU   1   2.670   2.672 -22.854
    2    H2   GLU   1           HT2      GLU   1   3.407   3.938 -23.668
    3    H3   GLU   1           HT3      GLU   1   1.876   3.378 -24.180
    4    HA   GLU   1           HA       GLU   1   1.694   5.436 -22.982
    5    HB2  GLU   1           HB2      GLU   1   0.648   3.005 -21.486
    6    HB3  GLU   1           HB1      GLU   1   0.131   4.645 -21.156
    7    HG2  GLU   1           HG2      GLU   1  -1.520   3.490 -22.495
    8    HG3  GLU   1           HG1      GLU   1  -0.785   4.790 -23.432
    9    H    ASP   2           HN       ASP   2   3.216   6.589 -21.950
   10    HA   ASP   2           HA       ASP   2   4.718   5.332 -19.827
   11    HB2  ASP   2           HB2      ASP   2   5.923   6.827 -21.375
   12    HB3  ASP   2           HB1      ASP   2   4.894   8.166 -20.884
   13    H    MET   3           HN       MET   3   3.014   4.935 -18.515
   14    HA   MET   3           HA       MET   3   2.665   6.861 -16.458
   15    HB2  MET   3           HB2      MET   3   0.901   7.571 -18.162
   16    HB3  MET   3           HB1      MET   3   0.153   5.993 -17.936
   17    HG2  MET   3           HG2      MET   3  -0.194   6.483 -15.588
   18    HG3  MET   3           HG1      MET   3   0.546   8.068 -15.779
   19    HE1  MET   3           HE1      MET   3  -3.516   6.795 -17.614
   20    HE2  MET   3           HE2      MET   3  -2.532   5.773 -16.567
   21    HE3  MET   3           HE3      MET   3  -1.978   6.158 -18.196
   22    H    GLU   4           HN       GLU   4   3.854   4.417 -16.625
   23    HA   GLU   4           HA       GLU   4   1.956   2.628 -15.281
   24    HB2  GLU   4           HB2      GLU   4   4.360   1.870 -16.932
   25    HB3  GLU   4           HB1      GLU   4   3.315   0.749 -16.067
   26    HG2  GLU   4           HG2      GLU   4   1.448   1.378 -17.440
   27    HG3  GLU   4           HG1      GLU   4   2.432   2.578 -18.270
   28    HA   PRO   5           HA       PRO   5   5.131   3.627 -12.166
   29    HB2  PRO   5           HB2      PRO   5   2.872   3.498 -10.297
   30    HB3  PRO   5           HB1      PRO   5   3.976   4.842 -10.612
   31    HG2  PRO   5           HG2      PRO   5   1.415   4.961 -11.391
   32    HG3  PRO   5           HG1      PRO   5   2.749   5.636 -12.355
   33    HD2  PRO   5           HD2      PRO   5   1.369   2.980 -12.721
   34    HD3  PRO   5           HD1      PRO   5   1.709   4.236 -13.930
   35    H    CYS   6           HN       CYS   6   6.247   1.935 -11.327
   36    HA   CYS   6           HA       CYS   6   4.919  -0.595 -11.116
   37    HB2  CYS   6           HB2      CYS   6   7.284  -1.279 -10.363
   38    HB3  CYS   6           HB1      CYS   6   6.970  -0.950 -12.084
   39    HG   CYS   6           HG       CYS   6   9.118   0.424 -12.133
   40    H    LEU   7           HN       LEU   7   7.367   0.468  -8.821
   41    HA   LEU   7           HA       LEU   7   7.485   0.578  -6.579
   42    HB2  LEU   7           HB2      LEU   7   4.500   1.040  -6.731
   43    HB3  LEU   7           HB1      LEU   7   5.435   1.204  -5.260
   44    HG   LEU   7           HG       LEU   7   5.039   3.372  -6.012
   45   HD11  LEU   7          HD11      LEU   7   7.207   4.296  -6.601
   46   HD12  LEU   7          HD12      LEU   7   7.777   2.669  -6.965
   47   HD13  LEU   7          HD13      LEU   7   7.306   3.087  -5.315
   48   HD21  LEU   7          HD21      LEU   7   5.573   4.136  -8.357
   49   HD22  LEU   7          HD22      LEU   7   4.209   3.041  -8.215
   50   HD23  LEU   7          HD23      LEU   7   5.764   2.426  -8.784
   51    H    THR   8           HN       THR   8   6.448  -1.942  -8.069
   52    HA   THR   8           HA       THR   8   4.899  -3.441  -6.275
   53    HB   THR   8           HB       THR   8   6.693  -4.530  -8.428
   54    HG1  THR   8           HG1      THR   8   4.366  -2.909  -8.578
   55   HG21  THR   8          HG21      THR   8   4.815  -6.100  -8.715
   56   HG22  THR   8          HG22      THR   8   3.929  -5.239  -7.453
   57   HG23  THR   8          HG23      THR   8   5.399  -6.125  -7.043
   58    H    GLY   9           HN       GLY   9   5.500  -4.866  -4.692
   59    HA2  GLY   9           HA2      GLY   9   7.043  -6.448  -3.791
   60    HA3  GLY   9           HA1      GLY   9   8.358  -5.420  -4.356
   61    H    THR  10           HN       THR  10   7.066  -2.998  -3.526
   62    HA   THR  10           HA       THR  10   8.256  -2.722  -0.997
   63    HB   THR  10           HB       THR  10   6.201  -0.859  -2.139
   64    HG1  THR  10           HG1      THR  10   7.421  -0.884  -3.870
   65   HG21  THR  10          HG21      THR  10   8.796  -0.407  -0.635
   66   HG22  THR  10          HG22      THR  10   7.179  -0.318   0.058
   67   HG23  THR  10          HG23      THR  10   7.675   0.854  -1.162
   68    H    LYS  11           HN       LYS  11   7.396  -3.137   0.966
   69    HA   LYS  11           HA       LYS  11   4.507  -3.380   1.168
   70    HB2  LYS  11           HB2      LYS  11   4.773  -4.697   3.124
   71    HB3  LYS  11           HB1      LYS  11   6.111  -5.208   2.129
   72    HG2  LYS  11           HG2      LYS  11   7.107  -5.051   4.209
   73    HG3  LYS  11           HG1      LYS  11   7.447  -3.446   3.556
   74    HD2  LYS  11           HD2      LYS  11   5.503  -2.533   4.750
   75    HD3  LYS  11           HD1      LYS  11   5.125  -4.131   5.380
   76    HE2  LYS  11           HE2      LYS  11   6.220  -2.850   7.097
   77    HE3  LYS  11           HE1      LYS  11   7.308  -4.125   6.563
   78    HZ1  LYS  11           HZ1      LYS  11   8.487  -2.043   6.818
   79    HZ2  LYS  11           HZ2      LYS  11   7.451  -1.259   5.771
   80    HZ3  LYS  11           HZ3      LYS  11   8.477  -2.473   5.189
   81    H    VAL  12           HN       VAL  12   3.376  -1.828   2.039
   82    HA   VAL  12           HA       VAL  12   4.803   0.285   3.505
   83    HB   VAL  12           HB       VAL  12   3.282   1.932   2.357
   84   HG11  VAL  12          HG11      VAL  12   4.552   2.021   0.269
   85   HG12  VAL  12          HG12      VAL  12   5.119   0.375   0.542
   86   HG13  VAL  12          HG13      VAL  12   5.606   1.668   1.639
   87   HG21  VAL  12          HG21      VAL  12   2.706  -0.421   0.551
   88   HG22  VAL  12          HG22      VAL  12   2.220   1.243   0.245
   89   HG23  VAL  12          HG23      VAL  12   1.555   0.374   1.628
   90    H    LYS  13           HN       LYS  13   3.007   1.794   4.429
   91    HA   LYS  13           HA       LYS  13   0.857   0.097   5.422
   92    HB2  LYS  13           HB2      LYS  13   2.004   2.630   6.608
   93    HB3  LYS  13           HB1      LYS  13   0.531   1.868   7.174
   94    HG2  LYS  13           HG2      LYS  13   1.790  -0.140   7.691
   95    HG3  LYS  13           HG1      LYS  13   3.304   0.686   7.262
   96    HD2  LYS  13           HD2      LYS  13   1.361   1.296   9.499
   97    HD3  LYS  13           HD1      LYS  13   3.042   0.781   9.643
   98    HE2  LYS  13           HE2      LYS  13   3.710   2.905   8.535
   99    HE3  LYS  13           HE1      LYS  13   2.008   3.357   8.555
  100    HZ1  LYS  13           HZ1      LYS  13   3.227   4.340  10.400
  101    HZ2  LYS  13           HZ2      LYS  13   3.597   2.801  11.005
  102    HZ3  LYS  13           HZ3      LYS  13   1.997   3.318  10.932
  103    H    VAL  14           HN       VAL  14  -1.137   0.793   5.264
  104    HA   VAL  14           HA       VAL  14  -1.530   3.050   3.475
  105    HB   VAL  14           HB       VAL  14  -2.894   0.349   3.452
  106   HG11  VAL  14          HG11      VAL  14  -4.507   2.148   3.020
  107   HG12  VAL  14          HG12      VAL  14  -4.196   1.135   1.615
  108   HG13  VAL  14          HG13      VAL  14  -3.469   2.747   1.713
  109   HG21  VAL  14          HG21      VAL  14  -0.716   0.358   2.361
  110   HG22  VAL  14          HG22      VAL  14  -1.208   1.726   1.363
  111   HG23  VAL  14          HG23      VAL  14  -2.010   0.169   1.179
  112    H    LYS  15           HN       LYS  15  -3.043   4.362   4.023
  113    HA   LYS  15           HA       LYS  15  -4.574   3.911   6.482
  114    HB2  LYS  15           HB2      LYS  15  -2.997   5.917   6.291
  115    HB3  LYS  15           HB1      LYS  15  -4.008   6.461   4.954
  116    HG2  LYS  15           HG2      LYS  15  -5.918   6.649   6.422
  117    HG3  LYS  15           HG1      LYS  15  -4.954   6.075   7.781
  118    HD2  LYS  15           HD2      LYS  15  -4.478   8.615   6.209
  119    HD3  LYS  15           HD1      LYS  15  -5.202   8.503   7.812
  120    HE2  LYS  15           HE2      LYS  15  -3.084   7.500   8.643
  121    HE3  LYS  15           HE1      LYS  15  -2.379   7.757   7.051
  122    HZ1  LYS  15           HZ1      LYS  15  -2.822  10.163   7.346
  123    HZ2  LYS  15           HZ2      LYS  15  -1.745   9.546   8.444
  124    HZ3  LYS  15           HZ3      LYS  15  -3.330   9.852   8.927
  125    H    TYR  16           HN       TYR  16  -6.403   2.988   5.688
  126    HA   TYR  16           HA       TYR  16  -7.648   4.365   3.437
  127    HB2  TYR  16           HB2      TYR  16  -6.738   2.092   2.821
  128    HB3  TYR  16           HB1      TYR  16  -7.810   1.392   4.021
  129    HD1  TYR  16           HD1      TYR  16  -7.756   3.322   0.848
  130    HD2  TYR  16           HD2      TYR  16 -10.046   0.892   3.478
  131    HE1  TYR  16           HE1      TYR  16  -9.533   3.147  -0.868
  132    HE2  TYR  16           HE2      TYR  16 -11.814   0.727   1.776
  133    HH   TYR  16           HH       TYR  16 -12.592   2.119  -0.086
  134    H    GLY  17           HN       GLY  17  -9.619   5.105   3.896
  135    HA2  GLY  17           HA2      GLY  17 -11.323   3.848   5.665
  136    HA3  GLY  17           HA1      GLY  17 -10.385   5.045   6.539
  137    H    ARG  18           HN       ARG  18 -13.056   4.933   6.199
  138    HA   ARG  18           HA       ARG  18 -13.523   7.463   4.869
  139    HB2  ARG  18           HB2      ARG  18 -15.853   6.567   4.383
  140    HB3  ARG  18           HB1      ARG  18 -14.559   5.828   3.453
  141    HG2  ARG  18           HG2      ARG  18 -14.616   3.893   5.043
  142    HG3  ARG  18           HG1      ARG  18 -15.985   4.653   5.841
  143    HD2  ARG  18           HD2      ARG  18 -15.888   3.830   2.944
  144    HD3  ARG  18           HD1      ARG  18 -16.697   2.942   4.239
  145    HE   ARG  18           HE       ARG  18 -17.802   5.380   4.388
  146   HH11  ARG  18          HH11      ARG  18 -17.380   3.140   1.678
  147   HH12  ARG  18          HH12      ARG  18 -18.747   3.678   0.832
  148   HH21  ARG  18          HH21      ARG  18 -19.716   6.092   3.245
  149   HH22  ARG  18          HH22      ARG  18 -20.148   5.341   1.782
  150    H    GLY  19           HN       GLY  19 -13.559   8.752   6.559
  151    HA2  GLY  19           HA2      GLY  19 -14.211   9.790   8.462
  152    HA3  GLY  19           HA1      GLY  19 -15.716   8.914   8.290
  153    H    LYS  20           HN       LYS  20 -16.188   7.393   9.705
  154    HA   LYS  20           HA       LYS  20 -14.514   7.104  12.029
  155    HB2  LYS  20           HB2      LYS  20 -16.983   7.475  12.137
  156    HB3  LYS  20           HB1      LYS  20 -17.218   5.885  11.432
  157    HG2  LYS  20           HG2      LYS  20 -16.132   4.870  13.376
  158    HG3  LYS  20           HG1      LYS  20 -15.911   6.471  14.079
  159    HD2  LYS  20           HD2      LYS  20 -18.350   6.790  14.082
  160    HD3  LYS  20           HD1      LYS  20 -18.552   5.164  13.426
  161    HE2  LYS  20           HE2      LYS  20 -17.405   4.257  15.408
  162    HE3  LYS  20           HE1      LYS  20 -17.277   5.888  16.049
  163    HZ1  LYS  20           HZ1      LYS  20 -19.124   4.688  17.005
  164    HZ2  LYS  20           HZ2      LYS  20 -19.824   4.458  15.509
  165    HZ3  LYS  20           HZ3      LYS  20 -19.669   6.027  16.150
  166    H    THR  21           HN       THR  21 -15.121   5.337   9.168
  167    HA   THR  21           HA       THR  21 -14.036   2.879  10.320
  168    HB   THR  21           HB       THR  21 -15.177   3.413   7.559
  169    HG1  THR  21           HG1      THR  21 -16.340   2.215   9.859
  170   HG21  THR  21          HG21      THR  21 -14.564   0.796   8.970
  171   HG22  THR  21          HG22      THR  21 -13.666   1.487   7.613
  172   HG23  THR  21          HG23      THR  21 -15.330   0.968   7.386
  173    H    GLN  22           HN       GLN  22 -11.878   3.647  10.532
  174    HA   GLN  22           HA       GLN  22 -10.388   3.882   8.046
  175    HB2  GLN  22           HB2      GLN  22 -11.151   6.197   8.727
  176    HB3  GLN  22           HB1      GLN  22 -10.281   5.983  10.224
  177    HG2  GLN  22           HG2      GLN  22  -8.935   5.991   7.521
  178    HG3  GLN  22           HG1      GLN  22  -9.188   7.442   8.484
  179   HE21  GLN  22          HE21      GLN  22  -7.337   4.583   8.022
  180   HE22  GLN  22          HE22      GLN  22  -6.156   4.920   9.233
  181    H    LYS  23           HN       LYS  23  -8.809   2.470   8.238
  182    HA   LYS  23           HA       LYS  23  -7.451   2.184  10.838
  183    HB2  LYS  23           HB2      LYS  23  -8.069  -0.068   8.910
  184    HB3  LYS  23           HB1      LYS  23  -7.177  -0.220  10.408
  185    HG2  LYS  23           HG2      LYS  23 -10.103   0.465  10.124
  186    HG3  LYS  23           HG1      LYS  23  -9.441  -1.094  10.604
  187    HD2  LYS  23           HD2      LYS  23  -9.158   1.503  12.124
  188    HD3  LYS  23           HD1      LYS  23 -10.267   0.196  12.515
  189    HE2  LYS  23           HE2      LYS  23  -8.405  -1.303  12.942
  190    HE3  LYS  23           HE1      LYS  23  -7.262  -0.059  12.465
  191    HZ1  LYS  23           HZ1      LYS  23  -8.018   1.301  14.322
  192    HZ2  LYS  23           HZ2      LYS  23  -7.450  -0.173  14.874
  193    HZ3  LYS  23           HZ3      LYS  23  -9.111   0.114  14.789
  194    H    ILE  24           HN       ILE  24  -5.214   1.429  10.616
  195    HA   ILE  24           HA       ILE  24  -4.095   2.056   7.990
  196    HB   ILE  24           HB       ILE  24  -2.677   2.131  10.701
  197   HG12  ILE  24          HG12      ILE  24  -2.264   4.593  10.067
  198   HG13  ILE  24          HG11      ILE  24  -3.480   4.377   8.824
  199   HG21  ILE  24          HG21      ILE  24  -1.148   1.323   8.980
  200   HG22  ILE  24          HG22      ILE  24  -0.691   2.950   9.467
  201   HG23  ILE  24          HG23      ILE  24  -1.554   2.695   7.956
  202   HD11  ILE  24          HD11      ILE  24  -3.905   4.117  11.798
  203   HD12  ILE  24          HD12      ILE  24  -5.138   3.863  10.569
  204   HD13  ILE  24          HD13      ILE  24  -4.425   5.462  10.781
  205    H    TYR  25           HN       TYR  25  -3.534   0.376   6.930
  206    HA   TYR  25           HA       TYR  25  -3.025  -2.160   8.369
  207    HB2  TYR  25           HB2      TYR  25  -3.815  -1.895   5.477
  208    HB3  TYR  25           HB1      TYR  25  -3.885  -3.319   6.489
  209    HD1  TYR  25           HD1      TYR  25  -5.810  -3.545   8.137
  210    HD2  TYR  25           HD2      TYR  25  -5.604  -0.367   5.307
  211    HE1  TYR  25           HE1      TYR  25  -8.231  -3.167   8.377
  212    HE2  TYR  25           HE2      TYR  25  -8.015   0.024   5.560
  213    HH   TYR  25           HH       TYR  25  -9.910  -1.409   8.010
  214    H    GLU  26           HN       GLU  26  -1.310  -3.502   7.231
  215    HA   GLU  26           HA       GLU  26   0.524  -1.867   5.689
  216    HB2  GLU  26           HB2      GLU  26   0.950  -4.651   6.785
  217    HB3  GLU  26           HB1      GLU  26   2.161  -3.567   6.138
  218    HG2  GLU  26           HG2      GLU  26   2.527  -3.410   8.424
  219    HG3  GLU  26           HG1      GLU  26   1.468  -2.044   8.047
  220    H    ALA  27           HN       ALA  27   0.866  -2.314   3.611
  221    HA   ALA  27           HA       ALA  27  -0.414  -4.674   2.451
  222    HB1  ALA  27           HB1      ALA  27  -1.968  -2.774   2.253
  223    HB2  ALA  27           HB2      ALA  27  -1.396  -3.366   0.700
  224    HB3  ALA  27           HB3      ALA  27  -0.722  -1.881   1.377
  225    H    SER  28           HN       SER  28   0.321  -5.103   0.309
  226    HA   SER  28           HA       SER  28   3.009  -4.043  -0.205
  227    HB2  SER  28           HB2      SER  28   1.913  -6.744  -1.019
  228    HB3  SER  28           HB1      SER  28   3.596  -6.185  -1.036
  229    HG   SER  28           HG       SER  28   2.618  -5.803   1.369
  230    H    ILE  29           HN       ILE  29   3.407  -3.309  -2.254
  231    HA   ILE  29           HA       ILE  29   1.106  -2.446  -3.744
  232    HB   ILE  29           HB       ILE  29   4.012  -2.127  -4.481
  233   HG12  ILE  29          HG12      ILE  29   3.660  -1.172  -2.257
  234   HG13  ILE  29          HG11      ILE  29   3.902   0.110  -3.431
  235   HG21  ILE  29          HG21      ILE  29   2.567  -1.709  -6.337
  236   HG22  ILE  29          HG22      ILE  29   3.208  -0.162  -5.754
  237   HG23  ILE  29          HG23      ILE  29   1.552  -0.631  -5.373
  238   HD11  ILE  29          HD11      ILE  29   2.182   0.739  -1.892
  239   HD12  ILE  29          HD12      ILE  29   1.316  -0.761  -2.179
  240   HD13  ILE  29          HD13      ILE  29   1.441   0.446  -3.469
  241    H    LYS  30           HN       LYS  30   0.258  -3.299  -5.515
  242    HA   LYS  30           HA       LYS  30   1.583  -5.549  -6.830
  243    HB2  LYS  30           HB2      LYS  30  -0.770  -5.829  -6.044
  244    HB3  LYS  30           HB1      LYS  30  -1.256  -4.512  -7.081
  245    HG2  LYS  30           HG2      LYS  30  -1.861  -6.472  -8.241
  246    HG3  LYS  30           HG1      LYS  30  -0.404  -5.883  -9.042
  247    HD2  LYS  30           HD2      LYS  30  -0.156  -8.241  -8.801
  248    HD3  LYS  30           HD1      LYS  30   0.897  -7.504  -7.595
  249    HE2  LYS  30           HE2      LYS  30  -0.263  -9.314  -6.509
  250    HE3  LYS  30           HE1      LYS  30  -0.963  -7.795  -5.938
  251    HZ1  LYS  30           HZ1      LYS  30  -2.168  -9.647  -7.925
  252    HZ2  LYS  30           HZ2      LYS  30  -2.722  -8.109  -7.625
  253    HZ3  LYS  30           HZ3      LYS  30  -2.765  -9.228  -6.391
  254    H    SER  31           HN       SER  31  -0.348  -2.641  -7.775
  255    HA   SER  31           HA       SER  31   1.490  -1.958  -9.869
  256    HB2  SER  31           HB2      SER  31  -1.335  -2.845 -10.574
  257    HB3  SER  31           HB1      SER  31  -0.148  -2.172 -11.691
  258    HG   SER  31           HG       SER  31   1.078  -4.112 -10.529
  259    H    THR  32           HN       THR  32   0.153  -0.017 -11.246
  260    HA   THR  32           HA       THR  32  -1.384   1.567  -9.319
  261    HB   THR  32           HB       THR  32   0.789   2.982 -10.742
  262    HG1  THR  32           HG1      THR  32   2.094   1.402  -9.809
  263   HG21  THR  32          HG21      THR  32   0.868   4.233  -8.686
  264   HG22  THR  32          HG22      THR  32  -0.365   3.181  -7.995
  265   HG23  THR  32          HG23      THR  32  -0.752   4.203  -9.394
  266    H    GLU  33           HN       GLU  33  -2.723   3.055 -10.356
  267    HA   GLU  33           HA       GLU  33  -2.422   3.560 -13.225
  268    HB2  GLU  33           HB2      GLU  33  -4.904   2.484 -11.943
  269    HB3  GLU  33           HB1      GLU  33  -4.971   3.466 -13.386
  270    HG2  GLU  33           HG2      GLU  33  -3.436   1.797 -14.435
  271    HG3  GLU  33           HG1      GLU  33  -3.764   0.755 -13.035
  272    H    ILE  34           HN       ILE  34  -3.539   5.402 -13.931
  273    HA   ILE  34           HA       ILE  34  -4.368   7.163 -11.762
  274    HB   ILE  34           HB       ILE  34  -3.153   7.869 -14.444
  275   HG12  ILE  34          HG12      ILE  34  -1.526   9.245 -13.067
  276   HG13  ILE  34          HG11      ILE  34  -2.255   8.540 -11.636
  277   HG21  ILE  34          HG21      ILE  34  -4.984   9.404 -14.126
  278   HG22  ILE  34          HG22      ILE  34  -3.460  10.269 -13.915
  279   HG23  ILE  34          HG23      ILE  34  -4.410   9.802 -12.505
  280   HD11  ILE  34          HD11      ILE  34  -0.161   7.463 -12.183
  281   HD12  ILE  34          HD12      ILE  34  -0.775   7.051 -13.788
  282   HD13  ILE  34          HD13      ILE  34  -1.512   6.342 -12.348
  283    H    ASP  35           HN       ASP  35  -6.415   7.892 -11.919
  284    HA   ASP  35           HA       ASP  35  -7.922   7.640 -14.420
  285    HB2  ASP  35           HB2      ASP  35  -8.354   5.523 -13.195
  286    HB3  ASP  35           HB1      ASP  35  -8.853   6.454 -11.787
  287    H    ASP  36           HN       ASP  36  -8.978   9.460 -14.720
  288    HA   ASP  36           HA       ASP  36 -10.006  11.461 -14.458
  289    HB2  ASP  36           HB2      ASP  36 -11.650   9.958 -13.244
  290    HB3  ASP  36           HB1      ASP  36 -10.875  10.421 -11.740
  291    H    GLY  37           HN       GLY  37  -7.273  11.024 -13.357
  292    HA2  GLY  37           HA2      GLY  37  -5.797  12.834 -12.830
  293    HA3  GLY  37           HA1      GLY  37  -7.116  13.604 -11.963
  294    H    GLU  38           HN       GLU  38  -7.365  10.547 -10.874
  295    HA   GLU  38           HA       GLU  38  -5.516  11.101  -8.638
  296    HB2  GLU  38           HB2      GLU  38  -7.019   9.784  -7.224
  297    HB3  GLU  38           HB1      GLU  38  -7.934  11.062  -7.999
  298    HG2  GLU  38           HG2      GLU  38  -8.699   9.329  -9.693
  299    HG3  GLU  38           HG1      GLU  38  -7.931   8.123  -8.670
  300    H    VAL  39           HN       VAL  39  -4.321   9.408  -7.783
  301    HA   VAL  39           HA       VAL  39  -4.005   7.286  -9.692
  302    HB   VAL  39           HB       VAL  39  -2.062   8.768  -9.694
  303   HG11  VAL  39          HG11      VAL  39  -2.186   9.688  -7.547
  304   HG12  VAL  39          HG12      VAL  39  -0.583   8.953  -7.750
  305   HG13  VAL  39          HG13      VAL  39  -1.836   8.135  -6.797
  306   HG21  VAL  39          HG21      VAL  39  -1.694   6.383 -10.162
  307   HG22  VAL  39          HG22      VAL  39  -1.427   6.059  -8.467
  308   HG23  VAL  39          HG23      VAL  39  -0.285   7.051  -9.362
  309    H    LEU  40           HN       LEU  40  -4.301   5.475  -9.240
  310    HA   LEU  40           HA       LEU  40  -4.910   4.813  -6.486
  311    HB2  LEU  40           HB2      LEU  40  -5.918   3.532  -9.016
  312    HB3  LEU  40           HB1      LEU  40  -6.431   3.159  -7.372
  313    HG   LEU  40           HG       LEU  40  -8.228   4.434  -8.206
  314   HD11  LEU  40          HD11      LEU  40  -8.256   6.475  -7.074
  315   HD12  LEU  40          HD12      LEU  40  -6.487   6.426  -6.947
  316   HD13  LEU  40          HD13      LEU  40  -7.448   5.226  -6.111
  317   HD21  LEU  40          HD21      LEU  40  -7.052   5.023 -10.313
  318   HD22  LEU  40          HD22      LEU  40  -6.310   6.380  -9.451
  319   HD23  LEU  40          HD23      LEU  40  -8.074   6.283  -9.636
  320    H    TYR  41           HN       TYR  41  -3.869   3.290  -5.669
  321    HA   TYR  41           HA       TYR  41  -1.905   1.786  -7.233
  322    HB2  TYR  41           HB2      TYR  41  -2.032   2.532  -4.310
  323    HB3  TYR  41           HB1      TYR  41  -0.889   1.367  -4.956
  324    HD1  TYR  41           HD2      TYR  41  -1.970   4.941  -5.439
  325    HD2  TYR  41           HD1      TYR  41   1.207   2.105  -5.587
  326    HE1  TYR  41           HE2      TYR  41  -0.384   6.742  -5.904
  327    HE2  TYR  41           HE1      TYR  41   2.799   3.919  -6.055
  328    HH   TYR  41           HH       TYR  41   1.981   7.234  -5.739
  329    H    LEU  42           HN       LEU  42  -1.866  -0.374  -6.909
  330    HA   LEU  42           HA       LEU  42  -4.341  -1.488  -5.797
  331    HB2  LEU  42           HB2      LEU  42  -3.355  -1.710  -8.285
  332    HB3  LEU  42           HB1      LEU  42  -2.416  -2.975  -7.542
  333    HG   LEU  42           HG       LEU  42  -5.381  -2.823  -7.921
  334   HD11  LEU  42          HD11      LEU  42  -5.067  -4.913  -9.103
  335   HD12  LEU  42          HD12      LEU  42  -3.336  -4.828  -8.791
  336   HD13  LEU  42          HD13      LEU  42  -4.109  -3.609  -9.807
  337   HD21  LEU  42          HD21      LEU  42  -4.995  -3.660  -5.663
  338   HD22  LEU  42          HD22      LEU  42  -3.891  -4.882  -6.321
  339   HD23  LEU  42          HD23      LEU  42  -5.620  -4.875  -6.771
  340    H    VAL  43           HN       VAL  43  -3.927  -2.236  -3.798
  341    HA   VAL  43           HA       VAL  43  -1.236  -3.294  -3.137
  342    HB   VAL  43           HB       VAL  43  -1.319  -2.181  -1.008
  343   HG11  VAL  43          HG11      VAL  43  -1.268   0.151  -1.590
  344   HG12  VAL  43          HG12      VAL  43  -2.163  -0.188  -3.066
  345   HG13  VAL  43          HG13      VAL  43  -0.538  -0.825  -2.873
  346   HG21  VAL  43          HG21      VAL  43  -3.718  -2.397  -0.521
  347   HG22  VAL  43          HG22      VAL  43  -4.082  -1.190  -1.752
  348   HG23  VAL  43          HG23      VAL  43  -3.191  -0.726  -0.307
  349    H    HIS  44           HN       HIS  44  -1.271  -4.998  -1.650
  350    HA   HIS  44           HA       HIS  44  -3.932  -5.753  -0.749
  351    HB2  HIS  44           HB2      HIS  44  -3.433  -8.203  -0.876
  352    HB3  HIS  44           HB1      HIS  44  -3.556  -7.417  -2.430
  353    HD1  HIS  44           HD1      HIS  44  -2.126  -8.595  -3.889
  354    HD2  HIS  44           HD2      HIS  44  -0.305  -8.120  -0.211
  355    HE1  HIS  44           HE1      HIS  44   0.136  -9.719  -4.097
  356    HE2  HIS  44           HE2      HIS  44   1.025  -9.687  -1.761
  357    H    TYR  45           HN       TYR  45  -4.247  -6.355   1.232
  358    HA   TYR  45           HA       TYR  45  -2.111  -5.615   3.042
  359    HB2  TYR  45           HB2      TYR  45  -4.919  -6.505   3.708
  360    HB3  TYR  45           HB1      TYR  45  -3.813  -5.555   4.701
  361    HD1  TYR  45           HD1      TYR  45  -3.183  -3.232   3.829
  362    HD2  TYR  45           HD2      TYR  45  -6.498  -5.436   2.361
  363    HE1  TYR  45           HE1      TYR  45  -4.171  -1.156   2.960
  364    HE2  TYR  45           HE2      TYR  45  -7.502  -3.368   1.494
  365    HH   TYR  45           HH       TYR  45  -7.381  -0.951   1.902
  366    H    TYR  46           HN       TYR  46  -0.704  -7.219   3.355
  367    HA   TYR  46           HA       TYR  46  -1.309  -9.880   2.792
  368    HB2  TYR  46           HB2      TYR  46   0.970 -10.434   3.698
  369    HB3  TYR  46           HB1      TYR  46   0.932  -9.226   2.430
  370    HD1  TYR  46           HD2      TYR  46   1.323  -6.831   3.011
  371    HD2  TYR  46           HD1      TYR  46   1.833  -9.939   5.863
  372    HE1  TYR  46           HE2      TYR  46   2.656  -5.318   4.408
  373    HE2  TYR  46           HE1      TYR  46   3.173  -8.429   7.273
  374    HH   TYR  46           HH       TYR  46   3.231  -5.124   6.839
  375    H    GLY  47           HN       GLY  47  -1.256  -8.293   5.953
  376    HA2  GLY  47           HA2      GLY  47  -2.016 -10.899   7.068
  377    HA3  GLY  47           HA1      GLY  47  -1.354  -9.563   7.992
  378    H    TRP  48           HN       TRP  48  -3.757  -8.864   5.635
  379    HA   TRP  48           HA       TRP  48  -5.800  -8.709   7.759
  380    HB2  TRP  48           HB2      TRP  48  -5.263  -6.470   5.786
  381    HB3  TRP  48           HB1      TRP  48  -6.561  -6.511   6.961
  382    HD1  TRP  48           HD1      TRP  48  -2.782  -5.986   6.707
  383    HE1  TRP  48           HE1      TRP  48  -1.945  -4.894   8.875
  384    HE3  TRP  48           HE3      TRP  48  -7.096  -6.235   9.437
  385    HZ2  TRP  48           HZ2      TRP  48  -2.989  -4.209  11.409
  386    HZ3  TRP  48           HZ3      TRP  48  -7.096  -5.333  11.720
  387    HH2  TRP  48           HH2      TRP  48  -5.084  -4.342  12.689
  388    H    ASN  49           HN       ASN  49  -5.306  -8.257   4.268
  389    HA   ASN  49           HA       ASN  49  -7.380 -10.103   3.605
  390    HB2  ASN  49           HB2      ASN  49  -8.745  -8.080   4.064
