*HEADER    ANTIMICROBIAL PROTEIN                   08-AUG-00   1FJN              
*TITLE     SOLUTION STRUCTURE AND ACTIVITY OF THE FOUR DISULFIDE BOND            
*TITLE    2 MEDITERRANEAN MUSSEL DEFENSIN MGD-1                                  
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: DEFENSIN MGD-1;                                            
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 SYNTHETIC: YES;                                                      
*SOURCE   3 OTHER_DETAILS: MGD-1 WAS OBTAINED BY SOLID PHASE SYNTHESIS           
*SOURCE   4 BY USING THE FMOC STRATEGY. THE SEQUENCE OF THIS PEPTIDE             
*SOURCE   5 OCCURS NATURALLY IN MEDITERRANEAN MUSSEL (MYTILUS                    
*SOURCE   6 GALLOPROVINCIALIS)                                                   
*KEYWDS    DEFENSIN, CYSTINE STABILIZED ALPHA-BETA MOTIF,                        
*KEYWDS   2 ANTIBACTERIAL, DISULFIDE BOND, SYNTHESIS                             
*EXPDTA    NMR, 20 STRUCTURES                                                    
*AUTHOR    Y.S.YANG                                                              
*REVDAT   1   20-DEC-00 1FJN    0   

! CaH(i)-NH(i+1) Sequentials assignements
assign (resid  1 and name   HA1) (resid  2 and name    HN)      2.6 0.8 0.0
assign (resid  1 and name   HA2) (resid  2 and name    HN)      2.6 0.8 0.0
assign (resid  2 and name    HA) (resid  2 and name    HN)      2.4 0.6 0.0
assign (resid  2 and name   HB1) (resid  2 and name    HN)      4.8 2.6 0.0
assign (resid  2 and name   HB2) (resid  2 and name    HN)      4.8 2.6 0.0
assign (resid  2 and name   HD#) (resid  2 and name    HN)      6.0 4.2 0.0
assign (resid  2 and name    HA) (resid  3 and name    HN)      3.0 1.2 0.0
assign (resid  2 and name    HN) (resid  3 and name    HN)      2.8 1.0 0.0
!assign (resid  2 and name   HB1) (resid  3 and name    HN)      4.8 3.0 0.0
!assign (resid  2 and name   HB2) (resid  3 and name    HN)      4.8 3.0 0.0
!assign (resid  1 and name   HA1) (resid  3 and name    HN)      4.8 3.0 0.0
!assign (resid  1 and name   HA2) (resid  3 and name    HN)      4.8 3.0 0.0
assign (resid  3 and name   HA1) (resid  3 and name    HN)      3.0 0.8 0.0
assign (resid  3 and name   HA2) (resid  3 and name    HN)      2.2 0.2 0.0
assign (resid  3 and name   HA1) (resid  4 and name    HN)      3.6 1.8 0.0
assign (resid  3 and name   HA2) (resid  4 and name    HN)      2.8 0.4 0.0
assign (resid  3 and name    HN) (resid  4 and name    HN)      2.8 1.0 0.0
assign (resid  4 and name    HA) (resid  4 and name    HN)      2.9 1.0 0.0
assign (resid  4 and name   HB1) (resid  4 and name    HN)      3.6 1.8 0.0
assign (resid  4 and name   HB2) (resid  4 and name    HN)      3.2 1.4 0.0
assign (resid  4 and name    HN) (resid  5 and name    HA)      4.8 3.0 0.0
assign (resid  4 and name    HA) (resid  6 and name    HN)      2.4 0.4 0.0
assign (resid  5 and name    HA) (resid  6 and name    HN)      3.4 1.6 0.0
assign (resid  6 and name    HA) (resid  6 and name    HN)      2.9 1.1 0.0
assign (resid  6 and name   HB1) (resid  6 and name    HN)      3.4 1.6 0.0
assign (resid  6 and name   HB2) (resid  6 and name    HN)      3.0 1.2 0.0
assign (resid  6 and name    HA) (resid  7 and name    HN)      2.4 0.6 0.0
assign (resid  6 and name   HB1) (resid  7 and name    HN)      4.8 3.0 0.0
assign (resid  6 and name   HB2) (resid  7 and name    HN)      4.8 3.0 0.0
assign (resid  6 and name    HN) (resid  7 and name    HN)      4.6 2.8 0.0