  391    HB3  ASN  49           HB1      ASN  49  -7.765  -7.161   2.931
  392   HD21  ASN  49          HD21      ASN  49  -9.613  -6.667   1.710
  393   HD22  ASN  49          HD22      ASN  49 -10.385  -7.829   0.703
  394    H    VAL  50           HN       VAL  50  -5.816 -11.118   2.502
  395    HA   VAL  50           HA       VAL  50  -4.183  -9.621   0.660
  396    HB   VAL  50           HB       VAL  50  -3.072 -11.212   2.128
  397   HG11  VAL  50          HG11      VAL  50  -4.619 -13.362   0.713
  398   HG12  VAL  50          HG12      VAL  50  -4.784 -12.879   2.400
  399   HG13  VAL  50          HG13      VAL  50  -3.290 -13.632   1.840
  400   HG21  VAL  50          HG21      VAL  50  -2.001 -10.725   0.004
  401   HG22  VAL  50          HG22      VAL  50  -2.908 -12.019  -0.775
  402   HG23  VAL  50          HG23      VAL  50  -1.706 -12.405   0.457
  403    H    ARG  51           HN       ARG  51  -6.789 -11.956   0.480
  404    HA   ARG  51           HA       ARG  51  -6.218 -12.652  -2.239
  405    HB2  ARG  51           HB2      ARG  51  -8.440 -13.422  -0.408
  406    HB3  ARG  51           HB1      ARG  51  -8.472 -13.842  -2.109
  407    HG2  ARG  51           HG2      ARG  51  -6.257 -14.973  -1.769
  408    HG3  ARG  51           HG1      ARG  51  -6.466 -14.701  -0.037
  409    HD2  ARG  51           HD2      ARG  51  -7.220 -16.946  -0.775
  410    HD3  ARG  51           HD1      ARG  51  -8.504 -15.990  -0.032
  411    HE   ARG  51           HE       ARG  51  -8.542 -15.539  -2.789
  412   HH11  ARG  51          HH11      ARG  51  -9.144 -18.268  -0.614
  413   HH12  ARG  51          HH12      ARG  51 -10.403 -18.917  -1.541
  414   HH21  ARG  51          HH21      ARG  51 -10.328 -16.420  -4.057
  415   HH22  ARG  51          HH22      ARG  51 -11.086 -17.853  -3.559
  416    H    TYR  52           HN       TYR  52  -7.570  -9.902  -1.192
  417    HA   TYR  52           HA       TYR  52  -9.400  -9.924  -3.440
  418    HB2  TYR  52           HB2      TYR  52  -9.431  -8.279  -0.974
  419    HB3  TYR  52           HB1      TYR  52 -10.182  -7.641  -2.441
  420    HD1  TYR  52           HD2      TYR  52 -10.254 -10.432  -0.022
  421    HD2  TYR  52           HD1      TYR  52 -12.209  -8.504  -3.254
  422    HE1  TYR  52           HE2      TYR  52 -12.227 -11.819   0.358
  423    HE2  TYR  52           HE1      TYR  52 -14.187  -9.882  -2.898
  424    HH   TYR  52           HH       TYR  52 -14.671 -11.763  -0.103
  425    H    ASP  53           HN       ASP  53  -6.701  -8.086  -2.228
  426    HA   ASP  53           HA       ASP  53  -5.373  -6.515  -3.147
  427    HB2  ASP  53           HB2      ASP  53  -6.392  -7.672  -5.788
  428    HB3  ASP  53           HB1      ASP  53  -5.130  -6.462  -5.673
  429    H    GLU  54           HN       GLU  54  -5.879  -4.461  -2.796
  430    HA   GLU  54           HA       GLU  54  -8.470  -3.513  -3.811
  431    HB2  GLU  54           HB2      GLU  54  -8.505  -4.106  -1.396
  432    HB3  GLU  54           HB1      GLU  54  -7.188  -2.984  -1.117
  433    HG2  GLU  54           HG2      GLU  54  -9.315  -2.051  -0.415
  434    HG3  GLU  54           HG1      GLU  54  -8.627  -1.125  -1.746
  435    H    TRP  55           HN       TRP  55  -8.649  -1.284  -4.107
  436    HA   TRP  55           HA       TRP  55  -6.119  -0.102  -4.994
  437    HB2  TRP  55           HB2      TRP  55  -8.953   0.573  -5.730
  438    HB3  TRP  55           HB1      TRP  55  -7.528   1.376  -6.359
  439    HD1  TRP  55           HD1      TRP  55  -9.184  -2.132  -6.423
  440    HE1  TRP  55           HE1      TRP  55  -8.543  -3.265  -8.649
  441    HE3  TRP  55           HE3      TRP  55  -5.903   1.357  -8.217
  442    HZ2  TRP  55           HZ2      TRP  55  -6.861  -2.761 -10.850
  443    HZ3  TRP  55           HZ3      TRP  55  -4.816   0.948 -10.377
  444    HH2  TRP  55           HH2      TRP  55  -5.285  -1.064 -11.665
  445    H    VAL  56           HN       VAL  56  -5.321   1.546  -3.990
  446    HA   VAL  56           HA       VAL  56  -7.037   3.257  -2.339
  447    HB   VAL  56           HB       VAL  56  -5.343   3.393  -0.595
  448   HG11  VAL  56          HG11      VAL  56  -5.476   1.095   0.298
  449   HG12  VAL  56          HG12      VAL  56  -5.951   0.527  -1.294
  450   HG13  VAL  56          HG13      VAL  56  -7.002   1.625  -0.405
  451   HG21  VAL  56          HG21      VAL  56  -3.315   1.973  -0.618
  452   HG22  VAL  56          HG22      VAL  56  -3.329   3.104  -1.963
  453   HG23  VAL  56          HG23      VAL  56  -3.738   1.410  -2.233
  454    H    LYS  57           HN       LYS  57  -5.813   5.393  -1.882
  455    HA   LYS  57           HA       LYS  57  -4.583   6.086  -4.444
  456    HB2  LYS  57           HB2      LYS  57  -5.809   7.934  -2.393
  457    HB3  LYS  57           HB1      LYS  57  -5.155   8.388  -3.965
  458    HG2  LYS  57           HG2      LYS  57  -6.727   7.132  -5.098
  459    HG3  LYS  57           HG1      LYS  57  -7.393   6.460  -3.586
  460    HD2  LYS  57           HD2      LYS  57  -7.893   8.891  -2.982
  461    HD3  LYS  57           HD1      LYS  57  -7.560   9.254  -4.681
  462    HE2  LYS  57           HE2      LYS  57  -9.254   7.570  -5.317
  463    HE3  LYS  57           HE1      LYS  57  -9.651   7.367  -3.613
  464    HZ1  LYS  57           HZ1      LYS  57 -10.180   9.831  -3.635
  465    HZ2  LYS  57           HZ2      LYS  57 -11.194   8.806  -4.510
  466    HZ3  LYS  57           HZ3      LYS  57 -10.050   9.721  -5.335
  467    H    ALA  58           HN       ALA  58  -3.076   7.989  -4.270
  468    HA   ALA  58           HA       ALA  58  -0.705   7.092  -3.116
  469    HB1  ALA  58           HB1      ALA  58  -0.864   8.469  -5.064
  470    HB2  ALA  58           HB2      ALA  58   0.187   9.231  -3.857
  471    HB3  ALA  58           HB3      ALA  58  -1.467   9.812  -4.109
  472    H    ASP  59           HN       ASP  59  -2.928   9.620  -2.117
  473    HA   ASP  59           HA       ASP  59  -1.534  10.637   0.114
  474    HB2  ASP  59           HB2      ASP  59  -3.406  11.878  -0.721
  475    HB3  ASP  59           HB1      ASP  59  -4.494  10.512  -0.494
  476    H    ARG  60           HN       ARG  60  -3.255   7.737  -0.327
  477    HA   ARG  60           HA       ARG  60  -3.858   7.360   2.487
  478    HB2  ARG  60           HB2      ARG  60  -4.324   5.418   0.228
  479    HB3  ARG  60           HB1      ARG  60  -5.111   5.439   1.801
  480    HG2  ARG  60           HG2      ARG  60  -5.484   7.335  -0.499
  481    HG3  ARG  60           HG1      ARG  60  -6.672   6.238   0.202
  482    HD2  ARG  60           HD2      ARG  60  -5.399   8.486   1.711
  483    HD3  ARG  60           HD1      ARG  60  -6.908   8.682   0.781
  484    HE   ARG  60           HE       ARG  60  -7.443   6.666   2.433
  485   HH11  ARG  60          HH11      ARG  60  -5.840   9.784   3.054
  486   HH12  ARG  60          HH12      ARG  60  -6.523   9.988   4.594
  487   HH21  ARG  60          HH21      ARG  60  -8.425   6.982   4.552
  488   HH22  ARG  60          HH22      ARG  60  -8.023   8.356   5.482
  489    H    ILE  61           HN       ILE  61  -1.131   6.999   0.696
  490    HA   ILE  61           HA       ILE  61  -0.467   4.484   2.039
  491    HB   ILE  61           HB       ILE  61   0.774   5.648  -0.472
  492   HG12  ILE  61          HG12      ILE  61  -1.137   3.340  -0.109
  493   HG13  ILE  61          HG11      ILE  61  -1.547   4.912  -0.783
  494   HG21  ILE  61          HG21      ILE  61   2.315   4.239   0.843
  495   HG22  ILE  61          HG22      ILE  61   1.839   3.453  -0.669
  496   HG23  ILE  61          HG23      ILE  61   1.092   2.964   0.853
  497   HD11  ILE  61          HD11      ILE  61  -1.250   3.236  -2.483
  498   HD12  ILE  61          HD12      ILE  61   0.406   2.954  -1.936
  499   HD13  ILE  61          HD13      ILE  61  -0.049   4.518  -2.633
  500    H    ILE  62           HN       ILE  62   1.360   4.338   3.212
  501    HA   ILE  62           HA       ILE  62   2.848   6.814   3.727
  502    HB   ILE  62           HB       ILE  62   2.615   4.280   5.403
  503   HG12  ILE  62          HG12      ILE  62   1.666   5.823   7.180
  504   HG13  ILE  62          HG11      ILE  62   1.523   7.067   5.941
  505   HG21  ILE  62          HG21      ILE  62   4.195   6.768   6.004
  506   HG22  ILE  62          HG22      ILE  62   4.835   5.184   5.581
  507   HG23  ILE  62          HG23      ILE  62   3.971   5.405   7.108
  508   HD11  ILE  62          HD11      ILE  62   0.098   4.409   6.025
  509   HD12  ILE  62          HD12      ILE  62  -0.060   5.604   4.740
  510   HD13  ILE  62          HD13      ILE  62  -0.605   5.988   6.375
  511    H    TRP  63           HN       TRP  63   4.613   6.826   2.494
  512    HA   TRP  63           HA       TRP  63   5.817   4.334   1.653
  513    HB2  TRP  63           HB2      TRP  63   6.370   7.202   0.853
  514    HB3  TRP  63           HB1      TRP  63   7.209   5.806   0.183
  515    HD1  TRP  63           HD1      TRP  63   4.059   7.802  -0.112
  516    HE1  TRP  63           HE1      TRP  63   2.589   6.855  -1.967
  517    HE3  TRP  63           HE3      TRP  63   6.605   3.468  -0.958
  518    HZ2  TRP  63           HZ2      TRP  63   2.518   4.522  -3.601
  519    HZ3  TRP  63           HZ3      TRP  63   5.775   1.923  -2.681
  520    HH2  TRP  63           HH2      TRP  63   3.776   2.439  -3.975
  521    HA   PRO  64           HA       PRO  64   9.244   4.533   4.452
  522    HB2  PRO  64           HB2      PRO  64  11.138   4.003   2.253
  523    HB3  PRO  64           HB1      PRO  64  10.791   3.025   3.680
  524    HG2  PRO  64           HG2      PRO  64   9.979   2.259   1.246
  525    HG3  PRO  64           HG1      PRO  64   8.995   1.974   2.692
  526    HD2  PRO  64           HD2      PRO  64   8.704   4.097   0.601
  527    HD3  PRO  64           HD1      PRO  64   7.452   3.112   1.394
  528    H    LEU  65           HN       LEU  65   9.900   6.280   5.224
  529    HA   LEU  65           HA       LEU  65  11.642   8.176   3.912
  530    HB2  LEU  65           HB2      LEU  65   9.129   8.803   3.508
  531    HB3  LEU  65           HB1      LEU  65   8.994   8.910   5.238
  532    HG   LEU  65           HG       LEU  65   9.160  11.083   3.951
  533   HD11  LEU  65          HD11      LEU  65  11.140  10.603   6.160
  534   HD12  LEU  65          HD12      LEU  65   9.459  11.109   6.307
  535   HD13  LEU  65          HD13      LEU  65  10.640  12.188   5.567
  536   HD21  LEU  65          HD21      LEU  65  10.878  10.430   2.376
  537   HD22  LEU  65          HD22      LEU  65  12.043  10.255   3.688
  538   HD23  LEU  65          HD23      LEU  65  11.385  11.847   3.298
  539    H    ASP  66           HN       ASP  66  12.575   9.456   5.732
  540    HA   ASP  66           HA       ASP  66  13.016   7.497   7.698
  541    HB2  ASP  66           HB2      ASP  66  14.868   8.741   6.871
  542    HB3  ASP  66           HB1      ASP  66  14.215  10.235   7.525
  543    H    LYS  67           HN       LYS  67  11.331   7.154   8.709
  544    HA   LYS  67           HA       LYS  67  10.336   9.054  10.658
  545    HB2  LYS  67           HB2      LYS  67   8.658   7.418  11.272
  546    HB3  LYS  67           HB1      LYS  67   8.752   7.433   9.528
  547    HG2  LYS  67           HG2      LYS  67  10.045   5.381  11.308
  548    HG3  LYS  67           HG1      LYS  67   8.476   5.167  10.527
  549    HD2  LYS  67           HD2      LYS  67   9.675   5.447   8.320
  550    HD3  LYS  67           HD1      LYS  67  11.170   5.480   9.258
  551    HE2  LYS  67           HE2      LYS  67  10.811   3.242   8.341
  552    HE3  LYS  67           HE1      LYS  67  10.744   3.247  10.098
  553    HZ1  LYS  67           HZ1      LYS  67   8.391   3.183   8.283
  554    HZ2  LYS  67           HZ2      LYS  67   8.338   3.178   9.975
  555    HZ3  LYS  67           HZ3      LYS  67   9.001   1.885   9.163
  556    H    GLY  68           HN       GLY  68  12.997   7.538  10.347
  557    HA2  GLY  68           HA2      GLY  68  14.549   7.463  12.148
  558    HA3  GLY  68           HA1      GLY  68  13.265   6.774  13.140
  559    H    LEU  69           HN       LEU  69  15.029   6.176  10.148
  560    HA   LEU  69           HA       LEU  69  14.612   3.339  10.407
  561    HB2  LEU  69           HB2      LEU  69  16.311   4.980   8.526
  562    HB3  LEU  69           HB1      LEU  69  16.453   3.242   8.589
  563    HG   LEU  69           HG       LEU  69  14.023   3.101   7.948
  564   HD11  LEU  69          HD11      LEU  69  14.356   6.024   7.404
  565   HD12  LEU  69          HD12      LEU  69  13.322   5.313   8.645
  566   HD13  LEU  69          HD13      LEU  69  12.968   5.040   6.936
  567   HD21  LEU  69          HD21      LEU  69  14.419   3.610   5.590
  568   HD22  LEU  69          HD22      LEU  69  15.785   2.765   6.322
  569   HD23  LEU  69          HD23      LEU  69  15.872   4.504   6.035
  570    H    GLU  70           HN       GLU  70  16.585   1.901  10.461
  571    HA   GLU  70           HA       GLU  70  18.051   2.813  12.760
  572    HB2  GLU  70           HB2      GLU  70  17.021   0.517  12.585
  573    HB3  GLU  70           HB1      GLU  70  18.262   0.143  11.393
  574    HG2  GLU  70           HG2      GLU  70  19.981   0.564  13.050
  575    HG3  GLU  70           HG1      GLU  70  18.736   0.939  14.246
  576    H    HIS  71           HN       HIS  71  19.269   4.341  11.897
  577    HA   HIS  71           HA       HIS  71  21.052   3.853   9.665
  578    HB2  HIS  71           HB2      HIS  71  20.830   6.266  11.496
  579    HB3  HIS  71           HB1      HIS  71  21.853   6.169  10.078
  580    HD1  HIS  71           HD1      HIS  71  20.779   6.864   7.869
  581    HD2  HIS  71           HD2      HIS  71  18.021   6.314  10.915
  582    HE1  HIS  71           HE1      HIS  71  18.604   7.752   6.988
  583    HE2  HIS  71           HE2      HIS  71  16.975   7.488   8.921
  584    H    HIS  72           HN       HIS  72  22.682   2.545  10.130
  585    HA   HIS  72           HA       HIS  72  23.936   2.706  12.745
  586    HB2  HIS  72           HB2      HIS  72  23.440   0.472  11.794
  587    HB3  HIS  72           HB1      HIS  72  24.528   0.818  10.457
  588    HD1  HIS  72           HD1      HIS  72  24.546  -0.082  14.106
  589    HD2  HIS  72           HD2      HIS  72  27.251   0.623  11.039
  590    HE1  HIS  72           HE1      HIS  72  26.758  -0.885  14.960
  591    HE2  HIS  72           HE2      HIS  72  28.363   0.007  13.251
  592    H    HIS  73           HN       HIS  73  24.733   3.289   9.350
  593    HA   HIS  73           HA       HIS  73  27.462   3.907  10.009
  594    HB2  HIS  73           HB2      HIS  73  26.740   3.058   7.732
  595    HB3  HIS  73           HB1      HIS  73  26.054   4.651   7.431
  596    HD1  HIS  73           HD1      HIS  73  27.632   6.269   6.283
  597    HD2  HIS  73           HD2      HIS  73  29.666   3.257   8.286
  598    HE1  HIS  73           HE1      HIS  73  30.035   6.639   5.791
  599    HE2  HIS  73           HE2      HIS  73  31.228   5.022   7.279
  600    H    HIS  74           HN       HIS  74  24.526   5.644   9.549
  601    HA   HIS  74           HA       HIS  74  25.835   8.139  10.344
  602    HB2  HIS  74           HB2      HIS  74  24.345   8.299   8.347
  603    HB3  HIS  74           HB1      HIS  74  23.031   7.594   9.250
  604    HD1  HIS  74           HD1      HIS  74  24.319  10.812   8.167
  605    HD2  HIS  74           HD2      HIS  74  22.110   9.465  11.423
  606    HE1  HIS  74           HE1      HIS  74  23.151  12.815   9.070
  607    HE2  HIS  74           HE2      HIS  74  21.610  11.911  10.813
  608    H    HIS  75           HN       HIS  75  26.199   7.131  12.411
  609    HA   HIS  75           HA       HIS  75  24.021   6.256  14.037
  610    HB2  HIS  75           HB2      HIS  75  26.416   5.540  14.350
  611    HB3  HIS  75           HB1      HIS  75  26.780   7.162  14.918
  612    HD1  HIS  75           HD1      HIS  75  25.118   3.979  15.940
  613    HD2  HIS  75           HD2      HIS  75  25.978   7.706  17.546
  614    HE1  HIS  75           HE1      HIS  75  24.631   3.776  18.360
  615    HE2  HIS  75           HE2      HIS  75  25.419   5.940  19.349
  616    H    HIS  76           HN       HIS  76  25.697   9.199  13.486
  617    HA   HIS  76           HA       HIS  76  23.533  10.815  14.030
  618    HB2  HIS  76           HB2      HIS  76  24.166  10.398  16.450
  619    HB3  HIS  76           HB1      HIS  76  25.759  11.059  16.103
  620    HD1  HIS  76           HD1      HIS  76  25.960  13.619  15.929
  621    HD2  HIS  76           HD2      HIS  76  22.068  12.298  16.519
  622    HE1  HIS  76           HE1      HIS  76  24.632  15.660  16.446
  623    HE2  HIS  76           HE2      HIS  76  22.380  14.790  17.106
  Start of MODEL   17
    1    H1   GLU   1           HT1      GLU   1   3.563  -5.685 -26.475
    2    H2   GLU   1           HT2      GLU   1   4.751  -6.631 -25.721
    3    H3   GLU   1           HT3      GLU   1   5.009  -5.002 -25.932
    4    HA   GLU   1           HA       GLU   1   3.274  -4.480 -24.392
    5    HB2  GLU   1           HB2      GLU   1   3.015  -7.496 -24.115
    6    HB3  GLU   1           HB1      GLU   1   2.257  -6.329 -23.052
    7    HG2  GLU   1           HG2      GLU   1   0.647  -7.239 -24.624
    8    HG3  GLU   1           HG1      GLU   1   0.891  -5.522 -24.924
    9    H    ASP   2           HN       ASP   2   4.980  -3.586 -23.325
   10    HA   ASP   2           HA       ASP   2   6.709  -5.467 -21.957
   11    HB2  ASP   2           HB2      ASP   2   8.369  -3.657 -21.704
   12    HB3  ASP   2           HB1      ASP   2   7.994  -3.991 -23.384
   13    H    MET   3           HN       MET   3   7.520  -4.850 -19.893
   14    HA   MET   3           HA       MET   3   5.418  -4.642 -18.082
   15    HB2  MET   3           HB2      MET   3   7.115  -4.659 -16.334
   16    HB3  MET   3           HB1      MET   3   7.482  -5.838 -17.578
   17    HG2  MET   3           HG2      MET   3   9.164  -4.350 -18.517
   18    HG3  MET   3           HG1      MET   3   8.772  -3.133 -17.310
   19    HE1  MET   3           HE1      MET   3  11.278  -2.925 -16.584
   20    HE2  MET   3           HE2      MET   3  11.761  -4.129 -17.780
   21    HE3  MET   3           HE3      MET   3  12.284  -4.289 -16.106
   22    H    GLU   4           HN       GLU   4   4.495  -3.040 -17.059
   23    HA   GLU   4           HA       GLU   4   5.313  -0.341 -17.716
   24    HB2  GLU   4           HB2      GLU   4   2.834  -1.415 -16.377
   25    HB3  GLU   4           HB1      GLU   4   3.130   0.288 -16.689
   26    HG2  GLU   4           HG2      GLU   4   3.233  -0.171 -19.083
   27    HG3  GLU   4           HG1      GLU   4   2.923  -1.878 -18.766
   28    HA   PRO   5           HA       PRO   5   7.405  -0.141 -13.817
   29    HB2  PRO   5           HB2      PRO   5   7.377   2.778 -14.109
   30    HB3  PRO   5           HB1      PRO   5   8.747   1.669 -14.046
   31    HG2  PRO   5           HG2      PRO   5   8.020   2.899 -16.323
   32    HG3  PRO   5           HG1      PRO   5   8.702   1.261 -16.286
   33    HD2  PRO   5           HD2      PRO   5   5.854   2.113 -16.613
   34    HD3  PRO   5           HD1      PRO   5   6.773   0.830 -17.438
   35    H    CYS   6           HN       CYS   6   5.596  -0.745 -12.505
   36    HA   CYS   6           HA       CYS   6   4.215   1.522 -11.283
   37    HB2  CYS   6           HB2      CYS   6   3.704  -1.447 -10.857
   38    HB3  CYS   6           HB1      CYS   6   2.720  -0.106 -10.302
   39    HG   CYS   6           HG       CYS   6   3.238  -0.691 -13.606
   40    H    LEU   7           HN       LEU   7   3.963   0.968  -8.748
   41    HA   LEU   7           HA       LEU   7   6.742   0.844  -7.867
   42    HB2  LEU   7           HB2      LEU   7   4.257   1.838  -6.452
   43    HB3  LEU   7           HB1      LEU   7   5.830   1.764  -5.694
   44    HG   LEU   7           HG       LEU   7   6.651   3.320  -7.523
   45   HD11  LEU   7          HD11      LEU   7   4.884   3.054  -9.144
   46   HD12  LEU   7          HD12      LEU   7   5.032   4.742  -8.657
   47   HD13  LEU   7          HD13      LEU   7   3.714   3.758  -8.031
   48   HD21  LEU   7          HD21      LEU   7   5.780   5.335  -6.428
   49   HD22  LEU   7          HD22      LEU   7   6.286   4.103  -5.273
   50   HD23  LEU   7          HD23      LEU   7   4.572   4.350  -5.604
   51    H    THR   8           HN       THR   8   5.470  -1.509  -8.603
   52    HA   THR   8           HA       THR   8   4.365  -3.132  -6.684
   53    HB   THR   8           HB       THR   8   6.241  -3.998  -8.868
   54    HG1  THR   8           HG1      THR   8   3.507  -3.605  -9.373
   55   HG21  THR   8          HG21      THR   8   4.632  -5.848  -9.039
   56   HG22  THR   8          HG22      THR   8   3.653  -5.045  -7.811
   57   HG23  THR   8          HG23      THR   8   5.229  -5.710  -7.370
   58    H    GLY   9           HN       GLY   9   5.216  -4.353  -5.056
   59    HA2  GLY   9           HA2      GLY   9   6.942  -5.744  -4.127
   60    HA3  GLY   9           HA1      GLY   9   8.132  -4.739  -4.936
   61    H    THR  10           HN       THR  10   6.375  -2.428  -3.933
   62    HA   THR  10           HA       THR  10   7.918  -1.971  -1.550
   63    HB   THR  10           HB       THR  10   5.700  -0.238  -2.644
   64    HG1  THR  10           HG1      THR  10   6.903  -0.295  -4.411
   65   HG21  THR  10          HG21      THR  10   8.293   0.392  -1.212
   66   HG22  THR  10          HG22      THR  10   6.688   0.404  -0.479
   67   HG23  THR  10          HG23      THR  10   7.094   1.576  -1.735
   68    H    LYS  11           HN       LYS  11   7.146  -2.261   0.506
   69    HA   LYS  11           HA       LYS  11   4.302  -2.708   0.714
   70    HB2  LYS  11           HB2      LYS  11   4.642  -4.221   2.620
   71    HB3  LYS  11           HB1      LYS  11   5.432  -4.806   1.184
   72    HG2  LYS  11           HG2      LYS  11   7.062  -5.265   2.674
   73    HG3  LYS  11           HG1      LYS  11   7.526  -3.606   2.311
   74    HD2  LYS  11           HD2      LYS  11   7.539  -4.076   4.736
   75    HD3  LYS  11           HD1      LYS  11   6.361  -2.830   4.315
   76    HE2  LYS  11           HE2      LYS  11   4.546  -4.273   4.628
   77    HE3  LYS  11           HE1      LYS  11   5.539  -5.719   4.512
   78    HZ1  LYS  11           HZ1      LYS  11   6.525  -5.098   6.655
   79    HZ2  LYS  11           HZ2      LYS  11   4.868  -5.362   6.720
   80    HZ3  LYS  11           HZ3      LYS  11   5.450  -3.788   6.800
   81    H    VAL  12           HN       VAL  12   3.233  -1.365   1.636
   82    HA   VAL  12           HA       VAL  12   4.585   0.794   3.107
   83    HB   VAL  12           HB       VAL  12   2.906   2.265   2.051
   84   HG11  VAL  12          HG11      VAL  12   3.806   2.220  -0.219
   85   HG12  VAL  12          HG12      VAL  12   4.403   0.585   0.044
   86   HG13  VAL  12          HG13      VAL  12   5.097   1.926   0.948
   87   HG21  VAL  12          HG21      VAL  12   1.533   1.406   0.188
   88   HG22  VAL  12          HG22      VAL  12   1.108   0.665   1.731
   89   HG23  VAL  12          HG23      VAL  12   2.079  -0.231   0.563
   90    H    LYS  13           HN       LYS  13   2.768   2.130   4.195
   91    HA   LYS  13           HA       LYS  13   0.794   0.325   5.355
   92    HB2  LYS  13           HB2      LYS  13   2.057   2.818   6.494
   93    HB3  LYS  13           HB1      LYS  13   0.500   2.252   7.071
   94    HG2  LYS  13           HG2      LYS  13   1.476   0.153   7.719
   95    HG3  LYS  13           HG1      LYS  13   3.075   0.678   7.151
   96    HD2  LYS  13           HD2      LYS  13   1.420   1.886   9.381
   97    HD3  LYS  13           HD1      LYS  13   2.847   0.878   9.593
   98    HE2  LYS  13           HE2      LYS  13   4.134   2.587   8.330
   99    HE3  LYS  13           HE1      LYS  13   2.687   3.596   8.339
  100    HZ1  LYS  13           HZ1      LYS  13   4.121   4.263  10.173
  101    HZ2  LYS  13           HZ2      LYS  13   4.211   2.683  10.730
  102    HZ3  LYS  13           HZ3      LYS  13   2.758   3.507  10.817
  103    H    VAL  14           HN       VAL  14  -1.218   0.783   5.169
  104    HA   VAL  14           HA       VAL  14  -1.896   3.046   3.457
  105    HB   VAL  14           HB       VAL  14  -3.185   0.304   3.641
  106   HG11  VAL  14          HG11      VAL  14  -4.644   1.027   1.863
  107   HG12  VAL  14          HG12      VAL  14  -3.941   2.647   1.907
  108   HG13  VAL  14          HG13      VAL  14  -4.867   2.046   3.285
  109   HG21  VAL  14          HG21      VAL  14  -1.687   1.632   1.372
  110   HG22  VAL  14          HG22      VAL  14  -2.463   0.050   1.320
  111   HG23  VAL  14          HG23      VAL  14  -1.091   0.323   2.393
  112    H    LYS  15           HN       LYS  15  -3.378   4.366   4.155
  113    HA   LYS  15           HA       LYS  15  -4.635   3.952   6.799
  114    HB2  LYS  15           HB2      LYS  15  -3.108   5.911   6.255
  115    HB3  LYS  15           HB1      LYS  15  -4.400   6.374   5.115
  116    HG2  LYS  15           HG2      LYS  15  -5.965   6.585   6.997
  117    HG3  LYS  15           HG1      LYS  15  -4.672   6.170   8.122
  118    HD2  LYS  15           HD2      LYS  15  -4.780   8.590   6.311
  119    HD3  LYS  15           HD1      LYS  15  -4.979   8.584   8.060
  120    HE2  LYS  15           HE2      LYS  15  -2.669   7.816   8.337
  121    HE3  LYS  15           HE1      LYS  15  -2.470   7.756   6.587
  122    HZ1  LYS  15           HZ1      LYS  15  -2.966  10.207   8.188
  123    HZ2  LYS  15           HZ2      LYS  15  -2.791  10.146   6.502
  124    HZ3  LYS  15           HZ3      LYS  15  -1.516   9.733   7.500
  125    H    TYR  16           HN       TYR  16  -6.567   3.019   6.301
  126    HA   TYR  16           HA       TYR  16  -8.113   4.189   4.101
  127    HB2  TYR  16           HB2      TYR  16  -7.511   1.650   4.233
  128    HB3  TYR  16           HB1      TYR  16  -8.687   1.609   5.535
  129    HD1  TYR  16           HD1      TYR  16 -11.047   2.505   4.968
  130    HD2  TYR  16           HD2      TYR  16  -8.173   1.400   2.084
  131    HE1  TYR  16           HE1      TYR  16 -12.863   2.217   3.312
  132    HE2  TYR  16           HE2      TYR  16  -9.972   1.110   0.369
  133    HH   TYR  16           HH       TYR  16 -12.509   0.589   0.480
  134    H    GLY  17           HN       GLY  17  -9.121   5.827   5.061
  135    HA2  GLY  17           HA2      GLY  17 -10.626   5.199   7.504
  136    HA3  GLY  17           HA1      GLY  17  -9.932   6.781   7.166
  137    H    ARG  18           HN       ARG  18 -12.582   4.761   6.793
  138    HA   ARG  18           HA       ARG  18 -13.944   6.851   5.315
  139    HB2  ARG  18           HB2      ARG  18 -13.226   5.295   3.606
  140    HB3  ARG  18           HB1      ARG  18 -13.852   3.941   4.530
  141    HG2  ARG  18           HG2      ARG  18 -16.077   4.633   4.183
  142    HG3  ARG  18           HG1      ARG  18 -15.557   6.146   3.421
  143    HD2  ARG  18           HD2      ARG  18 -14.514   4.844   1.623
  144    HD3  ARG  18           HD1      ARG  18 -15.068   3.354   2.388
  145    HE   ARG  18           HE       ARG  18 -17.336   4.620   2.147
  146   HH11  ARG  18          HH11      ARG  18 -14.759   4.189  -0.263
  147   HH12  ARG  18          HH12      ARG  18 -15.819   4.324  -1.590
  148   HH21  ARG  18          HH21      ARG  18 -18.759   4.760   0.311
  149   HH22  ARG  18          HH22      ARG  18 -18.126   4.625  -1.261
  150    H    GLY  19           HN       GLY  19 -15.361   7.425   6.793
  151    HA2  GLY  19           HA2      GLY  19 -17.110   7.363   8.258
  152    HA3  GLY  19           HA1      GLY  19 -17.561   5.843   7.497
  153    H    LYS  20           HN       LYS  20 -17.409   4.087   8.638
  154    HA   LYS  20           HA       LYS  20 -16.331   4.187  11.343
  155    HB2  LYS  20           HB2      LYS  20 -18.570   3.316  11.114
  156    HB3  LYS  20           HB1      LYS  20 -18.052   2.185   9.879
  157    HG2  LYS  20           HG2      LYS  20 -18.398   1.011  11.954
  158    HG3  LYS  20           HG1      LYS  20 -16.686   1.036  11.521
  159    HD2  LYS  20           HD2      LYS  20 -16.299   2.832  13.135
  160    HD3  LYS  20           HD1      LYS  20 -18.006   2.801  13.586
  161    HE2  LYS  20           HE2      LYS  20 -17.770   0.457  14.286
  162    HE3  LYS  20           HE1      LYS  20 -16.070   0.504  13.840
  163    HZ1  LYS  20           HZ1      LYS  20 -16.381   0.784  16.206
  164    HZ2  LYS  20           HZ2      LYS  20 -17.313   2.166  15.966
  165    HZ3  LYS  20           HZ3      LYS  20 -15.693   2.164  15.542
  166    H    THR  21           HN       THR  21 -15.594   2.856   8.206
  167    HA   THR  21           HA       THR  21 -13.812   1.012   9.478
  168    HB   THR  21           HB       THR  21 -15.141   0.058   7.653
  169    HG1  THR  21           HG1      THR  21 -13.041  -0.731   8.037
  170   HG21  THR  21          HG21      THR  21 -15.405   2.026   6.182
  171   HG22  THR  21          HG22      THR  21 -14.755   0.657   5.282
  172   HG23  THR  21          HG23      THR  21 -13.690   1.960   5.791
  173    H    GLN  22           HN       GLN  22 -12.365   2.267  10.375
  174    HA   GLN  22           HA       GLN  22 -10.441   3.363   8.496
  175    HB2  GLN  22           HB2      GLN  22 -11.319   5.251   9.772
  176    HB3  GLN  22           HB1      GLN  22 -10.948   4.426  11.287
  177    HG2  GLN  22           HG2      GLN  22  -8.597   4.570  10.886
  178    HG3  GLN  22           HG1      GLN  22  -8.854   5.135   9.245
  179   HE21  GLN  22          HE21      GLN  22  -9.324   7.256   8.894
  180   HE22  GLN  22          HE22      GLN  22  -9.207   8.467  10.099
  181    H    LYS  23           HN       LYS  23  -8.734   2.365   8.371
  182    HA   LYS  23           HA       LYS  23  -7.684   0.838  10.593
  183    HB2  LYS  23           HB2      LYS  23  -7.557  -1.154   9.014
  184    HB3  LYS  23           HB1      LYS  23  -9.120  -0.755   9.713
  185    HG2  LYS  23           HG2      LYS  23  -9.595   0.522   7.582
  186    HG3  LYS  23           HG1      LYS  23  -8.160  -0.266   6.915
  187    HD2  LYS  23           HD2      LYS  23  -9.116  -2.428   7.413
  188    HD3  LYS  23           HD1      LYS  23 -10.519  -1.627   8.125
  189    HE2  LYS  23           HE2      LYS  23 -11.067  -0.609   5.968
  190    HE3  LYS  23           HE1      LYS  23  -9.657  -1.373   5.235
  191    HZ1  LYS  23           HZ1      LYS  23 -10.668  -3.541   5.680
  192    HZ2  LYS  23           HZ2      LYS  23 -11.679  -2.589   4.729
  193    HZ3  LYS  23           HZ3      LYS  23 -12.015  -2.789   6.362
  194    H    ILE  24           HN       ILE  24  -5.508   0.847  10.566
  195    HA   ILE  24           HA       ILE  24  -4.145   1.623   8.096
  196    HB   ILE  24           HB       ILE  24  -3.208   2.021  10.979
  197   HG12  ILE  24          HG12      ILE  24  -2.937   4.443  10.248
  198   HG13  ILE  24          HG11      ILE  24  -3.775   4.038   8.766
  199   HG21  ILE  24          HG21      ILE  24  -1.614   2.497   8.449
  200   HG22  ILE  24          HG22      ILE  24  -1.312   1.248   9.646
  201   HG23  ILE  24          HG23      ILE  24  -1.107   2.944  10.074
  202   HD11  ILE  24          HD11      ILE  24  -5.773   3.459  10.090
  203   HD12  ILE  24          HD12      ILE  24  -5.266   5.127  10.349
  204   HD13  ILE  24          HD13      ILE  24  -4.908   3.898  11.561
  205    H    TYR  25           HN       TYR  25  -2.993   0.181   7.213
  206    HA   TYR  25           HA       TYR  25  -1.963  -2.064   8.680
  207    HB2  TYR  25           HB2      TYR  25  -2.956  -3.588   6.755
  208    HB3  TYR  25           HB1      TYR  25  -3.877  -3.243   8.207
  209    HD1  TYR  25           HD1      TYR  25  -3.557  -0.726   5.465
  210    HD2  TYR  25           HD2      TYR  25  -5.937  -3.809   7.174
  211    HE1  TYR  25           HE1      TYR  25  -5.501  -0.020   4.075
  212    HE2  TYR  25           HE2      TYR  25  -7.833  -3.109   5.806
  213    HH   TYR  25           HH       TYR  25  -7.527  -1.073   3.193
  214    H    GLU  26           HN       GLU  26  -0.692  -3.532   7.223
  215    HA   GLU  26           HA       GLU  26   0.886  -1.811   5.465
  216    HB2  GLU  26           HB2      GLU  26   1.604  -4.375   6.895
  217    HB3  GLU  26           HB1      GLU  26   2.678  -3.477   5.834
  218    HG2  GLU  26           HG2      GLU  26   2.686  -1.619   7.330
  219    HG3  GLU  26           HG1      GLU  26   1.501  -2.400   8.385
  220    H    ALA  27           HN       ALA  27   0.767  -2.157   3.456
  221    HA   ALA  27           HA       ALA  27  -0.132  -4.744   2.417
  222    HB1  ALA  27           HB1      ALA  27  -1.026  -2.028   1.474
  223    HB2  ALA  27           HB2      ALA  27  -1.998  -3.163   2.406
  224    HB3  ALA  27           HB3      ALA  27  -1.484  -3.580   0.769
  225    H    SER  28           HN       SER  28   0.643  -5.201   0.379
  226    HA   SER  28           HA       SER  28   3.008  -3.678  -0.395
  227    HB2  SER  28           HB2      SER  28   2.153  -6.460  -1.143
  228    HB3  SER  28           HB1      SER  28   3.720  -5.704  -1.482
  229    HG   SER  28           HG       SER  28   3.103  -5.469   1.092
  230    H    ILE  29           HN       ILE  29   3.158  -2.797  -2.327
  231    HA   ILE  29           HA       ILE  29   0.806  -2.278  -3.859
  232    HB   ILE  29           HB       ILE  29   3.684  -1.717  -4.566
  233   HG12  ILE  29          HG12      ILE  29   3.280  -0.673  -2.423
  234   HG13  ILE  29          HG11      ILE  29   3.301   0.579  -3.655
  235   HG21  ILE  29          HG21      ILE  29   2.759   0.092  -5.970
  236   HG22  ILE  29          HG22      ILE  29   1.136  -0.518  -5.611
  237   HG23  ILE  29          HG23      ILE  29   2.301  -1.541  -6.459
  238   HD11  ILE  29          HD11      ILE  29   0.897  -0.594  -2.288
  239   HD12  ILE  29          HD12      ILE  29   0.826   0.578  -3.608
  240   HD13  ILE  29          HD13      ILE  29   1.567   1.025  -2.068
  241    H    LYS  30           HN       LYS  30   0.088  -3.450  -5.560
  242    HA   LYS  30           HA       LYS  30   2.050  -5.177  -6.871
  243    HB2  LYS  30           HB2      LYS  30   0.189  -6.349  -5.591
  244    HB3  LYS  30           HB1      LYS  30  -0.913  -5.718  -6.801
  245    HG2  LYS  30           HG2      LYS  30   1.472  -7.360  -7.620
  246    HG3  LYS  30           HG1      LYS  30   0.005  -8.141  -7.053
  247    HD2  LYS  30           HD2      LYS  30   0.051  -6.104  -9.206
  248    HD3  LYS  30           HD1      LYS  30   0.272  -7.829  -9.567
  249    HE2  LYS  30           HE2      LYS  30  -1.878  -8.335  -8.544
  250    HE3  LYS  30           HE1      LYS  30  -2.130  -6.653  -8.118
  251    HZ1  LYS  30           HZ1      LYS  30  -2.182  -6.142 -10.488
  252    HZ2  LYS  30           HZ2      LYS  30  -3.378  -7.275 -10.054
  253    HZ3  LYS  30           HZ3      LYS  30  -1.991  -7.784 -10.852
  254    H    SER  31           HN       SER  31  -0.852  -3.212  -7.538
  255    HA   SER  31           HA       SER  31   0.347  -2.665 -10.162
  256    HB2  SER  31           HB2      SER  31  -2.604  -3.169  -9.630
  257    HB3  SER  31           HB1      SER  31  -1.906  -2.670 -11.169
  258    HG   SER  31           HG       SER  31  -0.945  -4.570 -11.391
  259    H    THR  32           HN       THR  32  -0.601  -0.582 -11.149
  260    HA   THR  32           HA       THR  32  -1.810   1.233  -9.244
  261    HB   THR  32           HB       THR  32   0.584   2.245 -10.785
  262    HG1  THR  32           HG1      THR  32   0.532   0.574  -8.556
  263   HG21  THR  32          HG21      THR  32  -0.663   2.990  -8.170
  264   HG22  THR  32          HG22      THR  32  -0.950   3.766  -9.726
  265   HG23  THR  32          HG23      THR  32   0.651   3.838  -8.983
  266    H    GLU  33           HN       GLU  33  -2.853   2.964 -10.377
  267    HA   GLU  33           HA       GLU  33  -2.562   3.066 -13.272
  268    HB2  GLU  33           HB2      GLU  33  -4.917   3.102 -13.686
  269    HB3  GLU  33           HB1      GLU  33  -4.490   1.594 -12.856
  270    HG2  GLU  33           HG2      GLU  33  -5.416   2.451 -10.795
  271    HG3  GLU  33           HG1      GLU  33  -5.711   4.014 -11.561
  272    H    ILE  34           HN       ILE  34  -3.410   5.068 -14.143
  273    HA   ILE  34           HA       ILE  34  -3.746   7.104 -12.067
  274    HB   ILE  34           HB       ILE  34  -2.447   7.523 -14.758
  275   HG12  ILE  34          HG12      ILE  34  -0.370   8.185 -13.459
  276   HG13  ILE  34          HG11      ILE  34  -1.192   7.663 -12.003
  277   HG21  ILE  34          HG21      ILE  34  -2.891   9.482 -12.500
  278   HG22  ILE  34          HG22      ILE  34  -3.750   9.447 -14.034
  279   HG23  ILE  34          HG23      ILE  34  -2.031   9.846 -14.001
  280   HD11  ILE  34          HD11      ILE  34  -0.408   5.881 -14.303
  281   HD12  ILE  34          HD12      ILE  34  -1.231   5.416 -12.807
  282   HD13  ILE  34          HD13      ILE  34   0.422   6.023 -12.736
  283    H    ASP  35           HN       ASP  35  -5.713   7.684 -12.128
  284    HA   ASP  35           HA       ASP  35  -7.117   8.135 -14.663
  285    HB2  ASP  35           HB2      ASP  35  -7.735   5.855 -13.989
  286    HB3  ASP  35           HB1      ASP  35  -8.229   6.457 -12.411
  287    H    ASP  36           HN       ASP  36  -8.533   9.809 -14.579
  288    HA   ASP  36           HA       ASP  36  -9.562  11.702 -13.896
  289    HB2  ASP  36           HB2      ASP  36 -10.796  10.080 -12.378
  290    HB3  ASP  36           HB1      ASP  36  -9.619  10.435 -11.130
  291    H    GLY  37           HN       GLY  37  -6.678  11.252 -13.680
  292    HA2  GLY  37           HA2      GLY  37  -4.946  12.761 -13.367
  293    HA3  GLY  37           HA1      GLY  37  -6.039  13.772 -12.432
  294    H    GLU  38           HN       GLU  38  -6.352  10.746 -11.148
  295    HA   GLU  38           HA       GLU  38  -4.233  11.288  -9.255
  296    HB2  GLU  38           HB2      GLU  38  -5.741  10.172  -7.546
  297    HB3  GLU  38           HB1      GLU  38  -6.195  11.775  -8.114
  298    HG2  GLU  38           HG2      GLU  38  -7.883  10.743  -9.589
  299    HG3  GLU  38           HG1      GLU  38  -7.449   9.160  -8.946
  300    H    VAL  39           HN       VAL  39  -3.193   9.541  -8.249
  301    HA   VAL  39           HA       VAL  39  -3.012   7.231 -10.047
  302    HB   VAL  39           HB       VAL  39  -1.125   7.853  -7.789
  303   HG11  VAL  39          HG11      VAL  39  -0.769   6.317 -10.374
  304   HG12  VAL  39          HG12      VAL  39  -0.853   5.656  -8.767
  305   HG13  VAL  39          HG13      VAL  39   0.511   6.649  -9.227
  306   HG21  VAL  39          HG21      VAL  39  -1.170   9.907  -9.043
  307   HG22  VAL  39          HG22      VAL  39  -1.003   9.048 -10.561
  308   HG23  VAL  39          HG23      VAL  39   0.336   9.065  -9.409
  309    H    LEU  40           HN       LEU  40  -3.927   5.497  -9.440
  310    HA   LEU  40           HA       LEU  40  -4.714   5.106  -6.644
  311    HB2  LEU  40           HB2      LEU  40  -5.833   3.924  -9.166
  312    HB3  LEU  40           HB1      LEU  40  -6.464   3.694  -7.545
  313    HG   LEU  40           HG       LEU  40  -6.393   6.298  -9.048
  314   HD11  LEU  40          HD11      LEU  40  -7.955   4.766 -10.012
  315   HD12  LEU  40          HD12      LEU  40  -8.820   6.030  -9.134
  316   HD13  LEU  40          HD13      LEU  40  -8.649   4.417  -8.429
  317   HD21  LEU  40          HD21      LEU  40  -7.571   5.592  -6.360
  318   HD22  LEU  40          HD22      LEU  40  -7.777   7.136  -7.201
  319   HD23  LEU  40          HD23      LEU  40  -6.174   6.627  -6.664
  320    H    TYR  41           HN       TYR  41  -4.003   3.378  -5.654
  321    HA   TYR  41           HA       TYR  41  -2.221   1.615  -7.156
  322    HB2  TYR  41           HB2      TYR  41  -2.212   2.455  -4.269
  323    HB3  TYR  41           HB1      TYR  41  -1.212   1.157  -4.901
  324    HD1  TYR  41           HD1      TYR  41  -1.916   4.790  -5.279
  325    HD2  TYR  41           HD2      TYR  41   0.839   1.621  -5.867
  326    HE1  TYR  41           HE1      TYR  41  -0.187   6.424  -5.872
  327    HE2  TYR  41           HE2      TYR  41   2.576   3.227  -6.473
  328    HH   TYR  41           HH       TYR  41   2.701   5.526  -7.382
  329    H    LEU  42           HN       LEU  42  -2.348  -0.512  -6.889
  330    HA   LEU  42           HA       LEU  42  -4.683  -1.503  -5.464
  331    HB2  LEU  42           HB2      LEU  42  -4.692  -1.922  -7.906
  332    HB3  LEU  42           HB1      LEU  42  -3.113  -2.655  -7.777
  333    HG   LEU  42           HG       LEU  42  -5.104  -4.217  -8.104
  334   HD11  LEU  42          HD11      LEU  42  -2.931  -5.010  -7.427
  335   HD12  LEU  42          HD12      LEU  42  -4.213  -5.938  -6.642
  336   HD13  LEU  42          HD13      LEU  42  -3.321  -4.717  -5.734
  337   HD21  LEU  42          HD21      LEU  42  -5.557  -3.555  -5.189
  338   HD22  LEU  42          HD22      LEU  42  -6.348  -4.847  -6.080
  339   HD23  LEU  42          HD23      LEU  42  -6.640  -3.170  -6.522
  340    H    VAL  43           HN       VAL  43  -4.197  -2.345  -3.660
  341    HA   VAL  43           HA       VAL  43  -1.475  -3.314  -3.174
  342    HB   VAL  43           HB       VAL  43  -1.503  -2.301  -0.997
  343   HG11  VAL  43          HG11      VAL  43  -2.640  -0.288  -2.892
  344   HG12  VAL  43          HG12      VAL  43  -0.974  -0.817  -2.857
  345   HG13  VAL  43          HG13      VAL  43  -1.654   0.049  -1.467
  346   HG21  VAL  43          HG21      VAL  43  -3.438  -1.044  -0.103
  347   HG22  VAL  43          HG22      VAL  43  -3.855  -2.735  -0.379
  348   HG23  VAL  43          HG23      VAL  43  -4.381  -1.501  -1.519
  349    H    HIS  44           HN       HIS  44  -1.336  -5.001  -1.694
  350    HA   HIS  44           HA       HIS  44  -3.726  -5.990  -0.508
  351    HB2  HIS  44           HB2      HIS  44  -3.273  -8.405  -1.193
  352    HB3  HIS  44           HB1      HIS  44  -4.009  -7.353  -2.381
  353    HD1  HIS  44           HD1      HIS  44  -3.283  -8.106  -4.466
  354    HD2  HIS  44           HD2      HIS  44  -0.142  -8.108  -1.785
  355    HE1  HIS  44           HE1      HIS  44  -1.293  -8.992  -5.763
  356    HE2  HIS  44           HE2      HIS  44   0.480  -9.270  -4.002
  357    H    TYR  45           HN       TYR  45  -3.384  -7.699   1.070
  358    HA   TYR  45           HA       TYR  45  -1.091  -6.677   2.567
  359    HB2  TYR  45           HB2      TYR  45  -3.493  -8.069   3.719
  360    HB3  TYR  45           HB1      TYR  45  -2.412  -6.906   4.486
  361    HD1  TYR  45           HD2      TYR  45  -2.670  -4.502   4.044
  362    HD2  TYR  45           HD1      TYR  45  -5.314  -7.335   2.308
  363    HE1  TYR  45           HE2      TYR  45  -4.210  -2.692   3.409
  364    HE2  TYR  45           HE1      TYR  45  -6.847  -5.535   1.670
  365    HH   TYR  45           HH       TYR  45  -7.390  -3.315   2.274
  366    H    TYR  46           HN       TYR  46   0.466  -8.115   2.075
  367    HA   TYR  46           HA       TYR  46   1.725  -9.976   2.040
  368    HB2  TYR  46           HB2      TYR  46   0.042 -10.667   4.426
  369    HB3  TYR  46           HB1      TYR  46   1.614 -11.368   4.046
  370    HD1  TYR  46           HD1      TYR  46   3.618  -9.773   3.951
  371    HD2  TYR  46           HD2      TYR  46  -0.120  -8.699   5.672
  372    HE1  TYR  46           HE1      TYR  46   4.710  -7.970   5.206
  373    HE2  TYR  46           HE2      TYR  46   0.965  -6.899   6.929
  374    HH   TYR  46           HH       TYR  46   3.160  -6.400   7.756
  375    H    GLY  47           HN       GLY  47   1.334 -11.091   0.219
  376    HA2  GLY  47           HA2      GLY  47   0.879 -13.264  -0.635
  377    HA3  GLY  47           HA1      GLY  47  -0.498 -13.368   0.462
  378    H    TRP  48           HN       TRP  48  -2.053 -13.775  -1.184
  379    HA   TRP  48           HA       TRP  48  -2.508 -11.437  -2.834
  380    HB2  TRP  48           HB2      TRP  48  -2.730 -14.338  -3.661
  381    HB3  TRP  48           HB1      TRP  48  -3.401 -13.007  -4.594
  382    HD1  TRP  48           HD1      TRP  48  -1.659 -11.407  -5.872
  383    HE1  TRP  48           HE1      TRP  48   0.805 -11.766  -6.582
  384    HE3  TRP  48           HE3      TRP  48  -0.538 -15.446  -2.950
  385    HZ2  TRP  48           HZ2      TRP  48   2.914 -13.510  -5.980
  386    HZ3  TRP  48           HZ3      TRP  48   1.726 -16.395  -3.073
  387    HH2  TRP  48           HH2      TRP  48   3.414 -15.448  -4.560
  388    H    ASN  49           HN       ASN  49  -4.156 -10.535  -1.954
  389    HA   ASN  49           HA       ASN  49  -6.253 -12.071  -0.718
  390    HB2  ASN  49           HB2      ASN  49  -6.066  -9.097  -1.295
  391    HB3  ASN  49           HB1      ASN  49  -7.360  -9.859  -0.387
  392   HD21  ASN  49          HD21      ASN  49  -6.906 -10.628   1.736
  393   HD22  ASN  49          HD22      ASN  49  -5.507 -10.090   2.583
  394    H    VAL  50           HN       VAL  50  -8.008 -12.709  -1.717
  395    HA   VAL  50           HA       VAL  50  -8.013 -12.331  -4.539
  396    HB   VAL  50           HB       VAL  50  -9.883 -14.021  -4.562
  397   HG11  VAL  50          HG11      VAL  50  -8.379 -15.889  -3.925
  398   HG12  VAL  50          HG12      VAL  50  -7.302 -14.724  -3.148
  399   HG13  VAL  50          HG13      VAL  50  -7.559 -14.659  -4.884
  400   HG21  VAL  50          HG21      VAL  50 -10.281 -15.296  -2.499
  401   HG22  VAL  50          HG22      VAL  50 -10.762 -13.610  -2.292
  402   HG23  VAL  50          HG23      VAL  50  -9.240 -14.187  -1.610
  403    H    ARG  51           HN       ARG  51 -10.284 -11.563  -1.946
  404    HA   ARG  51           HA       ARG  51 -11.639  -9.803  -3.888
  405    HB2  ARG  51           HB2      ARG  51 -13.187 -11.389  -2.848
  406    HB3  ARG  51           HB1      ARG  51 -12.694 -10.852  -1.245
  407    HG2  ARG  51           HG2      ARG  51 -13.539  -8.597  -1.770
  408    HG3  ARG  51           HG1      ARG  51 -14.090  -9.191  -3.327
  409    HD2  ARG  51           HD2      ARG  51 -15.614 -10.716  -2.226
  410    HD3  ARG  51           HD1      ARG  51 -15.029 -10.186  -0.647
  411    HE   ARG  51           HE       ARG  51 -15.810  -7.929  -2.037
  412   HH11  ARG  51          HH11      ARG  51 -17.363 -10.790  -0.634
  413   HH12  ARG  51          HH12      ARG  51 -18.884 -10.034  -0.439
  414   HH21  ARG  51          HH21      ARG  51 -17.899  -6.896  -1.730
  415   HH22  ARG  51          HH22      ARG  51 -19.170  -7.784  -1.048
  416    H    TYR  52           HN       TYR  52  -9.828  -9.921  -0.982
  417    HA   TYR  52           HA       TYR  52 -10.615  -7.275  -0.101
  418    HB2  TYR  52           HB2      TYR  52 -10.089  -9.432   1.287
  419    HB3  TYR  52           HB1      TYR  52  -8.420  -8.905   1.135
  420    HD1  TYR  52           HD2      TYR  52 -11.767  -7.639   2.156
  421    HD2  TYR  52           HD1      TYR  52  -7.567  -7.494   2.782
  422    HE1  TYR  52           HE2      TYR  52 -12.115  -6.176   4.095
  423    HE2  TYR  52           HE1      TYR  52  -7.907  -6.034   4.734
  424    HH   TYR  52           HH       TYR  52 -10.890  -5.658   6.170
  425    H    ASP  53           HN       ASP  53  -8.942  -8.068  -2.547
  426    HA   ASP  53           HA       ASP  53  -6.379  -6.786  -2.384
  427    HB2  ASP  53           HB2      ASP  53  -7.401  -8.581  -4.053
  428    HB3  ASP  53           HB1      ASP  53  -8.096  -7.189  -4.855
  429    H    GLU  54           HN       GLU  54  -6.172  -4.475  -2.399
  430    HA   GLU  54           HA       GLU  54  -8.768  -3.075  -2.690
  431    HB2  GLU  54           HB2      GLU  54  -8.058  -3.561  -0.339
  432    HB3  GLU  54           HB1      GLU  54  -6.674  -2.532  -0.590
  433    HG2  GLU  54           HG2      GLU  54  -8.407  -1.346   0.609
  434    HG3  GLU  54           HG1      GLU  54  -8.156  -0.625  -0.982
  435    H    TRP  55           HN       TRP  55  -8.811  -0.941  -3.096
  436    HA   TRP  55           HA       TRP  55  -6.540   0.036  -4.677
  437    HB2  TRP  55           HB2      TRP  55  -9.485   0.468  -4.927
  438    HB3  TRP  55           HB1      TRP  55  -8.290   1.356  -5.874
  439    HD1  TRP  55           HD1      TRP  55  -9.769  -2.158  -5.467
  440    HE1  TRP  55           HE1      TRP  55  -9.230  -3.527  -7.569
  441    HE3  TRP  55           HE3      TRP  55  -6.635   1.153  -7.747
  442    HZ2  TRP  55           HZ2      TRP  55  -7.622  -3.225  -9.924
  443    HZ3  TRP  55           HZ3      TRP  55  -5.616   0.543  -9.894
  444    HH2  TRP  55           HH2      TRP  55  -6.090  -1.578 -10.962
  445    H    VAL  56           HN       VAL  56  -5.520   1.586  -3.655
  446    HA   VAL  56           HA       VAL  56  -7.105   3.600  -2.275
  447    HB   VAL  56           HB       VAL  56  -5.320   3.852  -0.540
  448   HG11  VAL  56          HG11      VAL  56  -7.398   2.633  -0.076
  449   HG12  VAL  56          HG12      VAL  56  -6.041   1.977   0.822
  450   HG13  VAL  56          HG13      VAL  56  -6.632   1.135  -0.614
  451   HG21  VAL  56          HG21      VAL  56  -3.484   2.768  -1.744
  452   HG22  VAL  56          HG22      VAL  56  -4.317   1.218  -1.648
  453   HG23  VAL  56          HG23      VAL  56  -3.736   2.003  -0.180
  454    H    LYS  57           HN       LYS  57  -6.218   5.675  -2.225
  455    HA   LYS  57           HA       LYS  57  -4.638   6.165  -4.567
  456    HB2  LYS  57           HB2      LYS  57  -6.778   7.295  -4.145
  457    HB3  LYS  57           HB1      LYS  57  -6.090   8.006  -2.696
  458    HG2  LYS  57           HG2      LYS  57  -4.699   9.415  -3.909
  459    HG3  LYS  57           HG1      LYS  57  -4.876   8.465  -5.391
  460    HD2  LYS  57           HD2      LYS  57  -6.196  10.484  -5.556
  461    HD3  LYS  57           HD1      LYS  57  -7.217   9.042  -5.461
  462    HE2  LYS  57           HE2      LYS  57  -7.517   9.497  -3.051
  463    HE3  LYS  57           HE1      LYS  57  -6.643  11.016  -3.272
  464    HZ1  LYS  57           HZ1      LYS  57  -8.945  11.539  -3.439
  465    HZ2  LYS  57           HZ2      LYS  57  -9.223  10.175  -4.370
  466    HZ3  LYS  57           HZ3      LYS  57  -8.436  11.452  -5.072
  467    H    ALA  58           HN       ALA  58  -3.012   7.918  -4.406
  468    HA   ALA  58           HA       ALA  58  -0.856   7.016  -2.971
  469    HB1  ALA  58           HB1      ALA  58  -1.231   9.719  -4.217
  470    HB2  ALA  58           HB2      ALA  58  -0.797   8.253  -5.077
  471    HB3  ALA  58           HB3      ALA  58   0.309   8.922  -3.865
  472    H    ASP  59           HN       ASP  59  -3.121   9.567  -2.213
  473    HA   ASP  59           HA       ASP  59  -1.523  10.731  -0.127
  474    HB2  ASP  59           HB2      ASP  59  -3.278  12.219   0.380
  475    HB3  ASP  59           HB1      ASP  59  -3.483  11.909  -1.329
  476    H    ARG  60           HN       ARG  60  -3.521   7.986  -0.202
  477    HA   ARG  60           HA       ARG  60  -3.861   7.932   2.685
  478    HB2  ARG  60           HB2      ARG  60  -4.968   6.344   0.439
  479    HB3  ARG  60           HB1      ARG  60  -4.896   5.620   2.037
  480    HG2  ARG  60           HG2      ARG  60  -6.145   7.640   2.862
  481    HG3  ARG  60           HG1      ARG  60  -6.402   8.059   1.163
  482    HD2  ARG  60           HD2      ARG  60  -7.555   5.967   0.769
  483    HD3  ARG  60           HD1      ARG  60  -6.998   5.441   2.381
  484    HE   ARG  60           HE       ARG  60  -8.445   6.837   3.410
  485   HH11  ARG  60          HH11      ARG  60  -9.129   6.577  -0.075
  486   HH12  ARG  60          HH12      ARG  60 -10.659   7.305  -0.006
  487   HH21  ARG  60          HH21      ARG  60 -10.685   7.812   3.497
  488   HH22  ARG  60          HH22      ARG  60 -11.556   7.990   2.038
  489    H    ILE  61           HN       ILE  61  -1.398   7.288   0.775
  490    HA   ILE  61           HA       ILE  61  -0.787   4.790   2.128
  491    HB   ILE  61           HB       ILE  61   0.434   5.898  -0.423
  492   HG12  ILE  61          HG12      ILE  61  -1.613   3.715   0.027
  493   HG13  ILE  61          HG11      ILE  61  -1.888   5.261  -0.758
  494   HG21  ILE  61          HG21      ILE  61   1.425   3.674  -0.642
  495   HG22  ILE  61          HG22      ILE  61   0.704   3.212   0.898
  496   HG23  ILE  61          HG23      ILE  61   1.963   4.454   0.852
  497   HD11  ILE  61          HD11      ILE  61  -0.142   3.036  -1.746
  498   HD12  ILE  61          HD12      ILE  61  -0.347   4.595  -2.553
  499   HD13  ILE  61          HD13      ILE  61  -1.718   3.496  -2.386
  500    H    ILE  62           HN       ILE  62   1.122   4.577   3.184
  501    HA   ILE  62           HA       ILE  62   2.657   7.016   3.712
  502    HB   ILE  62           HB       ILE  62   2.391   4.444   5.311
  503   HG12  ILE  62          HG12      ILE  62   1.573   6.027   7.144
  504   HG13  ILE  62          HG11      ILE  62   1.413   7.248   5.893
  505   HG21  ILE  62          HG21      ILE  62   4.658   5.238   5.478
  506   HG22  ILE  62          HG22      ILE  62   3.825   5.467   7.015
  507   HG23  ILE  62          HG23      ILE  62   4.097   6.843   5.945
  508   HD11  ILE  62          HD11      ILE  62  -0.240   5.828   4.755
  509   HD12  ILE  62          HD12      ILE  62  -0.725   6.218   6.404
  510   HD13  ILE  62          HD13      ILE  62  -0.070   4.624   6.033
  511    H    TRP  63           HN       TRP  63   4.465   7.070   2.541
  512    HA   TRP  63           HA       TRP  63   5.424   4.589   1.418
  513    HB2  TRP  63           HB2      TRP  63   6.052   7.452   0.702
  514    HB3  TRP  63           HB1      TRP  63   6.752   6.036  -0.078
  515    HD1  TRP  63           HD1      TRP  63   3.616   8.139  -0.013
  516    HE1  TRP  63           HE1      TRP  63   1.992   7.259  -1.813
  517    HE3  TRP  63           HE3      TRP  63   6.051   3.836  -1.250
  518    HZ2  TRP  63           HZ2      TRP  63   1.781   5.022  -3.513
  519    HZ3  TRP  63           HZ3      TRP  63   5.072   2.371  -2.958
  520    HH2  TRP  63           HH2      TRP  63   2.982   2.953  -4.065
  521    HA   PRO  64           HA       PRO  64   8.769   4.467   4.420
  522    HB2  PRO  64           HB2      PRO  64   9.715   2.346   2.623
  523    HB3  PRO  64           HB1      PRO  64   9.340   2.260   4.347
  524    HG2  PRO  64           HG2      PRO  64   7.763   1.099   2.528
  525    HG3  PRO  64           HG1      PRO  64   7.102   1.876   3.980
  526    HD2  PRO  64           HD2      PRO  64   7.177   2.888   1.171
  527    HD3  PRO  64           HD1      PRO  64   5.909   3.008   2.421
  528    H    LEU  65           HN       LEU  65  10.221   5.750   4.439
  529    HA   LEU  65           HA       LEU  65  12.427   5.659   2.717
  530    HB2  LEU  65           HB2      LEU  65  10.617   7.107   1.500
  531    HB3  LEU  65           HB1      LEU  65  10.942   8.288   2.748
  532    HG   LEU  65           HG       LEU  65  12.939   7.263   0.719
  533   HD11  LEU  65          HD11      LEU  65  11.546   9.898   0.954
  534   HD12  LEU  65          HD12      LEU  65  11.179   8.637  -0.208
  535   HD13  LEU  65          HD13      LEU  65  12.747   9.463  -0.273
  536   HD21  LEU  65          HD21      LEU  65  14.418   9.032   1.544
  537   HD22  LEU  65          HD22      LEU  65  13.974   7.898   2.842
  538   HD23  LEU  65          HD23      LEU  65  13.197   9.472   2.752
  539    H    ASP  66           HN       ASP  66  13.117   5.106   4.781
  540    HA   ASP  66           HA       ASP  66  14.098   5.400   6.804
  541    HB2  ASP  66           HB2      ASP  66  15.358   7.117   5.423
  542    HB3  ASP  66           HB1      ASP  66  14.236   8.332   6.007
  543    H    LYS  67           HN       LYS  67  11.396   5.260   6.830
  544    HA   LYS  67           HA       LYS  67  10.264   7.454   8.284
  545    HB2  LYS  67           HB2      LYS  67   9.096   4.891   7.323
  546    HB3  LYS  67           HB1      LYS  67   8.237   5.920   8.452