assign (resid  7 and name    HA) (resid  7 and name    HN)      2.9 1.0 0.0
assign (resid  7 and name   HB1) (resid  7 and name    HN)      3.6 1.8 0.0
assign (resid  7 and name   HB2) (resid  7 and name    HN)      3.6 1.8 0.0
assign (resid  7 and name    HA) (resid  8 and name    HN)      3.6 1.8 0.0
assign (resid  7 and name    HN) (resid  8 and name    HN)      2.8 1.0 0.0
assign (resid  7 and name   HB1) (resid  8 and name    HN)      4.0 2.2 0.0
assign (resid  7 and name   HB2) (resid  8 and name    HN)      3.6 2.2 0.0
assign (resid  8 and name    HA) (resid  8 and name    HN)      2.8 1.0 0.0
assign (resid  8 and name   HB1) (resid  8 and name    HN)      2.8 1.0 0.0
assign (resid  8 and name   HB2) (resid  8 and name    HN)      2.8 1.0 0.0
assign (resid  8 and name    HA) (resid  9 and name    HN)      3.6 1.8 0.0
assign (resid  8 and name   HB1) (resid  9 and name    HN)      3.6 1.8 0.0
assign (resid  8 and name   HB2) (resid  9 and name    HN)      4.0 2.2 0.0
assign (resid  8 and name    HN) (resid  9 and name    HN)      2.8 1.0 0.0
assign (resid  8 and name    HN) (resid  6 and name    HA)      4.2 2.4 0.0
assign (resid  8 and name    HN) (resid 10 and name    HN)      4.4 2.6 0.0
assign (resid  9 and name    HA) (resid  9 and name    HN)      2.8 1.0 0.0
assign (resid  9 and name   HB1) (resid  9 and name    HN)      3.6 1.6 0.0
assign (resid  9 and name   HB2) (resid  9 and name    HN)      3.0 1.2 0.0
assign (resid  9 and name   HG1) (resid  9 and name    HN)      4.4 2.6 0.0
assign (resid  9 and name   HG2) (resid  9 and name    HN)      4.4 2.6 0.0
assign (resid  9 and name    HA) (resid 10 and name    HN)      3.6 1.8 0.0
assign (resid  9 and name   HB1) (resid 10 and name    HN)      4.4 2.6 0.0
assign (resid  9 and name   HB2) (resid 10 and name    HN)      4.4 2.6 0.0
assign (resid  9 and name   HG1) (resid 10 and name    HN)      4.8 3.0 0.0
assign (resid  9 and name   HG2) (resid 10 and name    HN)      4.8 3.0 0.0
assign (resid  9 and name    HN) (resid 10 and name    HN)      2.8 1.0 0.0
assign (resid 10 and name    HA) (resid 10 and name    HN)      2.8 1.0 0.0
assign (resid 10 and name   HB1) (resid 10 and name    HN)      3.6 1.6 0.0
assign (resid 10 and name   HB2) (resid 10 and name    HN)      2.6 0.6 0.0
assign (resid 10 and name    HA) (resid 11 and name    HN)      3.6 1.8 0.0
assign (resid 10 and name   HB1) (resid 11 and name    HN)      3.6 1.8 0.0
assign (resid 10 and name   HB2) (resid 11 and name    HN)      3.6 1.8 0.0
assign (resid 10 and name    HN) (resid 11 and name    HN)      2.8 1.0 0.0
assign (resid 10 and name    HN) (resid  7 and name    HA)      3.6 1.8 0.0
assign (resid 11 and name    HA) (resid 11 and name    HN)      2.8 1.0 0.0
assign (resid 11 and name   HB1) (resid 11 and name    HN)      2.8 1.0 0.0
assign (resid 11 and name   HB2) (resid 11 and name    HN)      2.8 1.0 0.0
assign (resid 11 and name    HA) (resid 12 and name    HN)      3.6 1.8 0.0
assign (resid 11 and name   HB1) (resid 12 and name    HN)      4.0 2.2 0.0
assign (resid 11 and name   HB2) (resid 12 and name    HN)      4.0 2.2 0.0
assign (resid 11 and name    HN) (resid 12 and name    HN)      2.8 1.0 0.0
assign (resid 11 and name    HN) (resid 13 and name    HN)      4.4 2.6 0.0
assign (resid 11 and name    HN) (resid  7 and name    HA)      4.4 2.6 0.0
assign (resid 11 and name    HN) (resid  9 and name    HA)      4.4 2.6 0.0
assign (resid 11 and name    HN) (resid  8 and name    HA)      3.5 1.7 0.0
assign (resid 12 and name    HA) (resid 12 and name    HN)      2.8 1.0 0.0