  547    HG2  LYS  67           HG2      LYS  67   9.193   6.710   5.724
  548    HG3  LYS  67           HG1      LYS  67   7.521   6.285   6.186
  549    HD2  LYS  67           HD2      LYS  67   9.132   8.677   7.130
  550    HD3  LYS  67           HD1      LYS  67   7.767   8.702   6.022
  551    HE2  LYS  67           HE2      LYS  67   7.657   7.847   8.924
  552    HE3  LYS  67           HE1      LYS  67   7.173   9.397   8.301
  553    HZ1  LYS  67           HZ1      LYS  67   5.883   6.923   7.269
  554    HZ2  LYS  67           HZ2      LYS  67   5.251   8.527   7.320
  555    HZ3  LYS  67           HZ3      LYS  67   5.407   7.639   8.695
  556    H    GLY  68           HN       GLY  68   8.863   7.070  10.061
  557    HA2  GLY  68           HA2      GLY  68   8.835   5.261  11.941
  558    HA3  GLY  68           HA1      GLY  68  10.367   6.106  12.265
  559    H    LEU  69           HN       LEU  69   9.487   8.566  11.108
  560    HA   LEU  69           HA       LEU  69   7.486   9.454  13.070
  561    HB2  LEU  69           HB2      LEU  69   9.824  11.028  11.954
  562    HB3  LEU  69           HB1      LEU  69   8.549  11.709  12.935
  563    HG   LEU  69           HG       LEU  69  10.392  11.471  14.339
  564   HD11  LEU  69          HD11      LEU  69   9.693   9.862  16.027
  565   HD12  LEU  69          HD12      LEU  69   8.594   9.140  14.852
  566   HD13  LEU  69          HD13      LEU  69   8.345  10.804  15.379
  567   HD21  LEU  69          HD21      LEU  69  11.770  10.007  13.016
  568   HD22  LEU  69          HD22      LEU  69  10.667   8.672  13.302
  569   HD23  LEU  69          HD23      LEU  69  11.621   9.327  14.646
  570    H    GLU  70           HN       GLU  70   5.691  10.059  12.149
  571    HA   GLU  70           HA       GLU  70   5.511  10.019   9.345
  572    HB2  GLU  70           HB2      GLU  70   3.678   9.304  10.892
  573    HB3  GLU  70           HB1      GLU  70   3.401  11.004  11.256
  574    HG2  GLU  70           HG2      GLU  70   1.845  10.190   9.541
  575    HG3  GLU  70           HG1      GLU  70   2.905  11.459   8.923
  576    H    HIS  71           HN       HIS  71   5.242  11.555   7.912
  577    HA   HIS  71           HA       HIS  71   5.796  14.240   8.859
  578    HB2  HIS  71           HB2      HIS  71   6.370  14.910   6.540
  579    HB3  HIS  71           HB1      HIS  71   7.328  13.534   7.032
  580    HD1  HIS  71           HD1      HIS  71   6.074  14.714   4.089
  581    HD2  HIS  71           HD2      HIS  71   5.507  11.064   5.996
  582    HE1  HIS  71           HE1      HIS  71   5.419  13.104   2.286
  583    HE2  HIS  71           HE2      HIS  71   5.117  10.896   3.456
  584    H    HIS  72           HN       HIS  72   3.775  14.163   9.791
  585    HA   HIS  72           HA       HIS  72   1.396  14.276   8.148
  586    HB2  HIS  72           HB2      HIS  72   1.528  13.365  10.555
  587    HB3  HIS  72           HB1      HIS  72   1.666  15.034  11.073
  588    HD1  HIS  72           HD1      HIS  72  -0.519  16.145  11.613
  589    HD2  HIS  72           HD2      HIS  72  -1.000  12.846   9.138
  590    HE1  HIS  72           HE1      HIS  72  -2.978  15.871  11.337
  591    HE2  HIS  72           HE2      HIS  72  -3.191  13.633  10.217
  592    H    HIS  73           HN       HIS  73   3.764  16.311   9.457
  593    HA   HIS  73           HA       HIS  73   2.638  18.584   8.043
  594    HB2  HIS  73           HB2      HIS  73   3.822  18.564  10.822
  595    HB3  HIS  73           HB1      HIS  73   3.902  20.008   9.822
  596    HD1  HIS  73           HD1      HIS  73   1.933  21.496   9.894
  597    HD2  HIS  73           HD2      HIS  73   1.074  17.722  11.358
  598    HE1  HIS  73           HE1      HIS  73  -0.401  21.653  10.833
  599    HE2  HIS  73           HE2      HIS  73  -0.983  19.255  11.265
  600    H    HIS  74           HN       HIS  74   3.960  19.028   6.495
  601    HA   HIS  74           HA       HIS  74   6.516  17.795   6.346
  602    HB2  HIS  74           HB2      HIS  74   6.840  18.989   4.176
  603    HB3  HIS  74           HB1      HIS  74   5.336  18.102   4.245
  604    HD1  HIS  74           HD1      HIS  74   3.131  19.553   4.310
  605    HD2  HIS  74           HD2      HIS  74   6.628  21.721   3.758
  606    HE1  HIS  74           HE1      HIS  74   2.401  21.795   3.509
  607    HE2  HIS  74           HE2      HIS  74   4.524  22.967   2.909
  608    H    HIS  75           HN       HIS  75   8.043  18.312   7.593
  609    HA   HIS  75           HA       HIS  75   8.432  21.063   8.459
  610    HB2  HIS  75           HB2      HIS  75   9.971  18.572   9.245
  611    HB3  HIS  75           HB1      HIS  75  10.110  20.153   9.997
  612    HD1  HIS  75           HD1      HIS  75   8.570  16.981  10.436
  613    HD2  HIS  75           HD2      HIS  75   7.461  20.908  11.210
  614    HE1  HIS  75           HE1      HIS  75   6.733  16.841  12.129
  615    HE2  HIS  75           HE2      HIS  75   6.004  19.224  12.500
  616    H    HIS  76           HN       HIS  76  10.621  18.487   7.447
  617    HA   HIS  76           HA       HIS  76  11.810  19.827   5.323
  618    HB2  HIS  76           HB2      HIS  76  12.741  21.282   7.115
  619    HB3  HIS  76           HB1      HIS  76  13.355  19.855   7.936
  620    HD1  HIS  76           HD1      HIS  76  13.936  21.950   4.850
  621    HD2  HIS  76           HD2      HIS  76  15.818  18.973   7.045
  622    HE1  HIS  76           HE1      HIS  76  16.229  21.732   3.868
  623    HE2  HIS  76           HE2      HIS  76  17.111  19.675   4.922
  Start of MODEL   18
    1    H1   GLU   1           HT1      GLU   1   9.556  -9.730 -15.156
    2    H2   GLU   1           HT2      GLU   1  10.467 -11.012 -14.536
    3    H3   GLU   1           HT3      GLU   1  11.179  -9.509 -14.722
    4    HA   GLU   1           HA       GLU   1   9.759  -8.585 -13.066
    5    HB2  GLU   1           HB2      GLU   1   8.784 -11.442 -12.780
    6    HB3  GLU   1           HB1      GLU   1   8.393 -10.125 -11.684
    7    HG2  GLU   1           HG2      GLU   1   7.271  -8.930 -13.490
    8    HG3  GLU   1           HG1      GLU   1   7.660 -10.231 -14.605
    9    H    ASP   2           HN       ASP   2  10.858  -8.219 -11.341
   10    HA   ASP   2           HA       ASP   2  12.454  -9.823  -9.764
   11    HB2  ASP   2           HB2      ASP   2  14.715  -9.605 -10.607
   12    HB3  ASP   2           HB1      ASP   2  13.762 -10.203 -11.949
   13    H    MET   3           HN       MET   3  12.087  -6.908 -11.525
   14    HA   MET   3           HA       MET   3  11.811  -5.274  -9.243
   15    HB2  MET   3           HB2      MET   3  14.290  -5.214  -9.433
   16    HB3  MET   3           HB1      MET   3  14.146  -4.764 -11.126
   17    HG2  MET   3           HG2      MET   3  13.132  -2.641 -10.507
   18    HG3  MET   3           HG1      MET   3  13.173  -3.095  -8.808
   19    HE1  MET   3           HE1      MET   3  14.355  -0.344  -9.826
   20    HE2  MET   3           HE2      MET   3  15.877  -0.279  -8.939
   21    HE3  MET   3           HE3      MET   3  14.420  -0.865  -8.141
   22    H    GLU   4           HN       GLU   4   9.826  -5.140 -10.203
   23    HA   GLU   4           HA       GLU   4   9.546  -4.329 -12.874
   24    HB2  GLU   4           HB2      GLU   4   7.494  -4.436 -10.656
   25    HB3  GLU   4           HB1      GLU   4   7.118  -4.086 -12.331
   26    HG2  GLU   4           HG2      GLU   4   6.573  -6.356 -12.054
   27    HG3  GLU   4           HG1      GLU   4   8.135  -6.349 -12.869
   28    HA   PRO   5           HA       PRO   5  10.157  -0.000 -12.402
   29    HB2  PRO   5           HB2      PRO   5   8.191   0.368 -14.562
   30    HB3  PRO   5           HB1      PRO   5   9.895   0.836 -14.475
   31    HG2  PRO   5           HG2      PRO   5   9.076  -1.197 -16.025
   32    HG3  PRO   5           HG1      PRO   5  10.643  -1.214 -15.197
   33    HD2  PRO   5           HD2      PRO   5   8.117  -2.641 -14.497
   34    HD3  PRO   5           HD1      PRO   5   9.811  -3.161 -14.370
   35    H    CYS   6           HN       CYS   6   6.902  -1.281 -12.434
   36    HA   CYS   6           HA       CYS   6   5.759   1.221 -11.524
   37    HB2  CYS   6           HB2      CYS   6   4.576  -0.315 -13.106
   38    HB3  CYS   6           HB1      CYS   6   4.400  -1.453 -11.761
   39    HG   CYS   6           HG       CYS   6   2.930   0.453 -10.231
   40    H    LEU   7           HN       LEU   7   7.722  -0.020  -9.832
   41    HA   LEU   7           HA       LEU   7   8.177  -0.582  -7.731
   42    HB2  LEU   7           HB2      LEU   7   7.229   1.016  -5.996
   43    HB3  LEU   7           HB1      LEU   7   8.111   1.702  -7.326
   44    HG   LEU   7           HG       LEU   7   6.214   3.082  -6.572
   45   HD11  LEU   7          HD11      LEU   7   5.848   2.089  -9.371
   46   HD12  LEU   7          HD12      LEU   7   6.914   3.393  -8.839
   47   HD13  LEU   7          HD13      LEU   7   5.165   3.575  -8.714
   48   HD21  LEU   7          HD21      LEU   7   3.898   2.415  -7.100
   49   HD22  LEU   7          HD22      LEU   7   4.639   1.406  -5.851
   50   HD23  LEU   7          HD23      LEU   7   4.489   0.808  -7.504
   51    H    THR   8           HN       THR   8   6.393  -2.485  -8.592
   52    HA   THR   8           HA       THR   8   4.453  -3.000  -6.607
   53    HB   THR   8           HB       THR   8   4.501  -5.273  -7.779
   54    HG1  THR   8           HG1      THR   8   6.464  -5.345  -8.725
   55   HG21  THR   8          HG21      THR   8   4.058  -2.779  -9.437
   56   HG22  THR   8          HG22      THR   8   2.875  -3.529  -8.360
   57   HG23  THR   8          HG23      THR   8   3.415  -4.379  -9.805
   58    H    GLY   9           HN       GLY   9   4.574  -4.635  -5.011
   59    HA2  GLY   9           HA2      GLY   9   5.657  -6.211  -3.653
   60    HA3  GLY   9           HA1      GLY   9   7.151  -5.910  -4.533
   61    H    THR  10           HN       THR  10   6.213  -2.931  -3.918
   62    HA   THR  10           HA       THR  10   7.946  -2.595  -1.691
   63    HB   THR  10           HB       THR  10   5.910  -0.629  -2.700
   64    HG1  THR  10           HG1      THR  10   7.093  -0.950  -4.519
   65   HG21  THR  10          HG21      THR  10   7.530   1.054  -1.888
   66   HG22  THR  10          HG22      THR  10   8.581  -0.247  -1.330
   67   HG23  THR  10          HG23      THR  10   6.993  -0.020  -0.598
   68    H    LYS  11           HN       LYS  11   7.399  -2.924   0.323
   69    HA   LYS  11           HA       LYS  11   4.602  -3.171   1.020
   70    HB2  LYS  11           HB2      LYS  11   5.374  -4.039   3.215
   71    HB3  LYS  11           HB1      LYS  11   6.000  -4.958   1.862
   72    HG2  LYS  11           HG2      LYS  11   8.153  -3.805   2.097
   73    HG3  LYS  11           HG1      LYS  11   7.506  -2.902   3.464
   74    HD2  LYS  11           HD2      LYS  11   7.113  -5.014   4.656
   75    HD3  LYS  11           HD1      LYS  11   7.805  -5.898   3.296
   76    HE2  LYS  11           HE2      LYS  11   9.236  -3.819   4.932
   77    HE3  LYS  11           HE1      LYS  11   9.400  -5.557   5.146
   78    HZ1  LYS  11           HZ1      LYS  11  10.122  -4.051   2.670
   79    HZ2  LYS  11           HZ2      LYS  11  10.365  -5.708   2.912
   80    HZ3  LYS  11           HZ3      LYS  11  11.188  -4.579   3.850
   81    H    VAL  12           HN       VAL  12   3.527  -1.579   1.585
   82    HA   VAL  12           HA       VAL  12   4.796   0.705   2.937
   83    HB   VAL  12           HB       VAL  12   3.112   2.124   1.830
   84   HG11  VAL  12          HG11      VAL  12   4.025   2.044  -0.439
   85   HG12  VAL  12          HG12      VAL  12   4.705   0.453  -0.109
   86   HG13  VAL  12          HG13      VAL  12   5.293   1.863   0.772
   87   HG21  VAL  12          HG21      VAL  12   1.359   0.439   1.526
   88   HG22  VAL  12          HG22      VAL  12   2.345  -0.380   0.313
   89   HG23  VAL  12          HG23      VAL  12   1.734   1.246   0.005
   90    H    LYS  13           HN       LYS  13   2.938   2.038   3.973
   91    HA   LYS  13           HA       LYS  13   1.100   0.162   5.182
   92    HB2  LYS  13           HB2      LYS  13   2.682   1.031   6.839
   93    HB3  LYS  13           HB1      LYS  13   2.295   2.681   6.400
   94    HG2  LYS  13           HG2      LYS  13   0.246   2.617   7.440
   95    HG3  LYS  13           HG1      LYS  13   0.172   0.859   7.403
   96    HD2  LYS  13           HD2      LYS  13   0.597   1.826   9.668
   97    HD3  LYS  13           HD1      LYS  13   1.821   0.682   9.130
   98    HE2  LYS  13           HE2      LYS  13   3.278   2.490   8.541
   99    HE3  LYS  13           HE1      LYS  13   2.060   3.688   8.992
  100    HZ1  LYS  13           HZ1      LYS  13   2.176   2.880  11.268
  101    HZ2  LYS  13           HZ2      LYS  13   3.709   3.345  10.811
  102    HZ3  LYS  13           HZ3      LYS  13   3.289   1.709  10.852
  103    H    VAL  14           HN       VAL  14  -0.991   0.763   5.291
  104    HA   VAL  14           HA       VAL  14  -1.702   2.884   3.389
  105    HB   VAL  14           HB       VAL  14  -2.882   0.109   3.682
  106   HG11  VAL  14          HG11      VAL  14  -3.786   2.367   1.902
  107   HG12  VAL  14          HG12      VAL  14  -4.672   1.705   3.278
  108   HG13  VAL  14          HG13      VAL  14  -4.377   0.707   1.849
  109   HG21  VAL  14          HG21      VAL  14  -2.153  -0.195   1.378
  110   HG22  VAL  14          HG22      VAL  14  -0.788   0.216   2.414
  111   HG23  VAL  14          HG23      VAL  14  -1.485   1.435   1.348
  112    H    LYS  15           HN       LYS  15  -3.197   4.231   3.969
  113    HA   LYS  15           HA       LYS  15  -4.588   3.941   6.538
  114    HB2  LYS  15           HB2      LYS  15  -3.059   5.772   6.446
  115    HB3  LYS  15           HB1      LYS  15  -3.669   6.283   4.872
  116    HG2  LYS  15           HG2      LYS  15  -5.808   6.873   6.036
  117    HG3  LYS  15           HG1      LYS  15  -4.980   6.545   7.572
  118    HD2  LYS  15           HD2      LYS  15  -3.292   8.178   7.074
  119    HD3  LYS  15           HD1      LYS  15  -3.950   8.436   5.468
  120    HE2  LYS  15           HE2      LYS  15  -6.045   9.274   6.575
  121    HE3  LYS  15           HE1      LYS  15  -5.184   9.181   8.114
  122    HZ1  LYS  15           HZ1      LYS  15  -5.024  11.417   7.210
  123    HZ2  LYS  15           HZ2      LYS  15  -4.479  10.840   5.767
  124    HZ3  LYS  15           HZ3      LYS  15  -3.487  10.722   7.116
  125    H    TYR  16           HN       TYR  16  -6.527   3.099   6.030
  126    HA   TYR  16           HA       TYR  16  -7.960   4.190   3.714
  127    HB2  TYR  16           HB2      TYR  16  -7.255   1.824   3.534
  128    HB3  TYR  16           HB1      TYR  16  -8.179   1.477   4.996
  129    HD1  TYR  16           HD1      TYR  16  -8.314   2.217   1.452
  130    HD2  TYR  16           HD2      TYR  16 -10.629   1.357   4.896
  131    HE1  TYR  16           HE1      TYR  16 -10.251   1.752   0.012
  132    HE2  TYR  16           HE2      TYR  16 -12.581   0.890   3.475
  133    HH   TYR  16           HH       TYR  16 -12.320   0.460   0.152
  134    H    GLY  17           HN       GLY  17  -9.482   5.536   4.427
  135    HA2  GLY  17           HA2      GLY  17 -11.093   4.624   6.666
  136    HA3  GLY  17           HA1      GLY  17 -10.403   6.239   6.689
  137    H    ARG  18           HN       ARG  18 -12.961   4.307   5.756
  138    HA   ARG  18           HA       ARG  18 -14.173   6.666   4.557
  139    HB2  ARG  18           HB2      ARG  18 -15.576   5.264   3.075
  140    HB3  ARG  18           HB1      ARG  18 -13.881   5.022   2.719
  141    HG2  ARG  18           HG2      ARG  18 -13.895   2.850   3.713
  142    HG3  ARG  18           HG1      ARG  18 -15.467   3.143   4.453
  143    HD2  ARG  18           HD2      ARG  18 -15.797   1.708   2.569
  144    HD3  ARG  18           HD1      ARG  18 -16.446   3.293   2.159
  145    HE   ARG  18           HE       ARG  18 -13.977   2.078   1.145
  146   HH11  ARG  18          HH11      ARG  18 -16.396   4.672   0.862
  147   HH12  ARG  18          HH12      ARG  18 -16.012   5.046  -0.737
  148   HH21  ARG  18          HH21      ARG  18 -13.496   2.561  -1.088
  149   HH22  ARG  18          HH22      ARG  18 -14.314   3.842  -1.865
  150    H    GLY  19           HN       GLY  19 -15.368   7.406   6.155
  151    HA2  GLY  19           HA2      GLY  19 -16.936   7.566   7.810
  152    HA3  GLY  19           HA1      GLY  19 -17.744   6.257   6.972
  153    H    LYS  20           HN       LYS  20 -17.736   4.266   7.830
  154    HA   LYS  20           HA       LYS  20 -16.981   4.007  10.609
  155    HB2  LYS  20           HB2      LYS  20 -19.117   3.096   9.776
  156    HB3  LYS  20           HB1      LYS  20 -18.234   2.021   8.705
  157    HG2  LYS  20           HG2      LYS  20 -17.151   1.034  10.740
  158    HG3  LYS  20           HG1      LYS  20 -18.284   1.978  11.705
  159    HD2  LYS  20           HD2      LYS  20 -20.151   0.851  10.635
  160    HD3  LYS  20           HD1      LYS  20 -19.038  -0.065   9.619
  161    HE2  LYS  20           HE2      LYS  20 -19.279  -0.197  12.625
  162    HE3  LYS  20           HE1      LYS  20 -19.763  -1.436  11.473
  163    HZ1  LYS  20           HZ1      LYS  20 -17.393  -1.652  10.827
  164    HZ2  LYS  20           HZ2      LYS  20 -17.685  -2.017  12.433
  165    HZ3  LYS  20           HZ3      LYS  20 -16.966  -0.565  12.051
  166    H    THR  21           HN       THR  21 -15.994   2.778   7.504
  167    HA   THR  21           HA       THR  21 -14.236   0.820   8.638
  168    HB   THR  21           HB       THR  21 -14.717   1.638   5.771
  169    HG1  THR  21           HG1      THR  21 -16.178  -0.025   5.735
  170   HG21  THR  21          HG21      THR  21 -12.586   0.443   6.064
  171   HG22  THR  21          HG22      THR  21 -13.755  -0.552   5.204
  172   HG23  THR  21          HG23      THR  21 -13.422  -0.860   6.911
  173    H    GLN  22           HN       GLN  22 -12.766   2.213   9.764
  174    HA   GLN  22           HA       GLN  22 -10.734   3.218   7.934
  175    HB2  GLN  22           HB2      GLN  22 -11.753   5.241   8.794
  176    HB3  GLN  22           HB1      GLN  22 -11.639   4.647  10.444
  177    HG2  GLN  22           HG2      GLN  22  -9.234   4.799  10.397
  178    HG3  GLN  22           HG1      GLN  22  -9.252   5.210   8.687
  179   HE21  GLN  22          HE21      GLN  22  -9.634   7.297   8.084
  180   HE22  GLN  22          HE22      GLN  22  -9.785   8.598   9.188
  181    H    LYS  23           HN       LYS  23  -8.956   2.226   8.103
  182    HA   LYS  23           HA       LYS  23  -7.892   1.451  10.649
  183    HB2  LYS  23           HB2      LYS  23  -7.768  -0.871  10.198
  184    HB3  LYS  23           HB1      LYS  23  -9.442  -0.368  10.055
  185    HG2  LYS  23           HG2      LYS  23  -9.065  -0.260   7.575
  186    HG3  LYS  23           HG1      LYS  23  -7.524  -1.072   7.870
  187    HD2  LYS  23           HD2      LYS  23  -8.815  -2.918   7.608
  188    HD3  LYS  23           HD1      LYS  23  -9.019  -2.531   9.340
  189    HE2  LYS  23           HE2      LYS  23 -11.100  -1.401   8.924
  190    HE3  LYS  23           HE1      LYS  23 -10.890  -1.615   7.184
  191    HZ1  LYS  23           HZ1      LYS  23 -11.068  -4.023   7.526
  192    HZ2  LYS  23           HZ2      LYS  23 -12.445  -3.202   7.993
  193    HZ3  LYS  23           HZ3      LYS  23 -11.396  -3.774   9.167
  194    H    ILE  24           HN       ILE  24  -5.648   0.984  10.451
  195    HA   ILE  24           HA       ILE  24  -4.514   1.783   7.878
  196    HB   ILE  24           HB       ILE  24  -3.333   1.873  10.679
  197   HG12  ILE  24          HG12      ILE  24  -4.134   4.197   8.935
  198   HG13  ILE  24          HG11      ILE  24  -5.235   3.475  10.106
  199   HG21  ILE  24          HG21      ILE  24  -1.537   3.180   9.653
  200   HG22  ILE  24          HG22      ILE  24  -2.272   2.946   8.066
  201   HG23  ILE  24          HG23      ILE  24  -1.628   1.566   8.949
  202   HD11  ILE  24          HD11      ILE  24  -2.564   4.720  10.715
  203   HD12  ILE  24          HD12      ILE  24  -3.679   3.973  11.868
  204   HD13  ILE  24          HD13      ILE  24  -4.156   5.445  11.012
  205    H    TYR  25           HN       TYR  25  -3.706   0.167   6.739
  206    HA   TYR  25           HA       TYR  25  -2.988  -2.403   8.075
  207    HB2  TYR  25           HB2      TYR  25  -3.186  -2.259   5.125
  208    HB3  TYR  25           HB1      TYR  25  -3.556  -3.576   6.195
  209    HD1  TYR  25           HD1      TYR  25  -4.872  -0.345   4.923
  210    HD2  TYR  25           HD2      TYR  25  -5.825  -4.192   6.477
  211    HE1  TYR  25           HE1      TYR  25  -7.184  -0.075   4.184
  212    HE2  TYR  25           HE2      TYR  25  -8.148  -3.903   5.758
  213    HH   TYR  25           HH       TYR  25  -9.017  -1.579   3.538
  214    H    GLU  26           HN       GLU  26  -1.114  -3.500   7.012
  215    HA   GLU  26           HA       GLU  26   0.492  -1.678   5.395
  216    HB2  GLU  26           HB2      GLU  26   1.470  -3.887   7.225
  217    HB3  GLU  26           HB1      GLU  26   2.500  -3.067   6.053
  218    HG2  GLU  26           HG2      GLU  26   2.021  -0.911   7.193
  219    HG3  GLU  26           HG1      GLU  26   1.083  -1.797   8.386
  220    H    ALA  27           HN       ALA  27   1.169  -2.340   3.423
  221    HA   ALA  27           HA       ALA  27   0.238  -4.959   2.493
  222    HB1  ALA  27           HB1      ALA  27  -1.081  -3.963   0.725
  223    HB2  ALA  27           HB2      ALA  27  -0.691  -2.351   1.325
  224    HB3  ALA  27           HB3      ALA  27  -1.675  -3.439   2.302
  225    H    SER  28           HN       SER  28   0.832  -5.265   0.180
  226    HA   SER  28           HA       SER  28   3.296  -3.847  -0.441
  227    HB2  SER  28           HB2      SER  28   3.727  -5.835  -1.914
  228    HB3  SER  28           HB1      SER  28   3.627  -6.251  -0.203
  229    HG   SER  28           HG       SER  28   1.793  -7.305  -0.542
  230    H    ILE  29           HN       ILE  29   3.413  -2.813  -2.405
  231    HA   ILE  29           HA       ILE  29   0.970  -2.178  -3.672
  232    HB   ILE  29           HB       ILE  29   3.785  -1.715  -4.708
  233   HG12  ILE  29          HG12      ILE  29   3.504  -0.643  -2.563
  234   HG13  ILE  29          HG11      ILE  29   3.445   0.596  -3.813
  235   HG21  ILE  29          HG21      ILE  29   2.765   0.043  -6.104
  236   HG22  ILE  29          HG22      ILE  29   1.169  -0.435  -5.528
  237   HG23  ILE  29          HG23      ILE  29   2.124  -1.552  -6.499
  238   HD11  ILE  29          HD11      ILE  29   1.093  -0.570  -2.304
  239   HD12  ILE  29          HD12      ILE  29   0.969   0.579  -3.633
  240   HD13  ILE  29          HD13      ILE  29   1.777   1.050  -2.142
  241    H    LYS  30           HN       LYS  30  -0.122  -3.228  -5.052
  242    HA   LYS  30           HA       LYS  30   0.884  -5.724  -6.165
  243    HB2  LYS  30           HB2      LYS  30  -1.293  -5.285  -4.795
  244    HB3  LYS  30           HB1      LYS  30  -1.909  -4.589  -6.267
  245    HG2  LYS  30           HG2      LYS  30  -1.054  -7.456  -5.870
  246    HG3  LYS  30           HG1      LYS  30  -2.701  -6.848  -5.887
  247    HD2  LYS  30           HD2      LYS  30  -2.262  -6.102  -8.264
  248    HD3  LYS  30           HD1      LYS  30  -0.752  -7.010  -8.169
  249    HE2  LYS  30           HE2      LYS  30  -3.538  -8.096  -7.825
  250    HE3  LYS  30           HE1      LYS  30  -2.465  -8.389  -9.190
  251    HZ1  LYS  30           HZ1      LYS  30  -0.968  -9.576  -7.689
  252    HZ2  LYS  30           HZ2      LYS  30  -2.514 -10.249  -7.648
  253    HZ3  LYS  30           HZ3      LYS  30  -2.003  -9.286  -6.388
  254    H    SER  31           HN       SER  31  -0.507  -2.579  -7.074
  255    HA   SER  31           HA       SER  31   0.718  -2.555  -9.630
  256    HB2  SER  31           HB2      SER  31  -1.174  -4.158 -10.056
  257    HB3  SER  31           HB1      SER  31  -2.308  -2.903  -9.565
  258    HG   SER  31           HG       SER  31  -2.274  -2.534 -11.639
  259    H    THR  32           HN       THR  32  -0.241  -0.532 -10.860
  260    HA   THR  32           HA       THR  32  -1.502   1.395  -9.088
  261    HB   THR  32           HB       THR  32   0.772   2.416 -10.699
  262    HG1  THR  32           HG1      THR  32   0.925   0.866  -8.320
  263   HG21  THR  32          HG21      THR  32  -0.363   3.102  -8.017
  264   HG22  THR  32          HG22      THR  32  -0.750   3.864  -9.558
  265   HG23  THR  32          HG23      THR  32   0.879   4.008  -8.885
  266    H    GLU  33           HN       GLU  33  -2.745   2.765 -10.218
  267    HA   GLU  33           HA       GLU  33  -2.504   2.954 -13.102
  268    HB2  GLU  33           HB2      GLU  33  -5.001   2.015 -11.705
  269    HB3  GLU  33           HB1      GLU  33  -5.037   2.807 -13.270
  270    HG2  GLU  33           HG2      GLU  33  -3.596   1.087 -14.181
  271    HG3  GLU  33           HG1      GLU  33  -3.591   0.249 -12.627
  272    H    ILE  34           HN       ILE  34  -3.625   4.741 -13.934
  273    HA   ILE  34           HA       ILE  34  -4.075   6.726 -11.836
  274    HB   ILE  34           HB       ILE  34  -3.219   7.216 -14.702
  275   HG12  ILE  34          HG12      ILE  34  -1.229   8.357 -13.651
  276   HG13  ILE  34          HG11      ILE  34  -1.826   7.815 -12.088
  277   HG21  ILE  34          HG21      ILE  34  -3.180   9.635 -14.118
  278   HG22  ILE  34          HG22      ILE  34  -3.906   9.232 -12.558
  279   HG23  ILE  34          HG23      ILE  34  -4.799   8.935 -14.044
  280   HD11  ILE  34          HD11      ILE  34  -1.469   5.535 -12.716
  281   HD12  ILE  34          HD12      ILE  34   0.025   6.460 -12.876
  282   HD13  ILE  34          HD13      ILE  34  -0.914   6.018 -14.319
  283    H    ASP  35           HN       ASP  35  -6.027   7.499 -11.647
  284    HA   ASP  35           HA       ASP  35  -7.908   7.020 -13.830
  285    HB2  ASP  35           HB2      ASP  35  -8.201   5.283 -12.067
  286    HB3  ASP  35           HB1      ASP  35  -8.540   6.572 -10.912
  287    H    ASP  36           HN       ASP  36  -8.246   8.938 -14.517
  288    HA   ASP  36           HA       ASP  36  -8.794  11.082 -14.672
  289    HB2  ASP  36           HB2      ASP  36 -10.960  10.250 -13.968
  290    HB3  ASP  36           HB1      ASP  36 -10.496  10.399 -12.281
  291    H    GLY  37           HN       GLY  37  -6.495  11.265 -14.008
  292    HA2  GLY  37           HA2      GLY  37  -5.113  13.017 -13.337
  293    HA3  GLY  37           HA1      GLY  37  -6.417  13.607 -12.326
  294    H    GLU  38           HN       GLU  38  -6.610  10.858 -11.008
  295    HA   GLU  38           HA       GLU  38  -4.297  11.340  -9.350
  296    HB2  GLU  38           HB2      GLU  38  -5.589  10.299  -7.476
  297    HB3  GLU  38           HB1      GLU  38  -6.134  11.872  -8.028
  298    HG2  GLU  38           HG2      GLU  38  -7.946  10.717  -9.278
  299    HG3  GLU  38           HG1      GLU  38  -7.410   9.198  -8.550
  300    H    VAL  39           HN       VAL  39  -3.265   9.651  -8.267
  301    HA   VAL  39           HA       VAL  39  -3.177   7.322 -10.012
  302    HB   VAL  39           HB       VAL  39  -1.134   7.998  -7.913
  303   HG11  VAL  39          HG11      VAL  39  -0.986   6.384 -10.459
  304   HG12  VAL  39          HG12      VAL  39  -0.945   5.772  -8.823
  305   HG13  VAL  39          HG13      VAL  39   0.388   6.735  -9.429
  306   HG21  VAL  39          HG21      VAL  39   0.212   9.130  -9.687
  307   HG22  VAL  39          HG22      VAL  39  -1.244  10.003  -9.224
  308   HG23  VAL  39          HG23      VAL  39  -1.212   9.107 -10.733
  309    H    LEU  40           HN       LEU  40  -4.058   5.578  -9.338
  310    HA   LEU  40           HA       LEU  40  -4.580   5.259  -6.489
  311    HB2  LEU  40           HB2      LEU  40  -5.969   4.006  -8.856
  312    HB3  LEU  40           HB1      LEU  40  -6.381   3.763  -7.173
  313    HG   LEU  40           HG       LEU  40  -6.656   6.341  -8.713
  314   HD11  LEU  40          HD11      LEU  40  -8.725   4.429  -7.652
  315   HD12  LEU  40          HD12      LEU  40  -8.287   4.672  -9.343
  316   HD13  LEU  40          HD13      LEU  40  -9.051   5.978  -8.435
  317   HD21  LEU  40          HD21      LEU  40  -7.367   5.694  -5.845
  318   HD22  LEU  40          HD22      LEU  40  -7.790   7.179  -6.696
  319   HD23  LEU  40          HD23      LEU  40  -6.099   6.790  -6.390
  320    H    TYR  41           HN       TYR  41  -3.840   3.537  -5.557
  321    HA   TYR  41           HA       TYR  41  -2.105   1.805  -7.127
  322    HB2  TYR  41           HB2      TYR  41  -2.079   2.570  -4.209
  323    HB3  TYR  41           HB1      TYR  41  -1.050   1.331  -4.911
  324    HD1  TYR  41           HD2      TYR  41  -1.896   4.960  -5.316
  325    HD2  TYR  41           HD1      TYR  41   1.053   1.918  -5.631
  326    HE1  TYR  41           HE2      TYR  41  -0.220   6.650  -5.848
  327    HE2  TYR  41           HE1      TYR  41   2.745   3.626  -6.163
  328    HH   TYR  41           HH       TYR  41   2.765   5.863  -7.138
  329    H    LEU  42           HN       LEU  42  -2.272  -0.315  -6.788
  330    HA   LEU  42           HA       LEU  42  -4.703  -1.210  -5.427
  331    HB2  LEU  42           HB2      LEU  42  -4.093  -1.659  -7.975
  332    HB3  LEU  42           HB1      LEU  42  -3.000  -2.838  -7.290
  333    HG   LEU  42           HG       LEU  42  -5.991  -2.805  -7.263
  334   HD11  LEU  42          HD11      LEU  42  -3.990  -4.783  -8.262
  335   HD12  LEU  42          HD12      LEU  42  -5.045  -3.731  -9.213
  336   HD13  LEU  42          HD13      LEU  42  -5.734  -5.024  -8.229
  337   HD21  LEU  42          HD21      LEU  42  -5.942  -4.856  -5.881
  338   HD22  LEU  42          HD22      LEU  42  -5.435  -3.430  -5.007
  339   HD23  LEU  42          HD23      LEU  42  -4.223  -4.588  -5.578
  340    H    VAL  43           HN       VAL  43  -4.187  -2.177  -3.550
  341    HA   VAL  43           HA       VAL  43  -1.410  -3.022  -3.230
  342    HB   VAL  43           HB       VAL  43  -1.397  -2.234  -0.950
  343   HG11  VAL  43          HG11      VAL  43  -1.626   0.136  -1.206
  344   HG12  VAL  43          HG12      VAL  43  -2.561  -0.107  -2.679
  345   HG13  VAL  43          HG13      VAL  43  -0.875  -0.599  -2.628
  346   HG21  VAL  43          HG21      VAL  43  -4.294  -1.463  -1.368
  347   HG22  VAL  43          HG22      VAL  43  -3.345  -1.092   0.064
  348   HG23  VAL  43          HG23      VAL  43  -3.725  -2.770  -0.331
  349    H    HIS  44           HN       HIS  44  -1.046  -4.804  -2.005
  350    HA   HIS  44           HA       HIS  44  -3.365  -6.551  -1.552
  351    HB2  HIS  44           HB2      HIS  44  -1.899  -7.253  -3.455
  352    HB3  HIS  44           HB1      HIS  44  -0.537  -7.294  -2.342
  353    HD1  HIS  44           HD1      HIS  44  -0.083  -9.492  -1.311
  354    HD2  HIS  44           HD2      HIS  44  -3.966  -9.229  -2.737
  355    HE1  HIS  44           HE1      HIS  44  -1.069 -11.777  -1.011
  356    HE2  HIS  44           HE2      HIS  44  -3.441 -11.571  -1.808
  357    H    TYR  45           HN       TYR  45  -3.597  -6.977   0.530
  358    HA   TYR  45           HA       TYR  45  -1.848  -5.730   2.330
  359    HB2  TYR  45           HB2      TYR  45  -4.273  -7.423   2.874
  360    HB3  TYR  45           HB1      TYR  45  -3.430  -6.424   4.066
  361    HD1  TYR  45           HD2      TYR  45  -3.137  -3.986   3.542
  362    HD2  TYR  45           HD1      TYR  45  -5.938  -6.422   1.502
  363    HE1  TYR  45           HE2      TYR  45  -4.300  -1.981   2.774
  364    HE2  TYR  45           HE1      TYR  45  -7.111  -4.414   0.712
  365    HH   TYR  45           HH       TYR  45  -7.358  -2.011   1.404
  366    H    TYR  46           HN       TYR  46  -0.367  -6.359   3.580
  367    HA   TYR  46           HA       TYR  46   0.751  -8.974   3.058
  368    HB2  TYR  46           HB2      TYR  46   1.961  -6.714   2.858
  369    HB3  TYR  46           HB1      TYR  46   1.944  -6.677   4.610
  370    HD1  TYR  46           HD2      TYR  46   3.339  -8.262   1.636
  371    HD2  TYR  46           HD1      TYR  46   3.447  -8.135   5.886
  372    HE1  TYR  46           HE2      TYR  46   5.453  -9.499   1.606
  373    HE2  TYR  46           HE1      TYR  46   5.578  -9.372   5.866
  374    HH   TYR  46           HH       TYR  46   7.386  -9.775   3.030
  375    H    GLY  47           HN       GLY  47  -0.435 -10.338   4.360
  376    HA2  GLY  47           HA2      GLY  47  -0.278 -11.561   6.394
  377    HA3  GLY  47           HA1      GLY  47   0.087 -10.064   7.233
  378    H    TRP  48           HN       TRP  48  -2.058  -8.596   6.046
  379    HA   TRP  48           HA       TRP  48  -4.095  -9.384   7.944
  380    HB2  TRP  48           HB2      TRP  48  -3.310  -6.989   7.427
  381    HB3  TRP  48           HB1      TRP  48  -4.310  -7.093   5.988
  382    HD1  TRP  48           HD1      TRP  48  -6.873  -8.511   7.402
  383    HE1  TRP  48           HE1      TRP  48  -8.324  -7.108   9.002
  384    HE3  TRP  48           HE3      TRP  48  -3.522  -4.815   8.514
  385    HZ2  TRP  48           HZ2      TRP  48  -8.090  -4.729  10.497
  386    HZ3  TRP  48           HZ3      TRP  48  -4.219  -3.010  10.030
  387    HH2  TRP  48           HH2      TRP  48  -6.453  -2.969  10.998
  388    H    ASN  49           HN       ASN  49  -4.497  -8.339   4.555
  389    HA   ASN  49           HA       ASN  49  -6.501 -10.455   4.244
  390    HB2  ASN  49           HB2      ASN  49  -6.560  -7.623   3.186
  391    HB3  ASN  49           HB1      ASN  49  -7.591  -8.894   2.555
  392   HD21  ASN  49          HD21      ASN  49  -8.378  -6.401   3.813
  393   HD22  ASN  49          HD22      ASN  49  -9.292  -6.835   5.199
  394    H    VAL  50           HN       VAL  50  -5.567 -11.948   3.029
  395    HA   VAL  50           HA       VAL  50  -3.681 -11.124   0.981
  396    HB   VAL  50           HB       VAL  50  -3.126 -13.490   0.682
  397   HG11  VAL  50          HG11      VAL  50  -1.930 -12.183   2.342
  398   HG12  VAL  50          HG12      VAL  50  -2.089 -13.861   2.852
  399   HG13  VAL  50          HG13      VAL  50  -3.126 -12.623   3.564
  400   HG21  VAL  50          HG21      VAL  50  -5.188 -13.988   2.834
  401   HG22  VAL  50          HG22      VAL  50  -4.065 -15.194   2.206
  402   HG23  VAL  50          HG23      VAL  50  -5.297 -14.496   1.151
  403    H    ARG  51           HN       ARG  51  -6.944 -11.840   1.096
  404    HA   ARG  51           HA       ARG  51  -6.895 -12.437  -1.769
  405    HB2  ARG  51           HB2      ARG  51  -8.020 -14.158  -0.490
  406    HB3  ARG  51           HB1      ARG  51  -9.069 -12.968   0.262
  407    HG2  ARG  51           HG2      ARG  51 -10.231 -14.248  -1.465
  408    HG3  ARG  51           HG1      ARG  51 -10.146 -12.536  -1.879
  409    HD2  ARG  51           HD2      ARG  51  -8.195 -13.057  -3.340
  410    HD3  ARG  51           HD1      ARG  51  -8.437 -14.768  -2.991
  411    HE   ARG  51           HE       ARG  51 -10.837 -14.086  -3.864
  412   HH11  ARG  51          HH11      ARG  51  -7.649 -13.364  -5.287
  413   HH12  ARG  51          HH12      ARG  51  -8.255 -13.271  -6.879
  414   HH21  ARG  51          HH21      ARG  51 -11.614 -13.964  -6.052
  415   HH22  ARG  51          HH22      ARG  51 -10.532 -13.650  -7.323
  416    H    TYR  52           HN       TYR  52  -7.709 -10.058   0.513
  417    HA   TYR  52           HA       TYR  52  -9.650  -8.768  -1.168
  418    HB2  TYR  52           HB2      TYR  52  -9.440  -8.643   1.455
  419    HB3  TYR  52           HB1      TYR  52  -8.292  -7.351   1.112
  420    HD1  TYR  52           HD2      TYR  52  -9.596  -5.992  -1.177
  421    HD2  TYR  52           HD1      TYR  52 -11.307  -7.592   2.371
  422    HE1  TYR  52           HE2      TYR  52 -11.482  -4.447  -1.400
  423    HE2  TYR  52           HE1      TYR  52 -13.209  -6.044   2.155
  424    HH   TYR  52           HH       TYR  52 -13.669  -3.835   1.074
  425    H    ASP  53           HN       ASP  53  -8.974  -8.045  -2.944
  426    HA   ASP  53           HA       ASP  53  -6.406  -6.744  -3.414
  427    HB2  ASP  53           HB2      ASP  53  -7.496  -8.484  -4.924
  428    HB3  ASP  53           HB1      ASP  53  -8.787  -7.341  -5.211
  429    H    GLU  54           HN       GLU  54  -6.428  -4.505  -2.775
  430    HA   GLU  54           HA       GLU  54  -8.955  -3.095  -3.262
  431    HB2  GLU  54           HB2      GLU  54  -8.785  -3.870  -0.836
  432    HB3  GLU  54           HB1      GLU  54  -7.372  -2.838  -0.708
  433    HG2  GLU  54           HG2      GLU  54  -8.612  -0.882  -0.783
  434    HG3  GLU  54           HG1      GLU  54 -10.027  -1.687  -1.455
  435    H    TRP  55           HN       TRP  55  -8.879  -0.830  -3.379
  436    HA   TRP  55           HA       TRP  55  -6.361   0.101  -4.562
  437    HB2  TRP  55           HB2      TRP  55  -9.216   0.852  -5.127
  438    HB3  TRP  55           HB1      TRP  55  -7.826   1.670  -5.823
  439    HD1  TRP  55           HD1      TRP  55  -9.601  -1.743  -5.896
  440    HE1  TRP  55           HE1      TRP  55  -8.999  -2.907  -8.093
  441    HE3  TRP  55           HE3      TRP  55  -6.163   1.597  -7.632
  442    HZ2  TRP  55           HZ2      TRP  55  -7.271  -2.457 -10.305
  443    HZ3  TRP  55           HZ3      TRP  55  -5.075   1.165  -9.782
  444    HH2  TRP  55           HH2      TRP  55  -5.616  -0.819 -11.095
  445    H    VAL  56           HN       VAL  56  -5.427   1.812  -3.762
  446    HA   VAL  56           HA       VAL  56  -6.944   3.711  -2.174
  447    HB   VAL  56           HB       VAL  56  -5.190   3.836  -0.425
  448   HG11  VAL  56          HG11      VAL  56  -6.253   1.015  -0.689
  449   HG12  VAL  56          HG12      VAL  56  -7.167   2.397  -0.126
  450   HG13  VAL  56          HG13      VAL  56  -5.776   1.837   0.804
  451   HG21  VAL  56          HG21      VAL  56  -3.470   2.083  -0.239
  452   HG22  VAL  56          HG22      VAL  56  -3.286   3.012  -1.719
  453   HG23  VAL  56          HG23      VAL  56  -4.009   1.404  -1.773
  454    H    LYS  57           HN       LYS  57  -6.126   5.783  -2.251
  455    HA   LYS  57           HA       LYS  57  -4.548   6.377  -4.602
  456    HB2  LYS  57           HB2      LYS  57  -6.586   7.658  -4.001
  457    HB3  LYS  57           HB1      LYS  57  -5.815   8.179  -2.518
  458    HG2  LYS  57           HG2      LYS  57  -4.185   9.457  -3.799
  459    HG3  LYS  57           HG1      LYS  57  -4.910   8.883  -5.304
  460    HD2  LYS  57           HD2      LYS  57  -6.990  10.002  -4.788
  461    HD3  LYS  57           HD1      LYS  57  -6.386  10.476  -3.198
  462    HE2  LYS  57           HE2      LYS  57  -4.759  11.924  -4.186
  463    HE3  LYS  57           HE1      LYS  57  -5.127  11.344  -5.804
  464    HZ1  LYS  57           HZ1      LYS  57  -7.323  12.328  -5.614
  465    HZ2  LYS  57           HZ2      LYS  57  -6.133  13.491  -5.360
  466    HZ3  LYS  57           HZ3      LYS  57  -6.993  12.871  -4.052
  467    H    ALA  58           HN       ALA  58  -2.644   7.876  -4.479
  468    HA   ALA  58           HA       ALA  58  -0.593   6.988  -2.852
  469    HB1  ALA  58           HB1      ALA  58  -0.809   9.755  -4.016
  470    HB2  ALA  58           HB2      ALA  58  -0.387   8.326  -4.935
  471    HB3  ALA  58           HB3      ALA  58   0.681   8.879  -3.636
  472    H    ASP  59           HN       ASP  59  -2.835   9.563  -2.371
  473    HA   ASP  59           HA       ASP  59  -1.986  10.983  -0.130
  474    HB2  ASP  59           HB2      ASP  59  -3.913  11.687  -1.351
  475    HB3  ASP  59           HB1      ASP  59  -4.728  10.158  -1.077
  476    H    ARG  60           HN       ARG  60  -3.364   7.836  -0.354
  477    HA   ARG  60           HA       ARG  60  -4.043   7.683   2.481
  478    HB2  ARG  60           HB2      ARG  60  -4.600   5.854   0.150
  479    HB3  ARG  60           HB1      ARG  60  -5.277   5.692   1.771
  480    HG2  ARG  60           HG2      ARG  60  -5.658   8.171   0.132
  481    HG3  ARG  60           HG1      ARG  60  -6.716   6.771  -0.038
  482    HD2  ARG  60           HD2      ARG  60  -6.212   7.848   2.686
  483    HD3  ARG  60           HD1      ARG  60  -7.306   8.736   1.613
  484    HE   ARG  60           HE       ARG  60  -7.671   5.888   1.987
  485   HH11  ARG  60          HH11      ARG  60  -8.766   9.120   2.898
  486   HH12  ARG  60          HH12      ARG  60 -10.409   8.692   3.063
  487   HH21  ARG  60          HH21      ARG  60  -9.946   5.322   2.082
  488   HH22  ARG  60          HH22      ARG  60 -11.108   6.499   2.560
  489    H    ILE  61           HN       ILE  61  -1.277   7.247   0.812
  490    HA   ILE  61           HA       ILE  61  -0.732   4.725   2.126
  491    HB   ILE  61           HB       ILE  61   0.580   5.864  -0.356
  492   HG12  ILE  61          HG12      ILE  61  -1.352   3.579   0.049
  493   HG13  ILE  61          HG11      ILE  61  -1.685   5.096  -0.772
  494   HG21  ILE  61          HG21      ILE  61   0.945   3.214   1.013
  495   HG22  ILE  61          HG22      ILE  61   2.122   4.539   0.997
  496   HG23  ILE  61          HG23      ILE  61   1.705   3.701  -0.507
  497   HD11  ILE  61          HD11      ILE  61   0.238   2.976  -1.642
  498   HD12  ILE  61          HD12      ILE  61  -0.060   4.500  -2.497
  499   HD13  ILE  61          HD13      ILE  61  -1.346   3.296  -2.340
  500    H    ILE  62           HN       ILE  62   1.036   4.510   3.351
  501    HA   ILE  62           HA       ILE  62   2.653   6.877   3.974
  502    HB   ILE  62           HB       ILE  62   2.312   4.295   5.511
  503   HG12  ILE  62          HG12      ILE  62   1.311   5.662   7.343
  504   HG13  ILE  62          HG11      ILE  62   1.201   7.037   6.240
  505   HG21  ILE  62          HG21      ILE  62   3.863   6.759   6.274
  506   HG22  ILE  62          HG22      ILE  62   4.513   5.191   5.810
  507   HG23  ILE  62          HG23      ILE  62   3.611   5.355   7.318
  508   HD11  ILE  62          HD11      ILE  62  -0.354   5.687   4.858
  509   HD12  ILE  62          HD12      ILE  62  -0.941   5.933   6.500
  510   HD13  ILE  62          HD13      ILE  62  -0.237   4.383   6.039
  511    H    TRP  63           HN       TRP  63   4.354   6.743   2.654
  512    HA   TRP  63           HA       TRP  63   5.414   4.192   1.829
  513    HB2  TRP  63           HB2      TRP  63   6.168   7.039   1.137
  514    HB3  TRP  63           HB1      TRP  63   6.996   5.629   0.480
  515    HD1  TRP  63           HD1      TRP  63   3.689   7.542   0.244
  516    HE1  TRP  63           HE1      TRP  63   2.427   6.740  -1.837
  517    HE3  TRP  63           HE3      TRP  63   6.711   3.649  -1.066
  518    HZ2  TRP  63           HZ2      TRP  63   2.677   4.708  -3.781
  519    HZ3  TRP  63           HZ3      TRP  63   6.129   2.319  -3.057
  520    HH2  TRP  63           HH2      TRP  63   4.155   2.834  -4.377
  521    HA   PRO  64           HA       PRO  64   8.700   4.084   4.833
  522    HB2  PRO  64           HB2      PRO  64  10.592   3.381   2.656
  523    HB3  PRO  64           HB1      PRO  64  10.189   2.465   4.111
  524    HG2  PRO  64           HG2      PRO  64   9.329   1.668   1.711
  525    HG3  PRO  64           HG1      PRO  64   8.310   1.508   3.153
  526    HD2  PRO  64           HD2      PRO  64   8.184   3.552   0.972
  527    HD3  PRO  64           HD1      PRO  64   6.866   2.711   1.815
  528    H    LEU  65           HN       LEU  65   9.553   5.920   5.546
  529    HA   LEU  65           HA       LEU  65  11.221   7.601   3.881
  530    HB2  LEU  65           HB2      LEU  65   8.570   8.394   5.022
  531    HB3  LEU  65           HB1      LEU  65   9.848   9.572   4.823
  532    HG   LEU  65           HG       LEU  65   8.737   7.930   2.543
  533   HD11  LEU  65          HD11      LEU  65   7.517   9.951   1.927
  534   HD12  LEU  65          HD12      LEU  65   8.125  10.760   3.372
  535   HD13  LEU  65          HD13      LEU  65   7.016   9.395   3.529
  536   HD21  LEU  65          HD21      LEU  65   9.871   9.699   1.210
  537   HD22  LEU  65          HD22      LEU  65  10.978   8.738   2.195
  538   HD23  LEU  65          HD23      LEU  65  10.530  10.344   2.722
  539    H    ASP  66           HN       ASP  66  11.836   9.516   5.202
  540    HA   ASP  66           HA       ASP  66  13.333   8.618   7.415
  541    HB2  ASP  66           HB2      ASP  66  14.026  10.331   5.800
  542    HB3  ASP  66           HB1      ASP  66  12.768  11.386   6.385
  543    H    LYS  67           HN       LYS  67  11.560   7.859   8.494
  544    HA   LYS  67           HA       LYS  67  10.442   9.783  10.447
  545    HB2  LYS  67           HB2      LYS  67   8.789   8.951   8.673
  546    HB3  LYS  67           HB1      LYS  67   8.969   7.358   9.366
  547    HG2  LYS  67           HG2      LYS  67   7.908   9.740  10.895
  548    HG3  LYS  67           HG1      LYS  67   6.899   8.616  10.006
  549    HD2  LYS  67           HD2      LYS  67   7.683   6.785  11.442
  550    HD3  LYS  67           HD1      LYS  67   8.699   7.920  12.326
  551    HE2  LYS  67           HE2      LYS  67   6.630   7.501  13.537
  552    HE3  LYS  67           HE1      LYS  67   6.697   9.176  12.999
  553    HZ1  LYS  67           HZ1      LYS  67   5.219   7.006  11.617
  554    HZ2  LYS  67           HZ2      LYS  67   5.180   8.646  11.199
  555    HZ3  LYS  67           HZ3      LYS  67   4.522   8.121  12.656
  556    H    GLY  68           HN       GLY  68  11.607   6.547   9.719
  557    HA2  GLY  68           HA2      GLY  68  13.027   5.918  11.847
  558    HA3  GLY  68           HA1      GLY  68  11.411   5.749  12.529
  559    H    LEU  69           HN       LEU  69  10.306   4.804  10.004
  560    HA   LEU  69           HA       LEU  69  11.102   2.026  10.263
  561    HB2  LEU  69           HB2      LEU  69   8.935   3.325   8.587
  562    HB3  LEU  69           HB1      LEU  69   9.261   1.608   8.574
  563    HG   LEU  69           HG       LEU  69   7.347   1.955   9.921
  564   HD11  LEU  69          HD11      LEU  69   8.844   0.281  10.767
  565   HD12  LEU  69          HD12      LEU  69   7.992   1.084  12.086
  566   HD13  LEU  69          HD13      LEU  69   9.672   1.488  11.755
  567   HD21  LEU  69          HD21      LEU  69   8.916   3.966  11.540
  568   HD22  LEU  69          HD22      LEU  69   7.273   3.422  11.888
  569   HD23  LEU  69          HD23      LEU  69   7.612   4.339  10.416
  570    H    GLU  70           HN       GLU  70  12.191   4.561   8.675
  571    HA   GLU  70           HA       GLU  70  13.913   3.088   7.006
  572    HB2  GLU  70           HB2      GLU  70  11.837   3.479   5.571
  573    HB3  GLU  70           HB1      GLU  70  12.046   5.194   5.831
  574    HG2  GLU  70           HG2      GLU  70  14.080   3.457   4.427
  575    HG3  GLU  70           HG1      GLU  70  12.788   4.305   3.594
  576    H    HIS  71           HN       HIS  71  15.775   4.248   7.076
  577    HA   HIS  71           HA       HIS  71  15.753   7.042   7.410
  578    HB2  HIS  71           HB2      HIS  71  17.174   7.154   9.466
  579    HB3  HIS  71           HB1      HIS  71  15.577   6.512   9.795
  580    HD1  HIS  71           HD1      HIS  71  19.186   5.785  10.105
  581    HD2  HIS  71           HD2      HIS  71  15.597   3.707  10.417
  582    HE1  HIS  71           HE1      HIS  71  19.731   3.688  11.312
  583    HE2  HIS  71           HE2      HIS  71  17.637   2.346  11.271
  584    H    HIS  72           HN       HIS  72  16.701   7.243   5.664
  585    HA   HIS  72           HA       HIS  72  18.728   5.994   4.379
  586    HB2  HIS  72           HB2      HIS  72  19.297   8.208   3.323
  587    HB3  HIS  72           HB1      HIS  72  17.601   7.750   3.246
  588    HD1  HIS  72           HD1      HIS  72  19.912  10.297   4.721
  589    HD2  HIS  72           HD2      HIS  72  15.873   9.371   4.746
  590    HE1  HIS  72           HE1      HIS  72  18.785  12.239   5.816
  591    HE2  HIS  72           HE2      HIS  72  16.491  11.338   6.238
  592    H    HIS  73           HN       HIS  73  19.162   8.061   7.141
  593    HA   HIS  73           HA       HIS  73  22.031   8.129   6.807
  594    HB2  HIS  73           HB2      HIS  73  20.842  10.064   7.804
  595    HB3  HIS  73           HB1      HIS  73  20.294   9.040   9.119
  596    HD1  HIS  73           HD1      HIS  73  23.294  10.848   7.845
  597    HD2  HIS  73           HD2      HIS  73  22.259   8.473  11.083
  598    HE1  HIS  73           HE1      HIS  73  25.142  11.126   9.485
  599    HE2  HIS  73           HE2      HIS  73  24.460   9.760  11.488
  600    H    HIS  74           HN       HIS  74  23.095   6.307   7.179
  601    HA   HIS  74           HA       HIS  74  22.364   4.724   9.553
  602    HB2  HIS  74           HB2      HIS  74  23.710   3.762   7.002
  603    HB3  HIS  74           HB1      HIS  74  23.403   2.784   8.417
  604    HD1  HIS  74           HD1      HIS  74  21.198   1.565   8.483
  605    HD2  HIS  74           HD2      HIS  74  21.328   4.486   5.538
  606    HE1  HIS  74           HE1      HIS  74  19.119   1.246   7.122
  607    HE2  HIS  74           HE2      HIS  74  19.146   3.128   5.465
  608    H    HIS  75           HN       HIS  75  24.083   4.267  10.949
  609    HA   HIS  75           HA       HIS  75  26.568   5.650  10.470
  610    HB2  HIS  75           HB2      HIS  75  25.709   5.393  12.797
  611    HB3  HIS  75           HB1      HIS  75  25.832   3.647  12.652
  612    HD1  HIS  75           HD1      HIS  75  28.027   2.644  13.462
  613    HD2  HIS  75           HD2      HIS  75  28.338   6.709  12.629
  614    HE1  HIS  75           HE1      HIS  75  30.329   3.309  14.147
  615    HE2  HIS  75           HE2      HIS  75  30.441   5.779  13.781
  616    H    HIS  76           HN       HIS  76  25.231   2.513  10.148
  617    HA   HIS  76           HA       HIS  76  27.642   1.588   8.806
  618    HB2  HIS  76           HB2      HIS  76  27.369   0.299  10.845
  619    HB3  HIS  76           HB1      HIS  76  25.658   0.061  10.517
  620    HD1  HIS  76           HD1      HIS  76  29.058  -1.089   9.391
  621    HD2  HIS  76           HD2      HIS  76  25.074  -2.101   8.918
  622    HE1  HIS  76           HE1      HIS  76  29.054  -3.350   8.297
  623    HE2  HIS  76           HE2      HIS  76  26.679  -3.633   7.638
  Start of MODEL   19
    1    H1   GLU   1           HT1      GLU   1  23.435 -12.761 -12.033
    2    H2   GLU   1           HT2      GLU   1  21.903 -13.217 -11.545
    3    H3   GLU   1           HT3      GLU   1  23.257 -13.742 -10.664
    4    HA   GLU   1           HA       GLU   1  22.134 -11.942  -9.529
    5    HB2  GLU   1           HB2      GLU   1  24.542 -12.064  -9.269
    6    HB3  GLU   1           HB1      GLU   1  24.786 -11.214 -10.786
    7    HG2  GLU   1           HG2      GLU   1  23.547  -9.278  -9.753
    8    HG3  GLU   1           HG1      GLU   1  23.658 -10.146  -8.229
    9    H    ASP   2           HN       ASP   2  20.630 -10.404  -9.900
   10    HA   ASP   2           HA       ASP   2  21.161  -8.081 -11.324
   11    HB2  ASP   2           HB2      ASP   2  20.719  -9.625 -13.306
   12    HB3  ASP   2           HB1      ASP   2  19.065  -9.766 -12.721
   13    H    MET   3           HN       MET   3  20.267  -6.845  -9.847
   14    HA   MET   3           HA       MET   3  17.889  -7.720  -8.459
   15    HB2  MET   3           HB2      MET   3  18.121  -5.737  -7.058
   16    HB3  MET   3           HB1      MET   3  19.664  -6.563  -7.172
   17    HG2  MET   3           HG2      MET   3  20.465  -4.902  -8.750
   18    HG3  MET   3           HG1      MET   3  18.891  -4.117  -8.754
   19    HE1  MET   3           HE1      MET   3  21.180  -1.539  -6.894
   20    HE2  MET   3           HE2      MET   3  20.080  -1.800  -8.249
   21    HE3  MET   3           HE3      MET   3  21.653  -2.600  -8.221
   22    H    GLU   4           HN       GLU   4  15.905  -6.932  -8.683
   23    HA   GLU   4           HA       GLU   4  15.507  -4.936 -10.779
   24    HB2  GLU   4           HB2      GLU   4  13.762  -7.252  -9.966
   25    HB3  GLU   4           HB1      GLU   4  13.261  -5.980 -11.069
   26    HG2  GLU   4           HG2      GLU   4  14.931  -6.615 -12.645
   27    HG3  GLU   4           HG1      GLU   4  15.618  -7.785 -11.516
   28    HA   PRO   5           HA       PRO   5  14.010  -2.890  -6.979
   29    HB2  PRO   5           HB2      PRO   5  14.450  -0.511  -8.684
   30    HB3  PRO   5           HB1      PRO   5  15.075  -0.846  -7.065
   31    HG2  PRO   5           HG2      PRO   5  16.689  -0.896  -9.189
   32    HG3  PRO   5           HG1      PRO   5  16.872  -2.064  -7.865
   33    HD2  PRO   5           HD2      PRO   5  15.550  -2.443 -10.537
   34    HD3  PRO   5           HD1      PRO   5  16.672  -3.520  -9.682
   35    H    CYS   6           HN       CYS   6  11.870  -3.014  -6.874
   36    HA   CYS   6           HA       CYS   6  10.264  -1.832  -9.006
   37    HB2  CYS   6           HB2      CYS   6   9.706  -4.488  -7.675
   38    HB3  CYS   6           HB1      CYS   6   8.773  -3.745  -8.964
   39    HG   CYS   6           HG       CYS   6  11.874  -5.079  -9.113
   40    H    LEU   7           HN       LEU   7   8.466  -0.726  -8.186
   41    HA   LEU   7           HA       LEU   7   8.243  -0.496  -5.330
   42    HB2  LEU   7           HB2      LEU   7   6.470   1.076  -5.608
   43    HB3  LEU   7           HB1      LEU   7   7.584   1.401  -6.910
   44    HG   LEU   7           HG       LEU   7   4.972  -0.103  -7.203
   45   HD11  LEU   7          HD11      LEU   7   4.618   2.203  -6.562
   46   HD12  LEU   7          HD12      LEU   7   4.120   1.939  -8.233
   47   HD13  LEU   7          HD13      LEU   7   5.647   2.752  -7.885
   48   HD21  LEU   7          HD21      LEU   7   6.573  -0.692  -8.930
   49   HD22  LEU   7          HD22      LEU   7   6.870   1.011  -9.270
   50   HD23  LEU   7          HD23      LEU   7   5.285   0.304  -9.612
   51    H    THR   8           HN       THR   8   6.857  -2.379  -7.800
   52    HA   THR   8           HA       THR   8   4.689  -3.502  -6.458
   53    HB   THR   8           HB       THR   8   6.525  -4.665  -8.547
   54    HG1  THR   8           HG1      THR   8   4.195  -3.038  -8.705
   55   HG21  THR   8          HG21      THR   8   3.637  -5.298  -7.881
   56   HG22  THR   8          HG22      THR   8   5.016  -6.323  -7.495
   57   HG23  THR   8          HG23      THR   8   4.576  -6.030  -9.180
   58    H    GLY   9           HN       GLY   9   4.715  -4.836  -4.779
   59    HA2  GLY   9           HA2      GLY   9   5.460  -6.715  -3.568
   60    HA3  GLY   9           HA1      GLY   9   7.057  -6.524  -4.285
   61    H    THR  10           HN       THR  10   6.469  -3.491  -3.570
   62    HA   THR  10           HA       THR  10   7.967  -3.583  -1.124
   63    HB   THR  10           HB       THR  10   6.690  -1.301  -2.600
   64    HG1  THR  10           HG1      THR  10   8.411  -2.434  -3.730
   65   HG21  THR  10          HG21      THR  10   8.753  -1.234  -0.383
   66   HG22  THR  10          HG22      THR  10   7.077  -0.661  -0.304
   67   HG23  THR  10          HG23      THR  10   8.238   0.164  -1.334
   68    H    LYS  11           HN       LYS  11   7.202  -3.417   0.840
   69    HA   LYS  11           HA       LYS  11   4.332  -3.390   1.225
   70    HB2  LYS  11           HB2      LYS  11   4.788  -3.977   3.566
   71    HB3  LYS  11           HB1      LYS  11   5.524  -5.111   2.447
   72    HG2  LYS  11           HG2      LYS  11   7.711  -4.056   2.818
   73    HG3  LYS  11           HG1      LYS  11   6.962  -2.897   3.912
   74    HD2  LYS  11           HD2      LYS  11   7.009  -5.891   4.313
   75    HD3  LYS  11           HD1      LYS  11   8.089  -4.744   5.103
   76    HE2  LYS  11           HE2      LYS  11   5.075  -4.774   5.384
   77    HE3  LYS  11           HE1      LYS  11   6.220  -5.447   6.534
   78    HZ1  LYS  11           HZ1      LYS  11   5.427  -3.228   7.162