assign (resid 12 and name   HB1) (resid 12 and name    HN)      3.2 1.4 0.0
assign (resid 12 and name   HB2) (resid 12 and name    HN)      3.2 1.4 0.0
assign (resid 12 and name   HG1) (resid 12 and name    HN)      4.8 3.0 0.0
assign (resid 12 and name   HG2) (resid 12 and name    HN)      4.8 3.0 0.0
assign (resid 12 and name    HA) (resid 13 and name    HN)      3.6 1.8 0.0
assign (resid 12 and name   HB1) (resid 13 and name    HN)      4.0 2.2 0.0
assign (resid 12 and name   HB2) (resid 13 and name    HN)      4.0 2.2 0.0
assign (resid 12 and name   HG2) (resid 13 and name    HN)      4.8 3.0 0.0
assign (resid 12 and name    HN) (resid 13 and name    HN)      2.8 1.0 0.0
assign (resid 12 and name    HN) (resid  8 and name    HA)      4.4 2.6 0.0
assign (resid 12 and name    HN) (resid  9 and name    HA)      3.5 1.7 0.0
assign (resid 13 and name    HA) (resid 13 and name    HN)      2.8 1.0 0.0
assign (resid 13 and name   HB1) (resid 13 and name    HN)      2.8 1.0 0.0
assign (resid 13 and name   HB2) (resid 13 and name    HN)      2.8 1.0 0.0
assign (resid 13 and name    HA) (resid 14 and name    HN)      3.6 1.8 0.0
assign (resid 13 and name   HB1) (resid 14 and name    HN)      3.6 1.8 0.0
assign (resid 13 and name   HB2) (resid 14 and name    HN)      4.0 2.2 0.0
assign (resid 13 and name    HN) (resid 14 and name    HN)      2.8 1.0 0.0
assign (resid 13 and name    HN) (resid 10 and name    HA)      3.5 1.7 0.0
assign (resid 13 and name    HN) (resid  9 and name    HA)      4.4 2.6 0.0
assign (resid 14 and name    HA) (resid 14 and name    HN)      2.8 1.0 0.0
assign (resid 14 and name   HB1) (resid 14 and name    HN)      3.6 1.2 0.0
assign (resid 14 and name   HB2) (resid 14 and name    HN)      3.2 1.2 0.0
assign (resid 14 and name    HA) (resid 15 and name    HN)      3.6 1.8 0.0
assign (resid 14 and name    HN) (resid 15 and name    HN)      2.8 2.0 0.0
assign (resid 14 and name    HN) (resid 13 and name   HD2)      4.0 2.2 0.0
assign (resid 14 and name    HN) (resid 11 and name    HA)      3.5 1.8 0.0
assign (resid 14 and name    HN) (resid 10 and name    HA)      4.4 2.6 0.0
assign (resid 15 and name    HA) (resid 15 and name    HN)      2.8 2.0 0.0
assign (resid 15 and name   HB1) (resid 15 and name    HN)      3.6 1.8 0.0
assign (resid 15 and name   HB2) (resid 15 and name    HN)      2.8 1.0 0.0
assign (resid 15 and name    HN) (resid 12 and name    HA)      3.5 1.7 0.0
assign (resid 15 and name    HN) (resid 11 and name    HA)      4.4 2.6 0.0
assign (resid 15 and name    HA) (resid 16 and name    HN)      3.6 1.8 0.0
assign (resid 15 and name   HB1) (resid 16 and name    HN)      4.8 3.0 0.0
assign (resid 15 and name   HB2) (resid 16 and name    HN)      4.8 3.0 0.0
assign (resid 15 and name    HN) (resid 16 and name    HN)      2.8 1.0 0.0
assign (resid 16 and name    HA) (resid 16 and name    HN)      2.8 1.0 0.0
assign (resid 16 and name   HB1) (resid 16 and name    HN)      3.6 1.8 0.0
assign (resid 16 and name   HB2) (resid 16 and name    HN)      3.6 1.8 0.0
assign (resid 16 and name    HA) (resid 17 and name    HN)      3.6 1.8 0.0
assign (resid 16 and name   HB1) (resid 17 and name    HN)      4.8 3.0 0.0
assign (resid 16 and name   HB2) (resid 17 and name    HN)      4.8 3.0 0.0
assign (resid 16 and name    HN) (resid 17 and name    HN)      2.8 1.0 0.0
assign (resid 16 and name    HN) (resid 12 and name    HA)      4.4 2.6 0.0
assign (resid 16 and name    HN) (resid 13 and name    HA)      3.5 1.7 0.0