   79    HZ2  LYS  11           HZ2      LYS  11   6.106  -2.570   5.773
   80    HZ3  LYS  11           HZ3      LYS  11   7.096  -3.245   6.941
   81    H    VAL  12           HN       VAL  12   3.303  -1.649   1.478
   82    HA   VAL  12           HA       VAL  12   4.622   0.669   2.706
   83    HB   VAL  12           HB       VAL  12   2.922   2.031   1.585
   84   HG11  VAL  12          HG11      VAL  12   3.673   1.720  -0.721
   85   HG12  VAL  12          HG12      VAL  12   4.320   0.137  -0.287
   86   HG13  VAL  12          HG13      VAL  12   5.004   1.598   0.428
   87   HG21  VAL  12          HG21      VAL  12   1.963  -0.555   0.339
   88   HG22  VAL  12          HG22      VAL  12   1.334   1.069   0.000
   89   HG23  VAL  12          HG23      VAL  12   1.119   0.349   1.590
   90    H    LYS  13           HN       LYS  13   2.722   2.117   3.691
   91    HA   LYS  13           HA       LYS  13   1.000   0.267   5.150
   92    HB2  LYS  13           HB2      LYS  13   2.788   1.657   6.430
   93    HB3  LYS  13           HB1      LYS  13   1.687   3.000   6.138
   94    HG2  LYS  13           HG2      LYS  13  -0.104   1.838   7.255
   95    HG3  LYS  13           HG1      LYS  13   0.937   0.455   7.546
   96    HD2  LYS  13           HD2      LYS  13   1.035   3.192   8.774
   97    HD3  LYS  13           HD1      LYS  13   0.950   1.580   9.516
   98    HE2  LYS  13           HE2      LYS  13   3.249   1.145   8.624
   99    HE3  LYS  13           HE1      LYS  13   3.238   2.842   8.116
  100    HZ1  LYS  13           HZ1      LYS  13   3.065   3.546  10.402
  101    HZ2  LYS  13           HZ2      LYS  13   4.374   2.493  10.300
  102    HZ3  LYS  13           HZ3      LYS  13   2.937   1.963  10.941
  103    H    VAL  14           HN       VAL  14  -1.142   0.810   5.227
  104    HA   VAL  14           HA       VAL  14  -1.890   2.986   3.450
  105    HB   VAL  14           HB       VAL  14  -3.194   0.264   3.812
  106   HG11  VAL  14          HG11      VAL  14  -4.885   1.987   3.548
  107   HG12  VAL  14          HG12      VAL  14  -4.769   0.953   2.120
  108   HG13  VAL  14          HG13      VAL  14  -4.065   2.572   2.098
  109   HG21  VAL  14          HG21      VAL  14  -1.846   1.521   1.412
  110   HG22  VAL  14          HG22      VAL  14  -2.657  -0.041   1.437
  111   HG23  VAL  14          HG23      VAL  14  -1.206   0.210   2.403
  112    H    LYS  15           HN       LYS  15  -3.168   4.408   4.240
  113    HA   LYS  15           HA       LYS  15  -4.494   4.045   6.850
  114    HB2  LYS  15           HB2      LYS  15  -2.903   5.949   6.530
  115    HB3  LYS  15           HB1      LYS  15  -3.926   6.548   5.225
  116    HG2  LYS  15           HG2      LYS  15  -5.756   6.638   7.054
  117    HG3  LYS  15           HG1      LYS  15  -4.395   6.533   8.178
  118    HD2  LYS  15           HD2      LYS  15  -3.353   8.482   7.082
  119    HD3  LYS  15           HD1      LYS  15  -4.747   8.612   6.013
  120    HE2  LYS  15           HE2      LYS  15  -5.134  10.202   7.690
  121    HE3  LYS  15           HE1      LYS  15  -6.135   8.827   8.142
  122    HZ1  LYS  15           HZ1      LYS  15  -4.982   9.706  10.043
  123    HZ2  LYS  15           HZ2      LYS  15  -3.497   9.531   9.272
  124    HZ3  LYS  15           HZ3      LYS  15  -4.361   8.168   9.734
  125    H    TYR  16           HN       TYR  16  -6.484   3.252   6.427
  126    HA   TYR  16           HA       TYR  16  -7.887   4.105   3.992
  127    HB2  TYR  16           HB2      TYR  16  -7.225   1.690   4.450
  128    HB3  TYR  16           HB1      TYR  16  -8.414   1.712   5.734
  129    HD1  TYR  16           HD2      TYR  16  -7.852   1.749   2.146
  130    HD2  TYR  16           HD1      TYR  16 -10.799   1.622   5.200
  131    HE1  TYR  16           HE2      TYR  16  -9.497   0.994   0.504
  132    HE2  TYR  16           HE1      TYR  16 -12.458   0.838   3.557
  133    HH   TYR  16           HH       TYR  16 -11.559  -0.451   0.712
  134    H    GLY  17           HN       GLY  17  -9.243   5.747   4.528
  135    HA2  GLY  17           HA2      GLY  17 -10.674   5.539   7.071
  136    HA3  GLY  17           HA1      GLY  17 -10.200   7.056   6.327
  137    H    ARG  18           HN       ARG  18 -12.631   4.945   6.831
  138    HA   ARG  18           HA       ARG  18 -14.393   6.461   5.105
  139    HB2  ARG  18           HB2      ARG  18 -14.038   4.543   3.710
  140    HB3  ARG  18           HB1      ARG  18 -14.119   3.448   5.076
  141    HG2  ARG  18           HG2      ARG  18 -16.460   3.719   5.282
  142    HG3  ARG  18           HG1      ARG  18 -16.523   5.031   4.087
  143    HD2  ARG  18           HD2      ARG  18 -17.275   3.000   3.074
  144    HD3  ARG  18           HD1      ARG  18 -15.667   3.332   2.428
  145    HE   ARG  18           HE       ARG  18 -16.089   1.517   4.685
  146   HH11  ARG  18          HH11      ARG  18 -14.618   2.148   1.516
  147   HH12  ARG  18          HH12      ARG  18 -13.873   0.632   1.410
  148   HH21  ARG  18          HH21      ARG  18 -15.134  -0.615   4.479
  149   HH22  ARG  18          HH22      ARG  18 -14.211  -0.988   3.103
  150    H    GLY  19           HN       GLY  19 -15.502   7.380   6.706
  151    HA2  GLY  19           HA2      GLY  19 -16.712   7.679   8.647
  152    HA3  GLY  19           HA1      GLY  19 -17.521   6.219   8.115
  153    H    LYS  20           HN       LYS  20 -17.500   4.569   9.455
  154    HA   LYS  20           HA       LYS  20 -15.789   4.669  11.817
  155    HB2  LYS  20           HB2      LYS  20 -18.209   4.400  12.137
  156    HB3  LYS  20           HB1      LYS  20 -18.189   2.936  11.173
  157    HG2  LYS  20           HG2      LYS  20 -18.322   2.393  13.520
  158    HG3  LYS  20           HG1      LYS  20 -16.773   1.861  12.863
  159    HD2  LYS  20           HD2      LYS  20 -15.711   3.873  13.799
  160    HD3  LYS  20           HD1      LYS  20 -17.264   4.351  14.494
  161    HE2  LYS  20           HE2      LYS  20 -17.297   2.302  15.818
  162    HE3  LYS  20           HE1      LYS  20 -15.771   1.805  15.092
  163    HZ1  LYS  20           HZ1      LYS  20 -16.184   4.178  16.833
  164    HZ2  LYS  20           HZ2      LYS  20 -14.747   3.779  16.070
  165    HZ3  LYS  20           HZ3      LYS  20 -15.361   2.760  17.239
  166    H    THR  21           HN       THR  21 -15.925   3.151   8.822
  167    HA   THR  21           HA       THR  21 -14.773   0.596   9.603
  168    HB   THR  21           HB       THR  21 -14.928   0.006   7.227
  169    HG1  THR  21           HG1      THR  21 -15.261   2.787   6.961
  170   HG21  THR  21          HG21      THR  21 -17.052  -0.065   8.496
  171   HG22  THR  21          HG22      THR  21 -17.280   0.376   6.783
  172   HG23  THR  21          HG23      THR  21 -17.325   1.621   8.008
  173    H    GLN  22           HN       GLN  22 -13.283   3.109  10.039
  174    HA   GLN  22           HA       GLN  22 -11.094   3.146   8.154
  175    HB2  GLN  22           HB2      GLN  22 -11.788   5.271   9.056
  176    HB3  GLN  22           HB1      GLN  22 -11.594   4.693  10.701
  177    HG2  GLN  22           HG2      GLN  22  -9.183   4.572  10.405
  178    HG3  GLN  22           HG1      GLN  22  -9.337   5.063   8.724
  179   HE21  GLN  22          HE21      GLN  22  -9.723   7.214   8.258
  180   HE22  GLN  22          HE22      GLN  22  -9.602   8.459   9.436
  181    H    LYS  23           HN       LYS  23  -9.094   2.338   8.423
  182    HA   LYS  23           HA       LYS  23  -8.023   1.621  10.917
  183    HB2  LYS  23           HB2      LYS  23  -7.629  -0.814  10.483
  184    HB3  LYS  23           HB1      LYS  23  -9.332  -0.452  10.675
  185    HG2  LYS  23           HG2      LYS  23  -8.081  -0.704   7.984
  186    HG3  LYS  23           HG1      LYS  23  -8.617  -2.110   8.900
  187    HD2  LYS  23           HD2      LYS  23 -10.868  -1.153   9.031
  188    HD3  LYS  23           HD1      LYS  23 -10.322   0.240   8.097
  189    HE2  LYS  23           HE2      LYS  23  -9.758  -1.197   6.259
  190    HE3  LYS  23           HE1      LYS  23 -10.234  -2.604   7.219
  191    HZ1  LYS  23           HZ1      LYS  23 -11.943  -1.829   5.594
  192    HZ2  LYS  23           HZ2      LYS  23 -12.146  -0.426   6.557
  193    HZ3  LYS  23           HZ3      LYS  23 -12.473  -1.942   7.176
  194    H    ILE  24           HN       ILE  24  -5.813   0.925  10.730
  195    HA   ILE  24           HA       ILE  24  -4.661   1.758   8.184
  196    HB   ILE  24           HB       ILE  24  -3.529   2.096  11.001
  197   HG12  ILE  24          HG12      ILE  24  -3.303   4.533  10.332
  198   HG13  ILE  24          HG11      ILE  24  -4.231   4.185   8.893
  199   HG21  ILE  24          HG21      ILE  24  -1.517   3.064   9.986
  200   HG22  ILE  24          HG22      ILE  24  -2.130   2.610   8.393
  201   HG23  ILE  24          HG23      ILE  24  -1.743   1.365   9.576
  202   HD11  ILE  24          HD11      ILE  24  -6.155   3.580  10.314
  203   HD12  ILE  24          HD12      ILE  24  -5.608   5.227  10.611
  204   HD13  ILE  24          HD13      ILE  24  -5.194   3.943  11.746
  205    H    TYR  25           HN       TYR  25  -3.459   0.287   7.203
  206    HA   TYR  25           HA       TYR  25  -2.382  -1.931   8.677
  207    HB2  TYR  25           HB2      TYR  25  -3.349  -3.508   6.767
  208    HB3  TYR  25           HB1      TYR  25  -4.291  -3.176   8.216
  209    HD1  TYR  25           HD2      TYR  25  -3.819  -0.988   5.241
  210    HD2  TYR  25           HD1      TYR  25  -6.400  -3.554   7.409
  211    HE1  TYR  25           HE2      TYR  25  -5.695  -0.336   3.774
  212    HE2  TYR  25           HE1      TYR  25  -8.267  -2.920   5.964
  213    HH   TYR  25           HH       TYR  25  -7.850  -1.448   3.069
  214    H    GLU  26           HN       GLU  26  -1.118  -3.386   7.218
  215    HA   GLU  26           HA       GLU  26   0.358  -1.623   5.404
  216    HB2  GLU  26           HB2      GLU  26   1.296  -3.962   7.067
  217    HB3  GLU  26           HB1      GLU  26   2.297  -3.076   5.906
  218    HG2  GLU  26           HG2      GLU  26   2.158  -1.114   7.204
  219    HG3  GLU  26           HG1      GLU  26   0.975  -1.843   8.292
  220    H    ALA  27           HN       ALA  27   0.850  -2.342   3.379
  221    HA   ALA  27           HA       ALA  27  -0.046  -4.987   2.570
  222    HB1  ALA  27           HB1      ALA  27  -1.062  -2.430   1.342
  223    HB2  ALA  27           HB2      ALA  27  -2.012  -3.569   2.306
  224    HB3  ALA  27           HB3      ALA  27  -1.376  -4.059   0.737
  225    H    SER  28           HN       SER  28   0.693  -5.438   0.346
  226    HA   SER  28           HA       SER  28   3.177  -4.006  -0.199
  227    HB2  SER  28           HB2      SER  28   2.272  -6.679  -1.260
  228    HB3  SER  28           HB1      SER  28   3.913  -6.025  -1.200
  229    HG   SER  28           HG       SER  28   4.097  -6.878   0.700
  230    H    ILE  29           HN       ILE  29   3.443  -3.061  -2.158
  231    HA   ILE  29           HA       ILE  29   1.132  -2.365  -3.628
  232    HB   ILE  29           HB       ILE  29   4.039  -1.981  -4.401
  233   HG12  ILE  29          HG12      ILE  29   3.588  -0.880  -2.316
  234   HG13  ILE  29          HG11      ILE  29   3.657   0.342  -3.574
  235   HG21  ILE  29          HG21      ILE  29   3.216  -0.196  -5.891
  236   HG22  ILE  29          HG22      ILE  29   1.558  -0.649  -5.499
  237   HG23  ILE  29          HG23      ILE  29   2.601  -1.782  -6.361
  238   HD11  ILE  29          HD11      ILE  29   1.823   0.844  -2.106
  239   HD12  ILE  29          HD12      ILE  29   1.184  -0.783  -2.272
  240   HD13  ILE  29          HD13      ILE  29   1.156   0.314  -3.653
  241    H    LYS  30           HN       LYS  30   0.164  -3.233  -5.277
  242    HA   LYS  30           HA       LYS  30   1.330  -5.625  -6.482
  243    HB2  LYS  30           HB2      LYS  30  -0.893  -5.801  -5.405
  244    HB3  LYS  30           HB1      LYS  30  -1.474  -4.524  -6.446
  245    HG2  LYS  30           HG2      LYS  30  -2.313  -6.573  -7.292
  246    HG3  LYS  30           HG1      LYS  30  -1.047  -6.040  -8.397
  247    HD2  LYS  30           HD2      LYS  30   0.501  -7.619  -7.404
  248    HD3  LYS  30           HD1      LYS  30  -0.703  -8.078  -6.207
  249    HE2  LYS  30           HE2      LYS  30  -0.664  -9.732  -7.994
  250    HE3  LYS  30           HE1      LYS  30  -2.190  -8.838  -7.956
  251    HZ1  LYS  30           HZ1      LYS  30  -1.277  -9.181 -10.207
  252    HZ2  LYS  30           HZ2      LYS  30   0.035  -8.231  -9.836
  253    HZ3  LYS  30           HZ3      LYS  30  -1.525  -7.567  -9.848
  254    H    SER  31           HN       SER  31  -0.717  -2.808  -7.449
  255    HA   SER  31           HA       SER  31   0.953  -2.389  -9.776
  256    HB2  SER  31           HB2      SER  31  -2.035  -2.896  -9.950
  257    HB3  SER  31           HB1      SER  31  -0.987  -2.444 -11.294
  258    HG   SER  31           HG       SER  31  -1.405  -4.688 -11.203
  259    H    THR  32           HN       THR  32   0.382  -0.237 -10.784
  260    HA   THR  32           HA       THR  32  -1.162   1.499  -8.969
  261    HB   THR  32           HB       THR  32   0.994   2.626 -10.659
  262    HG1  THR  32           HG1      THR  32   1.925   0.800  -9.371
  263   HG21  THR  32          HG21      THR  32  -0.045   3.255  -7.920
  264   HG22  THR  32          HG22      THR  32  -0.458   4.073  -9.432
  265   HG23  THR  32          HG23      THR  32   1.184   4.175  -8.783
  266    H    GLU  33           HN       GLU  33  -2.527   2.859 -10.044
  267    HA   GLU  33           HA       GLU  33  -2.406   2.959 -12.940
  268    HB2  GLU  33           HB2      GLU  33  -4.814   1.888 -11.495
  269    HB3  GLU  33           HB1      GLU  33  -4.853   2.514 -13.137
  270    HG2  GLU  33           HG2      GLU  33  -3.244   0.833 -13.824
  271    HG3  GLU  33           HG1      GLU  33  -3.215   0.171 -12.190
  272    H    ILE  34           HN       ILE  34  -3.925   4.427 -13.857
  273    HA   ILE  34           HA       ILE  34  -4.325   6.697 -12.062
  274    HB   ILE  34           HB       ILE  34  -3.898   6.635 -15.056
  275   HG12  ILE  34          HG12      ILE  34  -1.923   8.137 -14.569
  276   HG13  ILE  34          HG11      ILE  34  -2.219   7.848 -12.864
  277   HG21  ILE  34          HG21      ILE  34  -4.476   9.031 -13.327
  278   HG22  ILE  34          HG22      ILE  34  -5.548   8.315 -14.527
  279   HG23  ILE  34          HG23      ILE  34  -4.040   9.078 -15.036
  280   HD11  ILE  34          HD11      ILE  34  -1.728   5.534 -13.134
  281   HD12  ILE  34          HD12      ILE  34  -0.371   6.504 -13.725
  282   HD13  ILE  34          HD13      ILE  34  -1.486   5.725 -14.868
  283    H    ASP  35           HN       ASP  35  -6.326   7.367 -11.826
  284    HA   ASP  35           HA       ASP  35  -8.403   6.457 -13.670
  285    HB2  ASP  35           HB2      ASP  35  -8.376   4.906 -11.737
  286    HB3  ASP  35           HB1      ASP  35  -8.592   6.281 -10.658
  287    H    ASP  36           HN       ASP  36  -9.256   8.201 -14.418
  288    HA   ASP  36           HA       ASP  36 -10.237  10.200 -14.663
  289    HB2  ASP  36           HB2      ASP  36 -11.738   9.186 -12.886
  290    HB3  ASP  36           HB1      ASP  36 -10.821  10.086 -11.689
  291    H    GLY  37           HN       GLY  37  -7.437  10.173 -14.156
  292    HA2  GLY  37           HA2      GLY  37  -6.032  12.095 -14.367
  293    HA3  GLY  37           HA1      GLY  37  -7.200  12.995 -13.421
  294    H    GLU  38           HN       GLU  38  -7.002  10.409 -11.569
  295    HA   GLU  38           HA       GLU  38  -4.621  11.449 -10.243
  296    HB2  GLU  38           HB2      GLU  38  -5.713  10.972  -8.091
  297    HB3  GLU  38           HB1      GLU  38  -6.571  12.170  -9.040
  298    HG2  GLU  38           HG2      GLU  38  -8.066  10.228  -9.776
  299    HG3  GLU  38           HG1      GLU  38  -7.309   9.345  -8.443
  300    H    VAL  39           HN       VAL  39  -3.406   9.970  -8.922
  301    HA   VAL  39           HA       VAL  39  -3.373   7.346 -10.241
  302    HB   VAL  39           HB       VAL  39  -1.189   8.427  -8.479
  303   HG11  VAL  39          HG11      VAL  39   0.253   6.878  -9.800
  304   HG12  VAL  39          HG12      VAL  39  -1.176   6.336 -10.668
  305   HG13  VAL  39          HG13      VAL  39  -1.047   6.058  -8.950
  306   HG21  VAL  39          HG21      VAL  39  -1.445   8.889 -11.457
  307   HG22  VAL  39          HG22      VAL  39  -0.021   9.255 -10.492
  308   HG23  VAL  39          HG23      VAL  39  -1.534  10.116 -10.201
  309    H    LEU  40           HN       LEU  40  -3.962   5.624  -9.193
  310    HA   LEU  40           HA       LEU  40  -3.867   5.695  -6.289
  311    HB2  LEU  40           HB2      LEU  40  -5.964   4.354  -7.968
  312    HB3  LEU  40           HB1      LEU  40  -5.771   4.115  -6.244
  313    HG   LEU  40           HG       LEU  40  -6.115   6.761  -6.241
  314   HD11  LEU  40          HD11      LEU  40  -7.793   7.397  -7.867
  315   HD12  LEU  40          HD12      LEU  40  -7.504   5.874  -8.723
  316   HD13  LEU  40          HD13      LEU  40  -6.203   7.060  -8.566
  317   HD21  LEU  40          HD21      LEU  40  -8.331   4.737  -6.495
  318   HD22  LEU  40          HD22      LEU  40  -8.452   6.334  -5.729
  319   HD23  LEU  40          HD23      LEU  40  -7.393   5.087  -5.048
  320    H    TYR  41           HN       TYR  41  -3.754   3.572  -5.369
  321    HA   TYR  41           HA       TYR  41  -2.046   1.888  -7.035
  322    HB2  TYR  41           HB2      TYR  41  -1.911   2.460  -4.078
  323    HB3  TYR  41           HB1      TYR  41  -1.005   1.179  -4.864
  324    HD1  TYR  41           HD2      TYR  41  -1.535   4.879  -5.050
  325    HD2  TYR  41           HD1      TYR  41   1.140   1.630  -5.621
  326    HE1  TYR  41           HE2      TYR  41   0.290   6.467  -5.526
  327    HE2  TYR  41           HE1      TYR  41   2.966   3.215  -6.094
  328    HH   TYR  41           HH       TYR  41   3.231   5.497  -6.871
  329    H    LEU  42           HN       LEU  42  -2.333  -0.210  -6.950
  330    HA   LEU  42           HA       LEU  42  -4.686  -1.221  -5.555
  331    HB2  LEU  42           HB2      LEU  42  -4.652  -1.330  -8.086
  332    HB3  LEU  42           HB1      LEU  42  -3.188  -2.271  -7.990
  333    HG   LEU  42           HG       LEU  42  -5.353  -3.511  -8.530
  334   HD11  LEU  42          HD11      LEU  42  -4.798  -5.469  -7.202
  335   HD12  LEU  42          HD12      LEU  42  -3.775  -4.481  -6.170
  336   HD13  LEU  42          HD13      LEU  42  -3.360  -4.712  -7.873
  337   HD21  LEU  42          HD21      LEU  42  -5.828  -3.166  -5.586
  338   HD22  LEU  42          HD22      LEU  42  -6.793  -4.127  -6.720
  339   HD23  LEU  42          HD23      LEU  42  -6.733  -2.376  -6.871
  340    H    VAL  43           HN       VAL  43  -4.123  -2.339  -3.829
  341    HA   VAL  43           HA       VAL  43  -1.323  -3.261  -3.634
  342    HB   VAL  43           HB       VAL  43  -1.289  -2.639  -1.311
  343   HG11  VAL  43          HG11      VAL  43  -1.564  -0.230  -1.398
  344   HG12  VAL  43          HG12      VAL  43  -2.502  -0.394  -2.880
  345   HG13  VAL  43          HG13      VAL  43  -0.808  -0.854  -2.869
  346   HG21  VAL  43          HG21      VAL  43  -3.215  -1.590  -0.159
  347   HG22  VAL  43          HG22      VAL  43  -3.615  -3.222  -0.693
  348   HG23  VAL  43          HG23      VAL  43  -4.202  -1.828  -1.600
  349    H    HIS  44           HN       HIS  44  -0.940  -5.140  -2.512
  350    HA   HIS  44           HA       HIS  44  -3.281  -6.832  -1.999
  351    HB2  HIS  44           HB2      HIS  44  -2.053  -8.833  -2.731
  352    HB3  HIS  44           HB1      HIS  44  -1.998  -7.662  -4.031
  353    HD1  HIS  44           HD1      HIS  44   0.153  -9.948  -2.141
  354    HD2  HIS  44           HD2      HIS  44   0.694  -6.331  -4.150
  355    HE1  HIS  44           HE1      HIS  44   2.577  -9.763  -2.541
  356    HE2  HIS  44           HE2      HIS  44   2.849  -7.776  -4.006
  357    H    TYR  45           HN       TYR  45  -3.348  -7.621  -0.001
  358    HA   TYR  45           HA       TYR  45  -1.426  -6.521   1.800
  359    HB2  TYR  45           HB2      TYR  45  -3.829  -8.284   2.339
  360    HB3  TYR  45           HB1      TYR  45  -2.875  -7.457   3.569
  361    HD1  TYR  45           HD2      TYR  45  -5.304  -7.000   0.840
  362    HD2  TYR  45           HD1      TYR  45  -3.079  -5.071   3.907
  363    HE1  TYR  45           HE2      TYR  45  -6.680  -4.982   0.557
  364    HE2  TYR  45           HE1      TYR  45  -4.450  -3.047   3.623
  365    HH   TYR  45           HH       TYR  45  -7.335  -2.969   1.779
  366    H    TYR  46           HN       TYR  46   0.470  -7.437   1.654
  367    HA   TYR  46           HA       TYR  46   2.166  -8.783   1.883
  368    HB2  TYR  46           HB2      TYR  46   0.272 -10.104   3.754
  369    HB3  TYR  46           HB1      TYR  46   1.934 -10.684   3.554
  370    HD1  TYR  46           HD2      TYR  46   3.806  -9.040   4.017
  371    HD2  TYR  46           HD1      TYR  46  -0.220  -8.283   5.163
  372    HE1  TYR  46           HE2      TYR  46   4.586  -7.356   5.622
  373    HE2  TYR  46           HE1      TYR  46   0.561  -6.596   6.778
  374    HH   TYR  46           HH       TYR  46   2.531  -6.045   8.013
  375    H    GLY  47           HN       GLY  47  -0.403 -11.231   1.775
  376    HA2  GLY  47           HA2      GLY  47   1.269 -13.040   0.306
  377    HA3  GLY  47           HA1      GLY  47  -0.415 -13.287   0.735
  378    H    TRP  48           HN       TRP  48  -1.997 -12.832  -0.761
  379    HA   TRP  48           HA       TRP  48  -1.139 -11.753  -3.340
  380    HB2  TRP  48           HB2      TRP  48  -2.682 -14.334  -2.917
  381    HB3  TRP  48           HB1      TRP  48  -2.454 -13.558  -4.478
  382    HD1  TRP  48           HD1      TRP  48  -0.889 -16.035  -2.198
  383    HE1  TRP  48           HE1      TRP  48   1.419 -16.737  -3.084
  384    HE3  TRP  48           HE3      TRP  48  -0.266 -12.429  -5.779
  385    HZ2  TRP  48           HZ2      TRP  48   3.268 -15.874  -5.042
  386    HZ3  TRP  48           HZ3      TRP  48   1.805 -12.437  -7.107
  387    HH2  TRP  48           HH2      TRP  48   3.530 -14.125  -6.748
  388    H    ASN  49           HN       ASN  49  -3.611 -12.256  -4.606
  389    HA   ASN  49           HA       ASN  49  -5.192 -10.068  -3.854
  390    HB2  ASN  49           HB2      ASN  49  -5.211 -10.932  -6.123
  391    HB3  ASN  49           HB1      ASN  49  -5.787 -12.495  -5.566
  392   HD21  ASN  49          HD21      ASN  49  -6.657  -9.199  -6.239
  393   HD22  ASN  49          HD22      ASN  49  -8.365  -9.474  -6.250
  394    H    VAL  50           HN       VAL  50  -6.180  -9.993  -1.995
  395    HA   VAL  50           HA       VAL  50  -7.126 -12.404  -0.785
  396    HB   VAL  50           HB       VAL  50  -6.090 -10.865   0.733
  397   HG11  VAL  50          HG11      VAL  50  -8.174  -8.797   0.040
  398   HG12  VAL  50          HG12      VAL  50  -6.481  -8.769  -0.453
  399   HG13  VAL  50          HG13      VAL  50  -6.904  -8.644   1.252
  400   HG21  VAL  50          HG21      VAL  50  -7.910 -12.165   1.678
  401   HG22  VAL  50          HG22      VAL  50  -9.056 -10.891   1.271
  402   HG23  VAL  50          HG23      VAL  50  -7.793 -10.594   2.471
  403    H    ARG  51           HN       ARG  51  -8.978  -9.379  -1.385
  404    HA   ARG  51           HA       ARG  51 -11.260 -11.184  -1.864
  405    HB2  ARG  51           HB2      ARG  51 -11.503  -9.549   0.018
  406    HB3  ARG  51           HB1      ARG  51 -11.334  -8.257  -1.154
  407    HG2  ARG  51           HG2      ARG  51 -13.359  -8.921  -2.270
  408    HG3  ARG  51           HG1      ARG  51 -13.514 -10.319  -1.204
  409    HD2  ARG  51           HD2      ARG  51 -13.576  -7.431  -0.328
  410    HD3  ARG  51           HD1      ARG  51 -14.983  -8.465  -0.546
  411    HE   ARG  51           HE       ARG  51 -13.004  -9.486   1.289
  412   HH11  ARG  51          HH11      ARG  51 -16.031  -7.638   0.957
  413   HH12  ARG  51          HH12      ARG  51 -16.410  -7.749   2.621
  414   HH21  ARG  51          HH21      ARG  51 -13.568  -9.600   3.564
  415   HH22  ARG  51          HH22      ARG  51 -15.017  -8.898   4.098
  416    H    TYR  52           HN       TYR  52 -10.153  -7.991  -2.867
  417    HA   TYR  52           HA       TYR  52 -10.286  -8.725  -5.698
  418    HB2  TYR  52           HB2      TYR  52 -11.501  -6.156  -4.600
  419    HB3  TYR  52           HB1      TYR  52 -11.436  -6.647  -6.272
  420    HD1  TYR  52           HD1      TYR  52 -12.777  -8.950  -6.732
  421    HD2  TYR  52           HD2      TYR  52 -13.473  -6.259  -3.517
  422    HE1  TYR  52           HE1      TYR  52 -15.099  -9.750  -6.567
  423    HE2  TYR  52           HE2      TYR  52 -15.781  -7.050  -3.335
  424    HH   TYR  52           HH       TYR  52 -17.437  -8.071  -4.879
  425    H    ASP  53           HN       ASP  53  -8.322  -8.257  -3.549
  426    HA   ASP  53           HA       ASP  53  -6.663  -6.929  -2.715
  427    HB2  ASP  53           HB2      ASP  53  -6.695  -5.810  -5.546
  428    HB3  ASP  53           HB1      ASP  53  -5.426  -5.473  -4.376
  429    H    GLU  54           HN       GLU  54  -6.146  -4.058  -3.265
  430    HA   GLU  54           HA       GLU  54  -8.753  -2.846  -3.048
  431    HB2  GLU  54           HB2      GLU  54  -8.240  -3.735  -0.699
  432    HB3  GLU  54           HB1      GLU  54  -6.904  -2.613  -0.651
  433    HG2  GLU  54           HG2      GLU  54  -8.213  -0.853  -0.256
  434    HG3  GLU  54           HG1      GLU  54  -9.483  -1.419  -1.338
  435    H    TRP  55           HN       TRP  55  -8.827  -0.633  -3.174
  436    HA   TRP  55           HA       TRP  55  -6.482   0.446  -4.538
  437    HB2  TRP  55           HB2      TRP  55  -9.415   1.012  -4.813
  438    HB3  TRP  55           HB1      TRP  55  -8.158   1.996  -5.550
  439    HD1  TRP  55           HD1      TRP  55  -9.643  -1.536  -5.719
  440    HE1  TRP  55           HE1      TRP  55  -9.087  -2.489  -8.074
  441    HE3  TRP  55           HE3      TRP  55  -6.595   2.179  -7.391
  442    HZ2  TRP  55           HZ2      TRP  55  -7.529  -1.746 -10.307
  443    HZ3  TRP  55           HZ3      TRP  55  -5.595   1.995  -9.611
  444    HH2  TRP  55           HH2      TRP  55  -6.044   0.064 -11.041
  445    H    VAL  56           HN       VAL  56  -5.472   1.959  -3.566
  446    HA   VAL  56           HA       VAL  56  -6.975   3.890  -2.032
  447    HB   VAL  56           HB       VAL  56  -5.098   4.042  -0.342
  448   HG11  VAL  56          HG11      VAL  56  -7.230   2.937   0.156
  449   HG12  VAL  56          HG12      VAL  56  -5.888   2.182   1.002
  450   HG13  VAL  56          HG13      VAL  56  -6.569   1.408  -0.430
  451   HG21  VAL  56          HG21      VAL  56  -4.299   1.361  -1.507
  452   HG22  VAL  56          HG22      VAL  56  -3.597   2.124  -0.075
  453   HG23  VAL  56          HG23      VAL  56  -3.390   2.860  -1.657
  454    H    LYS  57           HN       LYS  57  -6.153   5.935  -2.106
  455    HA   LYS  57           HA       LYS  57  -4.573   6.396  -4.463
  456    HB2  LYS  57           HB2      LYS  57  -6.570   7.790  -3.869
  457    HB3  LYS  57           HB1      LYS  57  -5.670   8.422  -2.501
  458    HG2  LYS  57           HG2      LYS  57  -4.050   9.428  -3.999
  459    HG3  LYS  57           HG1      LYS  57  -4.868   8.732  -5.391
  460    HD2  LYS  57           HD2      LYS  57  -6.870  10.015  -4.871
  461    HD3  LYS  57           HD1      LYS  57  -6.067  10.703  -3.454
  462    HE2  LYS  57           HE2      LYS  57  -4.449  11.782  -4.820
  463    HE3  LYS  57           HE1      LYS  57  -5.038  10.968  -6.266
  464    HZ1  LYS  57           HZ1      LYS  57  -6.541  12.963  -4.648
  465    HZ2  LYS  57           HZ2      LYS  57  -7.132  12.126  -5.985
  466    HZ3  LYS  57           HZ3      LYS  57  -5.862  13.229  -6.175
  467    H    ALA  58           HN       ALA  58  -2.716   7.891  -4.418
  468    HA   ALA  58           HA       ALA  58  -0.591   6.904  -2.966
  469    HB1  ALA  58           HB1      ALA  58   0.659   8.736  -3.862
  470    HB2  ALA  58           HB2      ALA  58  -0.824   9.643  -4.158
  471    HB3  ALA  58           HB3      ALA  58  -0.493   8.187  -5.088
  472    H    ASP  59           HN       ASP  59  -2.658   9.601  -2.297
  473    HA   ASP  59           HA       ASP  59  -1.138  10.754  -0.156
  474    HB2  ASP  59           HB2      ASP  59  -4.076  11.107  -0.803
  475    HB3  ASP  59           HB1      ASP  59  -3.129  12.133   0.261
  476    H    ARG  60           HN       ARG  60  -2.998   7.989  -0.311
  477    HA   ARG  60           HA       ARG  60  -3.867   8.054   2.495
  478    HB2  ARG  60           HB2      ARG  60  -4.618   6.332   0.130
  479    HB3  ARG  60           HB1      ARG  60  -5.199   6.044   1.763
  480    HG2  ARG  60           HG2      ARG  60  -5.593   8.754   0.652
  481    HG3  ARG  60           HG1      ARG  60  -6.564   7.455  -0.036
  482    HD2  ARG  60           HD2      ARG  60  -6.351   8.026   2.917
  483    HD3  ARG  60           HD1      ARG  60  -7.638   8.656   1.877
  484    HE   ARG  60           HE       ARG  60  -7.107   5.790   2.153
  485   HH11  ARG  60          HH11      ARG  60  -9.326   8.463   2.664
  486   HH12  ARG  60          HH12      ARG  60 -10.753   7.554   2.536
  487   HH21  ARG  60          HH21      ARG  60  -9.115   4.457   1.979
  488   HH22  ARG  60          HH22      ARG  60 -10.623   5.250   2.130
  489    H    ILE  61           HN       ILE  61  -1.184   7.267   0.871
  490    HA   ILE  61           HA       ILE  61  -0.781   4.740   2.259
  491    HB   ILE  61           HB       ILE  61   0.467   5.799  -0.287
  492   HG12  ILE  61          HG12      ILE  61  -1.451   3.521   0.199
  493   HG13  ILE  61          HG11      ILE  61  -1.820   5.045  -0.598
  494   HG21  ILE  61          HG21      ILE  61   0.893   3.176   1.103
  495   HG22  ILE  61          HG22      ILE  61   2.063   4.502   1.009
  496   HG23  ILE  61          HG23      ILE  61   1.579   3.635  -0.460
  497   HD11  ILE  61          HD11      ILE  61  -1.539   3.257  -2.189
  498   HD12  ILE  61          HD12      ILE  61   0.070   2.932  -1.567
  499   HD13  ILE  61          HD13      ILE  61  -0.267   4.465  -2.392
  500    H    ILE  62           HN       ILE  62   1.012   4.579   3.522
  501    HA   ILE  62           HA       ILE  62   2.744   6.946   3.778
  502    HB   ILE  62           HB       ILE  62   2.556   4.634   5.745
  503   HG12  ILE  62          HG12      ILE  62   1.496   6.401   7.325
  504   HG13  ILE  62          HG11      ILE  62   1.115   7.288   5.849
  505   HG21  ILE  62          HG21      ILE  62   3.897   7.315   6.058
  506   HG22  ILE  62          HG22      ILE  62   4.682   5.763   5.795
  507   HG23  ILE  62          HG23      ILE  62   3.806   6.055   7.291
  508   HD11  ILE  62          HD11      ILE  62  -0.229   5.375   5.087
  509   HD12  ILE  62          HD12      ILE  62  -0.783   5.999   6.641
  510   HD13  ILE  62          HD13      ILE  62   0.175   4.520   6.577
  511    H    TRP  63           HN       TRP  63   4.492   6.660   2.633
  512    HA   TRP  63           HA       TRP  63   5.406   4.024   1.949
  513    HB2  TRP  63           HB2      TRP  63   6.368   6.785   1.198
  514    HB3  TRP  63           HB1      TRP  63   7.127   5.301   0.638
  515    HD1  TRP  63           HD1      TRP  63   3.972   7.416   0.152
  516    HE1  TRP  63           HE1      TRP  63   2.779   6.604  -1.974
  517    HE3  TRP  63           HE3      TRP  63   6.814   3.297  -0.827
  518    HZ2  TRP  63           HZ2      TRP  63   3.018   4.473  -3.821
  519    HZ3  TRP  63           HZ3      TRP  63   6.275   1.920  -2.795
  520    HH2  TRP  63           HH2      TRP  63   4.417   2.496  -4.258
  521    HA   PRO  64           HA       PRO  64   8.412   4.054   5.295
  522    HB2  PRO  64           HB2      PRO  64   9.800   2.050   3.593
  523    HB3  PRO  64           HB1      PRO  64   9.262   1.886   5.265
  524    HG2  PRO  64           HG2      PRO  64   7.986   0.608   3.298
  525    HG3  PRO  64           HG1      PRO  64   7.105   1.316   4.663
  526    HD2  PRO  64           HD2      PRO  64   7.420   2.363   1.877
  527    HD3  PRO  64           HD1      PRO  64   5.990   2.350   2.938
  528    H    LEU  65           HN       LEU  65   9.855   5.643   5.280
  529    HA   LEU  65           HA       LEU  65  11.702   6.201   3.053
  530    HB2  LEU  65           HB2      LEU  65   9.123   7.456   3.387
  531    HB3  LEU  65           HB1      LEU  65  10.376   8.593   3.801
  532    HG   LEU  65           HG       LEU  65   9.709   8.909   1.517
  533   HD11  LEU  65          HD11      LEU  65  12.427   7.643   1.621
  534   HD12  LEU  65          HD12      LEU  65  12.027   9.324   1.974
  535   HD13  LEU  65          HD13      LEU  65  11.822   8.694   0.341
  536   HD21  LEU  65          HD21      LEU  65   8.822   6.726   1.014
  537   HD22  LEU  65          HD22      LEU  65  10.443   6.025   1.061
  538   HD23  LEU  65          HD23      LEU  65  10.018   7.184  -0.198
  539    H    ASP  66           HN       ASP  66  12.305   8.624   3.824
  540    HA   ASP  66           HA       ASP  66  13.947   8.065   6.012
  541    HB2  ASP  66           HB2      ASP  66  14.784   9.318   4.254
  542    HB3  ASP  66           HB1      ASP  66  13.479  10.482   4.335
  543    H    LYS  67           HN       LYS  67  12.642   7.684   7.669
  544    HA   LYS  67           HA       LYS  67  11.815   9.985   9.210
  545    HB2  LYS  67           HB2      LYS  67   9.571   8.865   9.780
  546    HB3  LYS  67           HB1      LYS  67   9.687   9.542   8.173
  547    HG2  LYS  67           HG2      LYS  67   8.541   7.467   8.030
  548    HG3  LYS  67           HG1      LYS  67  10.131   7.261   7.307
  549    HD2  LYS  67           HD2      LYS  67   9.853   5.306   8.581
  550    HD3  LYS  67           HD1      LYS  67  10.836   6.401   9.564
  551    HE2  LYS  67           HE2      LYS  67   7.849   6.062   9.914
  552    HE3  LYS  67           HE1      LYS  67   9.045   5.165  10.836
  553    HZ1  LYS  67           HZ1      LYS  67   9.862   7.401  11.648
  554    HZ2  LYS  67           HZ2      LYS  67   8.327   6.936  12.139
  555    HZ3  LYS  67           HZ3      LYS  67   8.475   8.082  10.939
  556    H    GLY  68           HN       GLY  68  13.914   7.959   9.226
  557    HA2  GLY  68           HA2      GLY  68  14.865   7.276  11.396
  558    HA3  GLY  68           HA1      GLY  68  13.284   6.591  11.763
  559    H    LEU  69           HN       LEU  69  14.302   6.313   8.545
  560    HA   LEU  69           HA       LEU  69  15.173   3.565   8.968
  561    HB2  LEU  69           HB2      LEU  69  13.496   4.613   6.690
  562    HB3  LEU  69           HB1      LEU  69  14.159   2.995   6.839
  563    HG   LEU  69           HG       LEU  69  12.096   4.176   8.709
  564   HD11  LEU  69          HD11      LEU  69  10.515   2.672   7.614
  565   HD12  LEU  69          HD12      LEU  69  11.765   2.198   6.463
  566   HD13  LEU  69          HD13      LEU  69  11.171   3.859   6.487
  567   HD21  LEU  69          HD21      LEU  69  13.177   1.370   8.436
  568   HD22  LEU  69          HD22      LEU  69  11.847   1.861   9.483
  569   HD23  LEU  69          HD23      LEU  69  13.472   2.479   9.779
  570    H    GLU  70           HN       GLU  70  17.207   4.020   8.846
  571    HA   GLU  70           HA       GLU  70  18.374   5.490   6.599
  572    HB2  GLU  70           HB2      GLU  70  20.031   4.068   8.653
  573    HB3  GLU  70           HB1      GLU  70  20.316   5.628   7.905
  574    HG2  GLU  70           HG2      GLU  70  19.907   6.215  10.103
  575    HG3  GLU  70           HG1      GLU  70  18.304   6.400   9.392
  576    H    HIS  71           HN       HIS  71  18.599   2.550   8.372
  577    HA   HIS  71           HA       HIS  71  19.286   0.988   5.982
  578    HB2  HIS  71           HB2      HIS  71  20.143   0.898   8.767
  579    HB3  HIS  71           HB1      HIS  71  19.460  -0.638   8.262
  580    HD1  HIS  71           HD1      HIS  71  22.648   0.655   8.671
  581    HD2  HIS  71           HD2      HIS  71  20.776  -1.106   5.403
  582    HE1  HIS  71           HE1      HIS  71  24.479  -0.254   7.245
  583    HE2  HIS  71           HE2      HIS  71  23.308  -1.582   5.490
  584    H    HIS  72           HN       HIS  72  18.097  -1.207   5.964
  585    HA   HIS  72           HA       HIS  72  15.301  -0.646   6.325
  586    HB2  HIS  72           HB2      HIS  72  16.273  -1.989   4.401
  587    HB3  HIS  72           HB1      HIS  72  16.570  -3.294   5.539
  588    HD1  HIS  72           HD1      HIS  72  13.846  -1.625   3.574
  589    HD2  HIS  72           HD2      HIS  72  14.241  -4.739   6.298
  590    HE1  HIS  72           HE1      HIS  72  11.739  -2.932   3.404
  591    HE2  HIS  72           HE2      HIS  72  11.879  -4.565   5.288
  592    H    HIS  73           HN       HIS  73  17.740  -1.998   8.257
  593    HA   HIS  73           HA       HIS  73  17.830  -2.613  10.404
  594    HB2  HIS  73           HB2      HIS  73  14.920  -1.819  10.462
  595    HB3  HIS  73           HB1      HIS  73  15.728  -2.494  11.874
  596    HD1  HIS  73           HD1      HIS  73  17.369  -0.946  13.136
  597    HD2  HIS  73           HD2      HIS  73  15.695   0.802   9.769
  598    HE1  HIS  73           HE1      HIS  73  17.985   1.459  13.258
  599    HE2  HIS  73           HE2      HIS  73  17.271   2.394  11.057
  600    H    HIS  74           HN       HIS  74  17.089  -4.402   8.213
  601    HA   HIS  74           HA       HIS  74  17.055  -6.736   9.829
  602    HB2  HIS  74           HB2      HIS  74  14.600  -6.349   9.685
  603    HB3  HIS  74           HB1      HIS  74  14.712  -6.349   7.931
  604    HD1  HIS  74           HD1      HIS  74  14.416  -8.602  10.855
  605    HD2  HIS  74           HD2      HIS  74  15.252  -8.984   6.806
  606    HE1  HIS  74           HE1      HIS  74  14.149 -11.018  10.344
  607    HE2  HIS  74           HE2      HIS  74  14.265 -11.120   7.852
  608    H    HIS  75           HN       HIS  75  18.899  -7.320   8.939
  609    HA   HIS  75           HA       HIS  75  18.739  -8.395   6.268
  610    HB2  HIS  75           HB2      HIS  75  19.707  -6.055   6.050
  611    HB3  HIS  75           HB1      HIS  75  21.019  -6.571   7.099
  612    HD1  HIS  75           HD1      HIS  75  19.913  -6.580   3.584
  613    HD2  HIS  75           HD2      HIS  75  22.757  -8.545   5.889
  614    HE1  HIS  75           HE1      HIS  75  21.511  -7.580   1.966
  615    HE2  HIS  75           HE2      HIS  75  23.345  -8.522   3.383
  616    H    HIS  76           HN       HIS  76  19.714 -10.363   6.299
  617    HA   HIS  76           HA       HIS  76  21.770 -10.928   8.214
  618    HB2  HIS  76           HB2      HIS  76  19.523 -11.229   9.390
  619    HB3  HIS  76           HB1      HIS  76  19.204 -12.532   8.256
  620    HD1  HIS  76           HD1      HIS  76  19.662 -14.726   9.304
  621    HD2  HIS  76           HD2      HIS  76  22.222 -11.785  10.711
  622    HE1  HIS  76           HE1      HIS  76  21.051 -15.827  11.077
  623    HE2  HIS  76           HE2      HIS  76  22.660 -14.061  11.843
  Start of MODEL   20
    1    H1   GLU   1           HT1      GLU   1  17.699 -10.041 -13.119
    2    H2   GLU   1           HT2      GLU   1  18.908  -9.177 -12.308
    3    H3   GLU   1           HT3      GLU   1  17.308  -8.903 -11.943
    4    HA   GLU   1           HA       GLU   1  17.088 -11.082 -11.011
    5    HB2  GLU   1           HB2      GLU   1  20.031 -11.312 -11.704
    6    HB3  GLU   1           HB1      GLU   1  19.123 -12.459 -10.737
    7    HG2  GLU   1           HG2      GLU   1  17.741 -13.023 -12.640
    8    HG3  GLU   1           HG1      GLU   1  18.557 -11.807 -13.620
    9    H    ASP   2           HN       ASP   2  17.622 -11.423  -8.816
   10    HA   ASP   2           HA       ASP   2  17.695 -10.570  -6.735
   11    HB2  ASP   2           HB2      ASP   2  20.077 -11.453  -7.233
   12    HB3  ASP   2           HB1      ASP   2  20.533  -9.759  -7.354
   13    H    MET   3           HN       MET   3  16.224  -8.949  -7.391
   14    HA   MET   3           HA       MET   3  17.176  -6.227  -7.007
   15    HB2  MET   3           HB2      MET   3  16.259  -5.487  -9.170
   16    HB3  MET   3           HB1      MET   3  17.590  -6.619  -9.394
   17    HG2  MET   3           HG2      MET   3  15.923  -8.425  -9.746
   18    HG3  MET   3           HG1      MET   3  14.649  -7.212  -9.667
   19    HE1  MET   3           HE1      MET   3  15.935  -4.739 -11.210
   20    HE2  MET   3           HE2      MET   3  14.292  -5.314 -11.485
   21    HE3  MET   3           HE3      MET   3  15.373  -5.053 -12.853
   22    H    GLU   4           HN       GLU   4  15.008  -4.863  -7.736
   23    HA   GLU   4           HA       GLU   4  12.778  -6.149  -6.368
   24    HB2  GLU   4           HB2      GLU   4  13.337  -3.258  -7.061
   25    HB3  GLU   4           HB1      GLU   4  11.857  -3.815  -6.298
   26    HG2  GLU   4           HG2      GLU   4  13.117  -4.572  -4.372
   27    HG3  GLU   4           HG1      GLU   4  14.620  -4.090  -5.154
   28    HA   PRO   5           HA       PRO   5  11.565  -6.627 -10.731
   29    HB2  PRO   5           HB2      PRO   5   9.532  -8.431  -9.600
   30    HB3  PRO   5           HB1      PRO   5  10.792  -8.788 -10.782
   31    HG2  PRO   5           HG2      PRO   5  10.940  -9.749  -8.291
   32    HG3  PRO   5           HG1      PRO   5  12.385  -9.196  -9.169
   33    HD2  PRO   5           HD2      PRO   5  10.794  -7.737  -7.082
   34    HD3  PRO   5           HD1      PRO   5  12.557  -7.942  -7.227
   35    H    CYS   6           HN       CYS   6  10.509  -4.814 -11.285
   36    HA   CYS   6           HA       CYS   6   8.880  -3.288 -11.648
   37    HB2  CYS   6           HB2      CYS   6   7.014  -5.347 -10.421
   38    HB3  CYS   6           HB1      CYS   6   6.532  -3.986 -11.422
   39    HG   CYS   6           HG       CYS   6   7.094  -5.043 -13.765
   40    H    LEU   7           HN       LEU   7   6.890  -2.190 -10.321
   41    HA   LEU   7           HA       LEU   7   7.981  -1.441  -7.773
   42    HB2  LEU   7           HB2      LEU   7   6.073   0.158  -7.572
   43    HB3  LEU   7           HB1      LEU   7   6.998   0.379  -9.023
   44    HG   LEU   7           HG       LEU   7   4.684   0.832  -9.454
   45   HD11  LEU   7          HD11      LEU   7   5.883  -0.228 -11.281
   46   HD12  LEU   7          HD12      LEU   7   4.145  -0.472 -11.310
   47   HD13  LEU   7          HD13      LEU   7   5.184  -1.788 -10.804
   48   HD21  LEU   7          HD21      LEU   7   3.597  -0.399  -7.706
   49   HD22  LEU   7          HD22      LEU   7   4.022  -1.936  -8.460
   50   HD23  LEU   7          HD23      LEU   7   2.890  -0.844  -9.257
   51    H    THR   8           HN       THR   8   5.961  -3.760  -8.892
   52    HA   THR   8           HA       THR   8   4.199  -4.331  -6.848
   53    HB   THR   8           HB       THR   8   5.650  -6.181  -8.721
   54    HG1  THR   8           HG1      THR   8   3.218  -4.877  -9.304
   55   HG21  THR   8          HG21      THR   8   2.843  -6.240  -7.630
   56   HG22  THR   8          HG22      THR   8   4.167  -7.227  -7.005
   57   HG23  THR   8          HG23      THR   8   3.573  -7.476  -8.652
   58    H    GLY   9           HN       GLY   9   4.821  -4.824  -4.772
   59    HA2  GLY   9           HA2      GLY   9   5.906  -6.700  -3.508
   60    HA3  GLY   9           HA1      GLY   9   7.348  -6.326  -4.435
   61    H    THR  10           HN       THR  10   6.548  -3.363  -4.086
   62    HA   THR  10           HA       THR  10   8.093  -2.946  -1.722
   63    HB   THR  10           HB       THR  10   6.379  -0.990  -3.243
   64    HG1  THR  10           HG1      THR  10   8.705  -2.266  -3.887
   65   HG21  THR  10          HG21      THR  10   7.124  -0.156  -1.065
   66   HG22  THR  10          HG22      THR  10   7.928   0.716  -2.369
   67   HG23  THR  10          HG23      THR  10   8.799  -0.535  -1.479
   68    H    LYS  11           HN       LYS  11   7.339  -2.711   0.321
   69    HA   LYS  11           HA       LYS  11   4.453  -2.843   0.626
   70    HB2  LYS  11           HB2      LYS  11   4.696  -3.722   2.823
   71    HB3  LYS  11           HB1      LYS  11   5.834  -4.594   1.831
   72    HG2  LYS  11           HG2      LYS  11   6.927  -4.240   3.896
   73    HG3  LYS  11           HG1      LYS  11   7.630  -3.036   2.820
   74    HD2  LYS  11           HD2      LYS  11   6.232  -1.299   3.777
   75    HD3  LYS  11           HD1      LYS  11   5.361  -2.485   4.744
   76    HE2  LYS  11           HE2      LYS  11   8.310  -1.938   5.005
   77    HE3  LYS  11           HE1      LYS  11   7.084  -1.133   5.975
   78    HZ1  LYS  11           HZ1      LYS  11   7.562  -4.068   5.894
   79    HZ2  LYS  11           HZ2      LYS  11   6.405  -3.282   6.855
   80    HZ3  LYS  11           HZ3      LYS  11   8.042  -3.029   7.119
   81    H    VAL  12           HN       VAL  12   3.324  -1.455   1.813
   82    HA   VAL  12           HA       VAL  12   4.674   0.956   2.760
   83    HB   VAL  12           HB       VAL  12   2.886   2.326   1.729
   84   HG11  VAL  12          HG11      VAL  12   3.655   2.234  -0.594
   85   HG12  VAL  12          HG12      VAL  12   4.382   0.657  -0.286
   86   HG13  VAL  12          HG13      VAL  12   5.005   2.089   0.532
   87   HG21  VAL  12          HG21      VAL  12   1.176   0.592   1.598
   88   HG22  VAL  12          HG22      VAL  12   2.084  -0.229   0.330
   89   HG23  VAL  12          HG23      VAL  12   1.405   1.379   0.038
   90    H    LYS  13           HN       LYS  13   2.832   2.306   3.819
   91    HA   LYS  13           HA       LYS  13   1.097   0.484   5.327
   92    HB2  LYS  13           HB2      LYS  13   2.025   3.283   6.021
   93    HB3  LYS  13           HB1      LYS  13   0.882   2.343   6.944
   94    HG2  LYS  13           HG2      LYS  13   3.400   1.037   6.361
   95    HG3  LYS  13           HG1      LYS  13   3.444   2.464   7.479
   96    HD2  LYS  13           HD2      LYS  13   1.600   0.095   7.759
   97    HD3  LYS  13           HD1      LYS  13   3.204   0.116   8.497
   98    HE2  LYS  13           HE2      LYS  13   2.587   2.141   9.725
   99    HE3  LYS  13           HE1      LYS  13   0.980   2.087   9.008
  100    HZ1  LYS  13           HZ1      LYS  13   1.058   1.143  11.247
  101    HZ2  LYS  13           HZ2      LYS  13   2.138  -0.035  10.726
  102    HZ3  LYS  13           HZ3      LYS  13   0.582  -0.008  10.118
  103    H    VAL  14           HN       VAL  14  -0.958   0.783   5.179
  104    HA   VAL  14           HA       VAL  14  -1.872   2.841   3.312
  105    HB   VAL  14           HB       VAL  14  -2.917   0.029   3.748
  106   HG11  VAL  14          HG11      VAL  14  -4.739   1.614   3.336
  107   HG12  VAL  14          HG12      VAL  14  -4.511   0.471   2.016
  108   HG13  VAL  14          HG13      VAL  14  -3.931   2.138   1.849
  109   HG21  VAL  14          HG21      VAL  14  -0.878   0.143   2.428
  110   HG22  VAL  14          HG22      VAL  14  -1.637   1.295   1.319
  111   HG23  VAL  14          HG23      VAL  14  -2.250  -0.351   1.447
  112    H    LYS  15           HN       LYS  15  -3.233   4.194   4.129
  113    HA   LYS  15           HA       LYS  15  -4.599   3.628   6.668
  114    HB2  LYS  15           HB2      LYS  15  -3.142   5.701   6.425
  115    HB3  LYS  15           HB1      LYS  15  -4.210   6.196   5.116
  116    HG2  LYS  15           HG2      LYS  15  -6.082   6.271   6.686
  117    HG3  LYS  15           HG1      LYS  15  -4.969   5.884   8.001
  118    HD2  LYS  15           HD2      LYS  15  -3.698   7.890   7.573
  119    HD3  LYS  15           HD1      LYS  15  -4.695   8.239   6.157
  120    HE2  LYS  15           HE2      LYS  15  -6.655   8.431   7.627
  121    HE3  LYS  15           HE1      LYS  15  -5.611   8.144   9.016
  122    HZ1  LYS  15           HZ1      LYS  15  -6.050  10.472   8.711
  123    HZ2  LYS  15           HZ2      LYS  15  -5.441  10.435   7.140
  124    HZ3  LYS  15           HZ3      LYS  15  -4.403  10.176   8.457
  125    H    TYR  16           HN       TYR  16  -6.536   2.704   6.078
  126    HA   TYR  16           HA       TYR  16  -8.089   4.041   4.017
  127    HB2  TYR  16           HB2      TYR  16  -6.771   2.310   2.844
  128    HB3  TYR  16           HB1      TYR  16  -7.461   1.084   3.896
  129    HD1  TYR  16           HD1      TYR  16  -8.136   3.404   1.111
  130    HD2  TYR  16           HD2      TYR  16  -9.688   0.270   3.527
  131    HE1  TYR  16           HE1      TYR  16  -9.978   3.073  -0.506
  132    HE2  TYR  16           HE2      TYR  16 -11.525  -0.044   1.944
  133    HH   TYR  16           HH       TYR  16 -11.551   1.432  -1.150
  134    H    GLY  17           HN       GLY  17  -9.952   4.391   4.846
  135    HA2  GLY  17           HA2      GLY  17 -11.686   2.464   5.735
  136    HA3  GLY  17           HA1      GLY  17 -11.021   3.249   7.160
  137    H    ARG  18           HN       ARG  18 -13.705   3.397   6.230
  138    HA   ARG  18           HA       ARG  18 -13.879   6.103   5.197
  139    HB2  ARG  18           HB2      ARG  18 -16.368   5.642   5.096
  140    HB3  ARG  18           HB1      ARG  18 -15.351   4.677   4.041
  141    HG2  ARG  18           HG2      ARG  18 -15.504   2.811   5.624
  142    HG3  ARG  18           HG1      ARG  18 -16.537   3.783   6.666
  143    HD2  ARG  18           HD2      ARG  18 -18.237   3.893   4.983
  144    HD3  ARG  18           HD1      ARG  18 -17.174   3.135   3.796
  145    HE   ARG  18           HE       ARG  18 -17.404   1.409   5.953
  146   HH11  ARG  18          HH11      ARG  18 -19.564   2.762   3.495
  147   HH12  ARG  18          HH12      ARG  18 -20.507   1.352   3.350
  148   HH21  ARG  18          HH21      ARG  18 -18.688  -0.518   5.739
  149   HH22  ARG  18          HH22      ARG  18 -19.989  -0.563   4.641
  150    H    GLY  19           HN       GLY  19 -13.911   7.740   6.448
  151    HA2  GLY  19           HA2      GLY  19 -14.494   9.175   8.099
  152    HA3  GLY  19           HA1      GLY  19 -15.773   8.059   8.552
  153    H    LYS  20           HN       LYS  20 -15.582   7.000  10.377
  154    HA   LYS  20           HA       LYS  20 -13.173   7.403  11.956
  155    HB2  LYS  20           HB2      LYS  20 -15.450   7.969  12.852
  156    HB3  LYS  20           HB1      LYS  20 -15.858   6.267  12.756
  157    HG2  LYS  20           HG2      LYS  20 -15.317   6.875  15.032
  158    HG3  LYS  20           HG1      LYS  20 -14.086   5.775  14.401
  159    HD2  LYS  20           HD2      LYS  20 -12.591   7.640  14.019
  160    HD3  LYS  20           HD1      LYS  20 -13.835   8.780  14.533
  161    HE2  LYS  20           HE2      LYS  20 -13.842   7.726  16.751
  162    HE3  LYS  20           HE1      LYS  20 -12.557   6.641  16.227
  163    HZ1  LYS  20           HZ1      LYS  20 -12.370   9.598  16.374
  164    HZ2  LYS  20           HZ2      LYS  20 -11.136   8.580  15.890
  165    HZ3  LYS  20           HZ3      LYS  20 -11.702   8.522  17.483
  166    H    THR  21           HN       THR  21 -14.414   5.180   9.870
  167    HA   THR  21           HA       THR  21 -13.548   2.738  11.200
  168    HB   THR  21           HB       THR  21 -14.472   3.138   8.322
  169    HG1  THR  21           HG1      THR  21 -15.848   3.837  10.340
  170   HG21  THR  21          HG21      THR  21 -15.269   0.837   8.508
  171   HG22  THR  21          HG22      THR  21 -14.740   0.769  10.191
  172   HG23  THR  21          HG23      THR  21 -13.548   0.896   8.895
  173    H    GLN  22           HN       GLN  22 -11.748   4.997  10.522
  174    HA   GLN  22           HA       GLN  22 -10.079   4.470   8.282
  175    HB2  GLN  22           HB2      GLN  22 -10.488   6.659   9.455
  176    HB3  GLN  22           HB1      GLN  22  -9.501   6.053  10.771
  177    HG2  GLN  22           HG2      GLN  22  -8.166   7.476   9.417
  178    HG3  GLN  22           HG1      GLN  22  -7.632   5.811   9.180
  179   HE21  GLN  22          HE21      GLN  22  -9.380   8.454   7.783
  180   HE22  GLN  22          HE22      GLN  22  -9.301   7.944   6.149
  181    H    LYS  23           HN       LYS  23  -8.919   2.601   8.258
  182    HA   LYS  23           HA       LYS  23  -7.553   1.775  10.727
  183    HB2  LYS  23           HB2      LYS  23  -8.409   0.134   8.346
  184    HB3  LYS  23           HB1      LYS  23  -7.485  -0.488   9.690
  185    HG2  LYS  23           HG2      LYS  23 -10.292   0.600   9.828
  186    HG3  LYS  23           HG1      LYS  23  -9.835  -1.105   9.779
  187    HD2  LYS  23           HD2      LYS  23  -9.025   0.836  11.959
  188    HD3  LYS  23           HD1      LYS  23 -10.367  -0.295  12.073
  189    HE2  LYS  23           HE2      LYS  23  -8.847  -2.184  11.869
  190    HE3  LYS  23           HE1      LYS  23  -7.483  -1.101  11.628
  191    HZ1  LYS  23           HZ1      LYS  23  -9.122  -1.231  14.105
  192    HZ2  LYS  23           HZ2      LYS  23  -7.753  -0.273  13.850
  193    HZ3  LYS  23           HZ3      LYS  23  -7.608  -1.934  13.897
  194    H    ILE  24           HN       ILE  24  -5.358   1.202  10.563
  195    HA   ILE  24           HA       ILE  24  -4.129   1.896   8.005
  196    HB   ILE  24           HB       ILE  24  -2.835   2.123  10.770
  197   HG12  ILE  24          HG12      ILE  24  -2.592   4.596  10.134
  198   HG13  ILE  24          HG11      ILE  24  -3.708   4.280   8.822
  199   HG21  ILE  24          HG21      ILE  24  -0.880   3.073   9.618
  200   HG22  ILE  24          HG22      ILE  24  -1.654   2.770   8.069
  201   HG23  ILE  24          HG23      ILE  24  -1.202   1.420   9.103
  202   HD11  ILE  24          HD11      ILE  24  -4.834   5.331  10.708
  203   HD12  ILE  24          HD12      ILE  24  -4.305   4.028  11.771
  204   HD13  ILE  24          HD13      ILE  24  -5.442   3.690  10.474
  205    H    TYR  25           HN       TYR  25  -2.945   0.428   7.046
  206    HA   TYR  25           HA       TYR  25  -2.486  -2.200   8.341
  207    HB2  TYR  25           HB2      TYR  25  -3.331  -1.703   5.480
  208    HB3  TYR  25           HB1      TYR  25  -3.057  -3.258   6.231
  209    HD1  TYR  25           HD1      TYR  25  -5.353  -0.419   5.904
  210    HD2  TYR  25           HD2      TYR  25  -4.763  -4.265   7.615
  211    HE1  TYR  25           HE1      TYR  25  -7.768  -0.583   6.369
  212    HE2  TYR  25           HE2      TYR  25  -7.162  -4.427   8.087
  213    HH   TYR  25           HH       TYR  25  -9.086  -3.029   8.362
  214    H    GLU  26           HN       GLU  26  -0.767  -3.420   7.188
  215    HA   GLU  26           HA       GLU  26   1.056  -1.742   5.622
  216    HB2  GLU  26           HB2      GLU  26   1.480  -4.332   7.128
  217    HB3  GLU  26           HB1      GLU  26   2.629  -3.740   5.944
  218    HG2  GLU  26           HG2      GLU  26   2.851  -1.686   7.285
  219    HG3  GLU  26           HG1      GLU  26   1.838  -2.433   8.520
  220    H    ALA  27           HN       ALA  27   1.114  -2.220   3.481
  221    HA   ALA  27           HA       ALA  27   0.124  -4.806   2.560
  222    HB1  ALA  27           HB1      ALA  27  -0.941  -2.160   1.580
  223    HB2  ALA  27           HB2      ALA  27  -1.827  -3.318   2.571
  224    HB3  ALA  27           HB3      ALA  27  -1.352  -3.745   0.923
  225    H    SER  28           HN       SER  28   0.806  -5.263   0.387
  226    HA   SER  28           HA       SER  28   3.044  -3.592  -0.388
  227    HB2  SER  28           HB2      SER  28   3.693  -5.682  -1.739
  228    HB3  SER  28           HB1      SER  28   3.880  -5.759   0.010
  229    HG   SER  28           HG       SER  28   2.733  -7.459  -0.154
  230    H    ILE  29           HN       ILE  29   3.243  -2.853  -2.426
  231    HA   ILE  29           HA       ILE  29   0.770  -2.343  -3.751
  232    HB   ILE  29           HB       ILE  29   3.554  -1.794  -4.819
  233   HG12  ILE  29          HG12      ILE  29   3.400  -0.802  -2.587
  234   HG13  ILE  29          HG11      ILE  29   3.363   0.456  -3.810
  235   HG21  ILE  29          HG21      ILE  29   0.881  -0.507  -5.355
  236   HG22  ILE  29          HG22      ILE  29   1.789  -1.541  -6.463
  237   HG23  ILE  29          HG23      ILE  29   2.418   0.048  -6.010
  238   HD11  ILE  29          HD11      ILE  29   1.790   0.972  -2.098
  239   HD12  ILE  29          HD12      ILE  29   1.043  -0.617  -2.231
  240   HD13  ILE  29          HD13      ILE  29   0.893   0.543  -3.558
  241    H    LYS  30           HN       LYS  30  -0.108  -3.449  -5.361
  242    HA   LYS  30           HA       LYS  30   1.424  -5.644  -6.500
  243    HB2  LYS  30           HB2      LYS  30  -0.877  -6.052  -5.456
  244    HB3  LYS  30           HB1      LYS  30  -1.560  -5.106  -6.759
  245    HG2  LYS  30           HG2      LYS  30  -0.017  -7.683  -7.174
  246    HG3  LYS  30           HG1      LYS  30  -1.769  -7.593  -7.039
  247    HD2  LYS  30           HD2      LYS  30  -1.863  -6.190  -9.030
  248    HD3  LYS  30           HD1      LYS  30  -0.106  -6.186  -9.121
  249    HE2  LYS  30           HE2      LYS  30  -0.148  -8.617  -9.481
  250    HE3  LYS  30           HE1      LYS  30  -1.911  -8.586  -9.431
  251    HZ1  LYS  30           HZ1      LYS  30  -1.098  -8.550 -11.714
  252    HZ2  LYS  30           HZ2      LYS  30  -0.202  -7.167 -11.397
  253    HZ3  LYS  30           HZ3      LYS  30  -1.886  -7.100 -11.359
  254    H    SER  31           HN       SER  31  -0.781  -3.005  -7.493
  255    HA   SER  31           HA       SER  31   0.870  -2.364  -9.743
  256    HB2  SER  31           HB2      SER  31  -1.961  -3.387 -10.156
  257    HB3  SER  31           HB1      SER  31  -1.001  -2.590 -11.397
  258    HG   SER  31           HG       SER  31   0.487  -4.514 -10.398
  259    H    THR  32           HN       THR  32  -0.510  -0.527 -11.032
  260    HA   THR  32           HA       THR  32  -2.279   0.932  -9.338
  261    HB   THR  32           HB       THR  32  -0.170   1.687  -8.357
  262    HG1  THR  32           HG1      THR  32  -1.870   3.210  -8.814
  263   HG21  THR  32          HG21      THR  32   1.338   1.153 -10.208
  264   HG22  THR  32          HG22      THR  32   1.526   2.839  -9.695
  265   HG23  THR  32          HG23      THR  32   0.598   2.447 -11.152
  266    H    GLU  33           HN       GLU  33  -2.928   2.871 -10.391
  267    HA   GLU  33           HA       GLU  33  -2.409   3.182 -13.206
  268    HB2  GLU  33           HB2      GLU  33  -4.717   3.180 -13.855
  269    HB3  GLU  33           HB1      GLU  33  -4.259   1.622 -13.123
  270    HG2  GLU  33           HG2      GLU  33  -5.387   2.250 -11.079
  271    HG3  GLU  33           HG1      GLU  33  -5.806   3.810 -11.776
  272    H    ILE  34           HN       ILE  34  -3.281   5.230 -13.954
  273    HA   ILE  34           HA       ILE  34  -3.624   7.081 -11.720
  274    HB   ILE  34           HB       ILE  34  -2.200   7.587 -14.327
  275   HG12  ILE  34          HG12      ILE  34  -0.215   8.170 -12.821
  276   HG13  ILE  34          HG11      ILE  34  -1.176   7.529 -11.501
  277   HG21  ILE  34          HG21      ILE  34  -1.726   9.866 -13.490
  278   HG22  ILE  34          HG22      ILE  34  -2.727   9.525 -12.078
  279   HG23  ILE  34          HG23      ILE  34  -3.454   9.563 -13.683
  280   HD11  ILE  34          HD11      ILE  34  -1.171   5.358 -12.510
  281   HD12  ILE  34          HD12      ILE  34   0.482   5.923 -12.230
  282   HD13  ILE  34          HD13      ILE  34  -0.205   5.940 -13.868
  283    H    ASP  35           HN       ASP  35  -5.521   7.810 -11.761
  284    HA   ASP  35           HA       ASP  35  -6.946   8.103 -14.325
  285    HB2  ASP  35           HB2      ASP  35  -7.737   6.116 -13.018
  286    HB3  ASP  35           HB1      ASP  35  -8.219   7.217 -11.735
  287    H    ASP  36           HN       ASP  36  -7.487  10.093 -14.672
  288    HA   ASP  36           HA       ASP  36  -8.282  12.185 -14.487
  289    HB2  ASP  36           HB2      ASP  36 -10.084  11.113 -13.054
  290    HB3  ASP  36           HB1      ASP  36  -9.112  11.499 -11.644
  291    H    GLY  37           HN       GLY  37  -5.619  11.305 -13.638
  292    HA2  GLY  37           HA2      GLY  37  -3.758  12.700 -13.315
  293    HA3  GLY  37           HA1      GLY  37  -4.800  13.875 -12.536
  294    H    GLU  38           HN       GLU  38  -5.682  11.125 -11.036
  295    HA   GLU  38           HA       GLU  38  -3.515  11.416  -9.117
  296    HB2  GLU  38           HB2      GLU  38  -5.131  10.739  -7.345
  297    HB3  GLU  38           HB1      GLU  38  -5.484  12.300  -8.093
  298    HG2  GLU  38           HG2      GLU  38  -7.175  11.047  -9.483
  299    HG3  GLU  38           HG1      GLU  38  -6.895   9.675  -8.411
  300    H    VAL  39           HN       VAL  39  -2.908   9.562  -7.900
  301    HA   VAL  39           HA       VAL  39  -2.907   7.294  -9.733
  302    HB   VAL  39           HB       VAL  39  -1.090   7.622  -7.367
  303   HG11  VAL  39          HG11      VAL  39  -0.843   6.125  -9.956
  304   HG12  VAL  39          HG12      VAL  39  -1.024   5.447  -8.348
  305   HG13  VAL  39          HG13      VAL  39   0.451   6.296  -8.784
  306   HG21  VAL  39          HG21      VAL  39   0.595   8.639  -8.911
  307   HG22  VAL  39          HG22      VAL  39  -0.771   9.672  -8.525
  308   HG23  VAL  39          HG23      VAL  39  -0.698   8.889 -10.090
  309    H    LEU  40           HN       LEU  40  -3.927   5.590  -9.290
  310    HA   LEU  40           HA       LEU  40  -4.956   5.092  -6.596
  311    HB2  LEU  40           HB2      LEU  40  -5.868   3.977  -9.237
  312    HB3  LEU  40           HB1      LEU  40  -6.644   3.766  -7.681
  313    HG   LEU  40           HG       LEU  40  -6.462   6.307  -9.279
  314   HD11  LEU  40          HD11      LEU  40  -8.780   4.568  -8.517
  315   HD12  LEU  40          HD12      LEU  40  -8.078   4.753 -10.128
  316   HD13  LEU  40          HD13      LEU  40  -8.895   6.117  -9.358
  317   HD21  LEU  40          HD21      LEU  40  -7.861   7.288  -7.474
  318   HD22  LEU  40          HD22      LEU  40  -6.228   6.851  -6.990
  319   HD23  LEU  40          HD23      LEU  40  -7.570   5.811  -6.524
  320    H    TYR  41           HN       TYR  41  -4.203   3.419  -5.656
  321    HA   TYR  41           HA       TYR  41  -2.386   1.655  -7.154
  322    HB2  TYR  41           HB2      TYR  41  -2.302   2.500  -4.273
  323    HB3  TYR  41           HB1      TYR  41  -1.352   1.169  -4.910
  324    HD1  TYR  41           HD2      TYR  41  -1.802   4.790  -4.883
  325    HD2  TYR  41           HD1      TYR  41   0.526   1.570  -6.336
  326    HE1  TYR  41           HE2      TYR  41  -0.014   6.375  -5.517
  327    HE2  TYR  41           HE1      TYR  41   2.319   3.116  -6.977
  328    HH   TYR  41           HH       TYR  41   2.554   5.523  -7.541
  329    H    LEU  42           HN       LEU  42  -2.418  -0.470  -6.826
  330    HA   LEU  42           HA       LEU  42  -4.754  -1.577  -5.463
  331    HB2  LEU  42           HB2      LEU  42  -4.627  -2.103  -7.846
  332    HB3  LEU  42           HB1      LEU  42  -2.966  -2.627  -7.669
  333    HG   LEU  42           HG       LEU  42  -3.722  -4.531  -6.303
  334   HD11  LEU  42          HD11      LEU  42  -5.724  -3.608  -5.340
  335   HD12  LEU  42          HD12      LEU  42  -6.124  -5.075  -6.240
  336   HD13  LEU  42          HD13      LEU  42  -6.473  -3.493  -6.932
  337   HD21  LEU  42          HD21      LEU  42  -3.435  -4.762  -8.716
  338   HD22  LEU  42          HD22      LEU  42  -5.121  -4.307  -8.962
  339   HD23  LEU  42          HD23      LEU  42  -4.724  -5.798  -8.108
  340    H    VAL  43           HN       VAL  43  -4.191  -2.232  -3.547
  341    HA   VAL  43           HA       VAL  43  -1.431  -3.151  -3.103
  342    HB   VAL  43           HB       VAL  43  -1.486  -2.163  -0.903
  343   HG11  VAL  43          HG11      VAL  43  -2.564  -0.166  -2.851
  344   HG12  VAL  43          HG12      VAL  43  -0.894  -0.681  -2.713
  345   HG13  VAL  43          HG13      VAL  43  -1.659   0.193  -1.380
  346   HG21  VAL  43          HG21      VAL  43  -3.442  -0.877  -0.061
  347   HG22  VAL  43          HG22      VAL  43  -3.819  -2.581  -0.288
  348   HG23  VAL  43          HG23      VAL  43  -4.363  -1.396  -1.471
  349    H    HIS  44           HN       HIS  44  -1.219  -4.891  -1.724
  350    HA   HIS  44           HA       HIS  44  -3.720  -6.105  -0.886
  351    HB2  HIS  44           HB2      HIS  44  -2.981  -8.391  -1.461
  352    HB3  HIS  44           HB1      HIS  44  -3.060  -7.374  -2.881
  353    HD1  HIS  44           HD1      HIS  44  -1.237 -10.022  -1.878
  354    HD2  HIS  44           HD2      HIS  44  -0.092  -6.235  -3.095
  355    HE1  HIS  44           HE1      HIS  44   1.133 -10.260  -2.667
  356    HE2  HIS  44           HE2      HIS  44   1.863  -7.885  -3.027
  357    H    TYR  45           HN       TYR  45  -3.826  -6.886   1.021
  358    HA   TYR  45           HA       TYR  45  -1.938  -5.799   2.865
  359    HB2  TYR  45           HB2      TYR  45  -4.260  -7.638   3.460
  360    HB3  TYR  45           HB1      TYR  45  -3.467  -6.529   4.568
  361    HD1  TYR  45           HD2      TYR  45  -3.669  -4.000   4.045
  362    HD2  TYR  45           HD1      TYR  45  -6.129  -6.959   2.243
  363    HE1  TYR  45           HE2      TYR  45  -5.329  -2.270   3.470
  364    HE2  TYR  45           HE1      TYR  45  -7.789  -5.243   1.656
  365    HH   TYR  45           HH       TYR  45  -7.140  -1.939   1.814
  366    H    TYR  46           HN       TYR  46  -0.309  -6.819   3.977
  367    HA   TYR  46           HA       TYR  46  -0.219  -9.720   3.664
  368    HB2  TYR  46           HB2      TYR  46   2.173  -9.725   3.483
  369    HB3  TYR  46           HB1      TYR  46   1.612  -8.487   2.373
  370    HD1  TYR  46           HD1      TYR  46   1.834  -6.050   3.135
  371    HD2  TYR  46           HD2      TYR  46   3.713  -9.294   5.132
  372    HE1  TYR  46           HE1      TYR  46   3.405  -4.489   4.192
  373    HE2  TYR  46           HE2      TYR  46   5.281  -7.748   6.198
  374    HH   TYR  46           HH       TYR  46   4.841  -4.469   6.337
  375    H    GLY  47           HN       GLY  47   0.160 -10.913   5.429
  376    HA2  GLY  47           HA2      GLY  47   0.800 -11.057   7.792
  377    HA3  GLY  47           HA1      GLY  47   0.109  -9.440   7.987
  378    H    TRP  48           HN       TRP  48  -1.960  -9.883   6.176
  379    HA   TRP  48           HA       TRP  48  -3.838 -11.515   7.735
  380    HB2  TRP  48           HB2      TRP  48  -4.270  -9.355   5.625
  381    HB3  TRP  48           HB1      TRP  48  -5.555 -10.215   6.452
  382    HD1  TRP  48           HD1      TRP  48  -6.127  -9.471   8.936
  383    HE1  TRP  48           HE1      TRP  48  -5.530  -7.382  10.307
  384    HE3  TRP  48           HE3      TRP  48  -2.368  -7.622   6.011
  385    HZ2  TRP  48           HZ2      TRP  48  -3.711  -5.234  10.169
  386    HZ3  TRP  48           HZ3      TRP  48  -1.258  -5.539   6.701
  387    HH2  TRP  48           HH2      TRP  48  -1.916  -4.372   8.737
  388    H    ASN  49           HN       ASN  49  -5.629 -11.833   5.438
  389    HA   ASN  49           HA       ASN  49  -4.158 -13.806   4.019
  390    HB2  ASN  49           HB2      ASN  49  -6.972 -12.780   3.762
  391    HB3  ASN  49           HB1      ASN  49  -6.291 -13.825   2.527
  392   HD21  ASN  49          HD21      ASN  49  -4.746 -15.420   4.435
  393   HD22  ASN  49          HD22      ASN  49  -5.924 -16.374   5.252
  394    H    VAL  50           HN       VAL  50  -2.869 -13.462   2.489
  395    HA   VAL  50           HA       VAL  50  -2.341 -10.860   1.558
  396    HB   VAL  50           HB       VAL  50  -0.680 -12.681   1.960
  397   HG11  VAL  50          HG11      VAL  50  -0.151 -14.258   0.169
  398   HG12  VAL  50          HG12      VAL  50  -1.635 -13.771  -0.658
  399   HG13  VAL  50          HG13      VAL  50  -1.718 -14.542   0.924
  400   HG21  VAL  50          HG21      VAL  50  -0.009 -10.674   0.851
  401   HG22  VAL  50          HG22      VAL  50  -0.556 -11.300  -0.707
  402   HG23  VAL  50          HG23      VAL  50   0.819 -12.050   0.116
  403    H    ARG  51           HN       ARG  51  -4.509 -13.177   0.482
  404    HA   ARG  51           HA       ARG  51  -4.550 -12.529  -2.302
  405    HB2  ARG  51           HB2      ARG  51  -6.565 -13.881  -2.423
  406    HB3  ARG  51           HB1      ARG  51  -5.367 -14.701  -1.438
  407    HG2  ARG  51           HG2      ARG  51  -6.533 -13.915   0.590
  408    HG3  ARG  51           HG1      ARG  51  -7.756 -13.166  -0.427
  409    HD2  ARG  51           HD2      ARG  51  -7.106 -16.113  -0.308
  410    HD3  ARG  51           HD1      ARG  51  -8.509 -15.332   0.417
  411    HE   ARG  51           HE       ARG  51  -8.326 -14.839  -2.379
  412   HH11  ARG  51          HH11      ARG  51  -9.507 -17.177   0.014
  413   HH12  ARG  51          HH12      ARG  51 -10.489 -18.023  -1.080
  414   HH21  ARG  51          HH21      ARG  51  -9.715 -15.955  -3.874
  415   HH22  ARG  51          HH22      ARG  51 -10.633 -17.289  -3.358
  416    H    TYR  52           HN       TYR  52  -5.524 -10.774   0.391
  417    HA   TYR  52           HA       TYR  52  -7.788  -9.583  -0.934
  418    HB2  TYR  52           HB2      TYR  52  -6.618  -9.180   1.796
  419    HB3  TYR  52           HB1      TYR  52  -7.818  -8.068   1.138
  420    HD1  TYR  52           HD1      TYR  52  -7.209 -11.475   2.279
  421    HD2  TYR  52           HD2      TYR  52 -10.092  -8.729   0.857
  422    HE1  TYR  52           HE1      TYR  52  -8.998 -13.023   2.952
  423    HE2  TYR  52           HE2      TYR  52 -11.888 -10.247   1.522
  424    HH   TYR  52           HH       TYR  52 -12.183 -12.628   1.900
  425    H    ASP  53           HN       ASP  53  -7.208  -8.512  -2.608
  426    HA   ASP  53           HA       ASP  53  -5.342  -6.299  -2.269
  427    HB2  ASP  53           HB2      ASP  53  -5.207  -6.221  -4.720
  428    HB3  ASP  53           HB1      ASP  53  -4.786  -7.818  -4.131
  429    H    GLU  54           HN       GLU  54  -6.001  -4.259  -2.678
  430    HA   GLU  54           HA       GLU  54  -8.692  -3.677  -3.582
  431    HB2  GLU  54           HB2      GLU  54  -8.934  -4.230  -1.122
  432    HB3  GLU  54           HB1      GLU  54  -7.794  -2.946  -0.766
  433    HG2  GLU  54           HG2      GLU  54 -10.138  -2.304  -0.385
  434    HG3  GLU  54           HG1      GLU  54  -9.333  -1.286  -1.577
  435    H    TRP  55           HN       TRP  55  -8.990  -1.403  -3.798
  436    HA   TRP  55           HA       TRP  55  -6.463  -0.193  -4.624
  437    HB2  TRP  55           HB2      TRP  55  -9.296   0.404  -5.399
  438    HB3  TRP  55           HB1      TRP  55  -7.916   1.334  -5.958
  439    HD1  TRP  55           HD1      TRP  55  -9.372  -2.227  -6.215
  440    HE1  TRP  55           HE1      TRP  55  -8.476  -3.317  -8.380
  441    HE3  TRP  55           HE3      TRP  55  -6.070   1.396  -7.641
  442    HZ2  TRP  55           HZ2      TRP  55  -6.598  -2.724 -10.393
  443    HZ3  TRP  55           HZ3      TRP  55  -4.733   1.044  -9.677
  444    HH2  TRP  55           HH2      TRP  55  -4.998  -0.967 -11.027
  445    H    VAL  56           HN       VAL  56  -5.732   1.581  -3.858
  446    HA   VAL  56           HA       VAL  56  -7.369   3.222  -2.093
  447    HB   VAL  56           HB       VAL  56  -5.519   3.495  -0.511
  448   HG11  VAL  56          HG11      VAL  56  -5.451   1.269   0.495
  449   HG12  VAL  56          HG12      VAL  56  -6.097   0.582  -0.991
  450   HG13  VAL  56          HG13      VAL  56  -7.077   1.697  -0.039
  451   HG21  VAL  56          HG21      VAL  56  -3.651   3.188  -2.061
  452   HG22  VAL  56          HG22      VAL  56  -4.008   1.467  -2.174
  453   HG23  VAL  56          HG23      VAL  56  -3.459   2.160  -0.647
  454    H    LYS  57           HN       LYS  57  -6.249   5.386  -1.843
  455    HA   LYS  57           HA       LYS  57  -5.126   6.040  -4.456
  456    HB2  LYS  57           HB2      LYS  57  -7.280   7.067  -3.452
  457    HB3  LYS  57           HB1      LYS  57  -6.187   7.984  -2.431
  458    HG2  LYS  57           HG2      LYS  57  -5.417   9.259  -4.171
  459    HG3  LYS  57           HG1      LYS  57  -5.793   8.038  -5.389
  460    HD2  LYS  57           HD2      LYS  57  -7.418   9.722  -5.673
  461    HD3  LYS  57           HD1      LYS  57  -8.229   8.415  -4.818
  462    HE2  LYS  57           HE2      LYS  57  -8.921  10.412  -3.773
  463    HE3  LYS  57           HE1      LYS  57  -7.727   9.701  -2.686
  464    HZ1  LYS  57           HZ1      LYS  57  -7.136  11.732  -4.714
  465    HZ2  LYS  57           HZ2      LYS  57  -6.075  11.264  -3.456
  466    HZ3  LYS  57           HZ3      LYS  57  -7.481  12.143  -3.131
  467    H    ALA  58           HN       ALA  58  -3.339   7.629  -4.472
  468    HA   ALA  58           HA       ALA  58  -1.143   6.801  -3.008
  469    HB1  ALA  58           HB1      ALA  58   0.030   8.697  -3.927
  470    HB2  ALA  58           HB2      ALA  58  -1.493   9.522  -4.246
  471    HB3  ALA  58           HB3      ALA  58  -1.083   8.067  -5.146
  472    H    ASP  59           HN       ASP  59  -3.394   9.278  -2.305
  473    HA   ASP  59           HA       ASP  59  -2.131  10.756  -0.273
  474    HB2  ASP  59           HB2      ASP  59  -5.056  10.117  -0.593
  475    HB3  ASP  59           HB1      ASP  59  -4.394  11.393   0.413
  476    H    ARG  60           HN       ARG  60  -3.567   7.618  -0.226
  477    HA   ARG  60           HA       ARG  60  -4.075   7.609   2.664
  478    HB2  ARG  60           HB2      ARG  60  -4.583   5.468   0.598
  479    HB3  ARG  60           HB1      ARG  60  -5.209   5.519   2.236
  480    HG2  ARG  60           HG2      ARG  60  -5.895   7.489   0.067
  481    HG3  ARG  60           HG1      ARG  60  -6.876   6.098   0.521
  482    HD2  ARG  60           HD2      ARG  60  -6.064   8.213   2.472
  483    HD3  ARG  60           HD1      ARG  60  -7.559   8.350   1.518
  484    HE   ARG  60           HE       ARG  60  -6.887   6.512   3.674
  485   HH11  ARG  60          HH11      ARG  60  -9.260   7.137   1.150
  486   HH12  ARG  60          HH12      ARG  60 -10.610   6.741   2.115
  487   HH21  ARG  60          HH21      ARG  60  -8.780   6.044   5.053
  488   HH22  ARG  60          HH22      ARG  60 -10.340   6.171   4.372
  489    H    ILE  61           HN       ILE  61  -1.458   7.132   0.763
  490    HA   ILE  61           HA       ILE  61  -0.655   4.684   2.131
  491    HB   ILE  61           HB       ILE  61   0.276   5.858  -0.496
  492   HG12  ILE  61          HG12      ILE  61  -1.369   3.420   0.177
  493   HG13  ILE  61          HG11      ILE  61  -1.919   4.868  -0.656
  494   HG21  ILE  61          HG21      ILE  61   1.575   3.817  -0.757
  495   HG22  ILE  61          HG22      ILE  61   1.071   3.315   0.858
  496   HG23  ILE  61          HG23      ILE  61   2.108   4.740   0.663
  497   HD11  ILE  61          HD11      ILE  61  -0.476   4.339  -2.543
  498   HD12  ILE  61          HD12      ILE  61  -1.571   2.994  -2.164
  499   HD13  ILE  61          HD13      ILE  61   0.114   2.915  -1.676
  500    H    ILE  62           HN       ILE  62   1.151   4.639   3.300
  501    HA   ILE  62           HA       ILE  62   2.822   7.061   3.429
  502    HB   ILE  62           HB       ILE  62   2.842   4.751   5.391
  503   HG12  ILE  62          HG12      ILE  62   1.870   6.445   7.058
  504   HG13  ILE  62          HG11      ILE  62   1.331   7.356   5.635
  505   HG21  ILE  62          HG21      ILE  62   4.928   5.903   5.355
  506   HG22  ILE  62          HG22      ILE  62   4.115   6.267   6.873
  507   HG23  ILE  62          HG23      ILE  62   4.128   7.451   5.577
  508   HD11  ILE  62          HD11      ILE  62   0.578   4.571   6.450
  509   HD12  ILE  62          HD12      ILE  62   0.018   5.362   4.974
  510   HD13  ILE  62          HD13      ILE  62  -0.455   5.999   6.558
  511    H    TRP  63           HN       TRP  63   4.441   6.785   2.057
  512    HA   TRP  63           HA       TRP  63   5.463   4.175   1.365
  513    HB2  TRP  63           HB2      TRP  63   6.311   6.959   0.518
  514    HB3  TRP  63           HB1      TRP  63   7.009   5.473  -0.114
  515    HD1  TRP  63           HD1      TRP  63   3.866   7.624  -0.308
  516    HE1  TRP  63           HE1      TRP  63   2.453   6.835  -2.307
  517    HE3  TRP  63           HE3      TRP  63   6.509   3.441  -1.554
  518    HZ2  TRP  63           HZ2      TRP  63   2.462   4.704  -4.161
  519    HZ3  TRP  63           HZ3      TRP  63   5.746   2.076  -3.450
  520    HH2  TRP  63           HH2      TRP  63   3.766   2.691  -4.725
  521    HA   PRO  64           HA       PRO  64   8.490   4.427   4.683
  522    HB2  PRO  64           HB2      PRO  64   9.822   2.230   3.201
  523    HB3  PRO  64           HB1      PRO  64   9.255   2.259   4.874
  524    HG2  PRO  64           HG2      PRO  64   7.963   0.842   3.007
  525    HG3  PRO  64           HG1      PRO  64   7.090   1.694   4.292
  526    HD2  PRO  64           HD2      PRO  64   7.470   2.481   1.425
  527    HD3  PRO  64           HD1      PRO  64   6.029   2.605   2.461
  528    H    LEU  65           HN       LEU  65   9.941   5.905   4.604
  529    HA   LEU  65           HA       LEU  65  12.149   6.091   2.867
  530    HB2  LEU  65           HB2      LEU  65   9.690   7.556   2.127
  531    HB3  LEU  65           HB1      LEU  65  11.176   8.475   2.097
  532    HG   LEU  65           HG       LEU  65  10.727   5.931   0.536
  533   HD11  LEU  65          HD11      LEU  65   9.227   7.720  -0.197
  534   HD12  LEU  65          HD12      LEU  65  10.508   7.459  -1.388
  535   HD13  LEU  65          HD13      LEU  65  10.593   8.829  -0.279
  536   HD21  LEU  65          HD21      LEU  65  12.855   8.063   0.436
  537   HD22  LEU  65          HD22      LEU  65  12.753   6.668  -0.643
  538   HD23  LEU  65          HD23      LEU  65  13.072   6.445   1.078
  539    H    ASP  66           HN       ASP  66  13.387   6.625   4.540
  540    HA   ASP  66           HA       ASP  66  14.550   8.059   5.829
  541    HB2  ASP  66           HB2      ASP  66  13.937   9.796   4.211
  542    HB3  ASP  66           HB1      ASP  66  12.460  10.061   5.121
  543    H    LYS  67           HN       LYS  67  11.151   8.777   6.468
  544    HA   LYS  67           HA       LYS  67  11.670   9.312   9.204
  545    HB2  LYS  67           HB2      LYS  67   9.297   9.531   9.647
  546    HB3  LYS  67           HB1      LYS  67   9.623  10.234   8.079
  547    HG2  LYS  67           HG2      LYS  67   8.379   7.580   8.640
  548    HG3  LYS  67           HG1      LYS  67   7.525   9.044   8.135
  549    HD2  LYS  67           HD2      LYS  67   9.074   8.976   6.120
  550    HD3  LYS  67           HD1      LYS  67   9.434   7.330   6.608
  551    HE2  LYS  67           HE2      LYS  67   7.696   7.175   5.001
  552    HE3  LYS  67           HE1      LYS  67   6.945   6.900   6.568
  553    HZ1  LYS  67           HZ1      LYS  67   6.958   9.479   5.107
  554    HZ2  LYS  67           HZ2      LYS  67   6.154   9.219   6.557
  555    HZ3  LYS  67           HZ3      LYS  67   5.663   8.437   5.164
  556    H    GLY  68           HN       GLY  68  11.407   8.230  11.048
  557    HA2  GLY  68           HA2      GLY  68  12.219   5.520  10.837
  558    HA3  GLY  68           HA1      GLY  68  11.966   6.417  12.318
  559    H    LEU  69           HN       LEU  69  10.380   4.527   9.836
  560    HA   LEU  69           HA       LEU  69   8.038   4.061  11.456
  561    HB2  LEU  69           HB2      LEU  69   9.096   2.454   9.105
  562    HB3  LEU  69           HB1      LEU  69   7.525   2.251   9.850
  563    HG   LEU  69           HG       LEU  69   8.441   4.699   8.331
  564   HD11  LEU  69          HD11      LEU  69   8.072   2.789   6.876
  565   HD12  LEU  69          HD12      LEU  69   6.809   3.999   6.657
  566   HD13  LEU  69          HD13      LEU  69   6.478   2.538   7.585
  567   HD21  LEU  69          HD21      LEU  69   6.101   5.422   8.515
  568   HD22  LEU  69          HD22      LEU  69   6.861   5.286  10.096
  569   HD23  LEU  69          HD23      LEU  69   5.752   4.029   9.540
  570    H    GLU  70           HN       GLU  70   8.432   3.251  13.320
  571    HA   GLU  70           HA       GLU  70   9.111   2.065  15.026
  572    HB2  GLU  70           HB2      GLU  70  10.009  -0.003  13.017
  573    HB3  GLU  70           HB1      GLU  70  10.418  -0.156  14.712
  574    HG2  GLU  70           HG2      GLU  70   7.877   0.037  15.114
  575    HG3  GLU  70           HG1      GLU  70   7.737  -0.330  13.396
  576    H    HIS  71           HN       HIS  71  10.577   2.513  16.335
  577    HA   HIS  71           HA       HIS  71  13.306   3.084  15.365
  578    HB2  HIS  71           HB2      HIS  71  11.854   4.135  17.825
  579    HB3  HIS  71           HB1      HIS  71  13.514   4.514  17.403
  580    HD1  HIS  71           HD1      HIS  71  10.084   5.695  16.948
  581    HD2  HIS  71           HD2      HIS  71  13.702   6.098  14.934
  582    HE1  HIS  71           HE1      HIS  71   9.787   7.651  15.435
  583    HE2  HIS  71           HE2      HIS  71  11.997   7.945  14.282
  584    H    HIS  72           HN       HIS  72  12.433   0.631  15.684
  585    HA   HIS  72           HA       HIS  72  12.404  -0.617  18.202
  586    HB2  HIS  72           HB2      HIS  72  11.541  -1.398  15.885
  587    HB3  HIS  72           HB1      HIS  72  13.192  -1.930  15.614
  588    HD1  HIS  72           HD1      HIS  72  10.064  -3.118  16.604
  589    HD2  HIS  72           HD2      HIS  72  13.956  -3.818  17.872
  590    HE1  HIS  72           HE1      HIS  72  10.014  -5.358  17.778
  591    HE2  HIS  72           HE2      HIS  72  12.293  -5.553  18.798
  592    H    HIS  73           HN       HIS  73  14.896  -0.022  15.835
  593    HA   HIS  73           HA       HIS  73  16.897  -0.337  17.908
  594    HB2  HIS  73           HB2      HIS  73  16.588  -2.454  16.284
  595    HB3  HIS  73           HB1      HIS  73  17.504  -1.446  15.175
  596    HD1  HIS  73           HD1      HIS  73  18.393  -4.192  16.682
  597    HD2  HIS  73           HD2      HIS  73  19.683  -0.337  17.462
  598    HE1  HIS  73           HE1      HIS  73  20.598  -4.442  17.816
  599    HE2  HIS  73           HE2      HIS  73  21.491  -2.122  17.643
  600    H    HIS  74           HN       HIS  74  17.664   1.663  17.925
  601    HA   HIS  74           HA       HIS  74  17.169   3.472  15.739
  602    HB2  HIS  74           HB2      HIS  74  16.680   4.129  18.020
  603    HB3  HIS  74           HB1      HIS  74  18.349   3.900  18.491
  604    HD1  HIS  74           HD1      HIS  74  16.687   6.062  15.777
  605    HD2  HIS  74           HD2      HIS  74  19.414   6.324  18.897
  606    HE1  HIS  74           HE1      HIS  74  17.388   8.464  15.868
  607    HE2  HIS  74           HE2      HIS  74  18.701   8.612  17.980
  608    H    HIS  75           HN       HIS  75  19.493   1.390  15.885
  609    HA   HIS  75           HA       HIS  75  21.183   2.569  14.053
  610    HB2  HIS  75           HB2      HIS  75  23.306   2.772  15.337
  611    HB3  HIS  75           HB1      HIS  75  22.113   3.872  15.980
  612    HD1  HIS  75           HD1      HIS  75  24.349   1.082  16.947
  613    HD2  HIS  75           HD2      HIS  75  21.096   3.116  18.571
  614    HE1  HIS  75           HE1      HIS  75  24.358   0.551  19.387
  615    HE2  HIS  75           HE2      HIS  75  22.327   1.681  20.328
  616    H    HIS  76           HN       HIS  76  23.444   0.885  14.460
  617    HA   HIS  76           HA       HIS  76  22.014  -1.648  14.398
  618    HB2  HIS  76           HB2      HIS  76  23.426  -1.023  12.421
  619    HB3  HIS  76           HB1      HIS  76  24.838  -1.043  13.476
  620    HD1  HIS  76           HD1      HIS  76  25.832  -3.302  14.051
  621    HD2  HIS  76           HD2      HIS  76  22.299  -3.564  11.906
  622    HE1  HIS  76           HE1      HIS  76  25.638  -5.702  13.386
  623    HE2  HIS  76           HE2      HIS  76  23.334  -5.870  12.423