assign (resid 17 and name    HA) (resid 17 and name    HN)      2.9 1.1 0.0
assign (resid 17 and name    HB) (resid 17 and name    HN)      2.8 0.8 0.0
assign (resid 17 and name  HG11) (resid 17 and name    HN)      3.2 1.4 0.0 
assign (resid 17 and name    HN) (resid 14 and name    HA)      3.5 1.7 0.0
assign (resid 18 and name    HA) (resid 19 and name    HN)      2.4 0.8 0.0
assign (resid 18 and name   HB1) (resid 19 and name    HN)      4.8 2.6 0.0
assign (resid 18 and name   HB2) (resid 19 and name    HN)      4.8 2.6 0.0
assign (resid 19 and name   HA1) (resid 19 and name    HN)      3.0 1.3 0.0
assign (resid 19 and name   HA2) (resid 19 and name    HN)      2.4 1.0 0.0
assign (resid 19 and name   HA1) (resid 20 and name    HN)      3.6 1.8 0.0
assign (resid 19 and name   HA2) (resid 20 and name    HN)      3.6 1.8 0.0
assign (resid 19 and name    HN) (resid 20 and name    HN)      2.6 0.8 0.0
assign (resid 20 and name    HA) (resid 20 and name    HN)      2.9 1.1 0.0
assign (resid 20 and name   HB1) (resid 20 and name    HN)      4.0 2.2 0.0
assign (resid 20 and name   HB2) (resid 20 and name    HN)      3.4 1.2 0.0
assign (resid 20 and name   HD1) (resid 20 and name    HN)      4.8 3.0 0.0
assign (resid 20 and name   HD2) (resid 20 and name    HN)      4.8 3.0 0.0
assign (resid 20 and name    HA) (resid 21 and name    HN)      2.8 1.0 0.0
assign (resid 20 and name    HN) (resid 21 and name    HN)      4.8 3.0 0.0
assign (resid 20 and name   HB2) (resid 21 and name    HN)      3.6 1.6 0.0
assign (resid 20 and name   HB1) (resid 21 and name    HN)      4.0 2.2 0.0
assign (resid 20 and name    HN) (resid 18 and name    HA)      4.0 2.2 0.0
assign (resid 21 and name    HA) (resid 21 and name    HN)      2.9 1.1 0.0
assign (resid 21 and name   HB2) (resid 21 and name    HN)      4.0 2.2 0.0
assign (resid 21 and name   HB1) (resid 21 and name    HN)      4.0 2.2 0.0
assign (resid 21 and name    HA) (resid 22 and name    HN)      3.6 1.8 0.0
assign (resid 21 and name   HB1) (resid 22 and name    HN)      4.8 3.0 0.0
assign (resid 21 and name   HB2) (resid 22 and name    HN)      4.8 3.0 0.0
assign (resid 21 and name    HN) (resid 22 and name    HN)      2.6 0.6 0.0
assign (resid 21 and name    HN) (resid 38 and name    HN)      4.0 2.2 0.0
assign (resid 22 and name   HA1) (resid 22 and name    HN)      2.9 1.1 0.0
assign (resid 22 and name   HA2) (resid 22 and name    HN)      2.9 1.1 0.0
assign (resid 22 and name   HA1) (resid 23 and name    HN)      3.2 1.4 0.0
assign (resid 22 and name   HA2) (resid 23 and name    HN)      2.6 0.6 0.0
assign (resid 22 and name    HN) (resid 23 and name    HN)      4.6 2.6 0.0
assign (resid 22 and name    HN) (resid 36 and name    HN)      3.6 1.8 0.0
assign (resid 22 and name    HN) (resid 14 and name   HB1)      4.8 3.0 0.0
assign (resid 23 and name   HA1) (resid 23 and name    HN)      2.9 1.1 0.0
assign (resid 23 and name   HA2) (resid 23 and name    HN)      2.9 1.1 0.0
assign (resid 23 and name   HA1) (resid 24 and name    HN)      2.8 0.8 0.0
assign (resid 23 and name   HA2) (resid 24 and name    HN)      2.8 0.8 0.0
assign (resid 24 and name    HA) (resid 24 and name    HN)      2.9 1.0 0.0
assign (resid 24 and name   HB1) (resid 24 and name    HN)      4.8 3.0 0.0
assign (resid 24 and name   HB2) (resid 24 and name    HN)      4.8 3.0 0.0
assign (resid 24 and name    HA) (resid 25 and name    HN)      2.4 0.4 0.0
assign (resid 24 and name   HB1) (resid 25 and name    HN)      4.0 2.2 0.0
assign (resid 24 and name   HB2) (resid 25 and name    HN)      4.0 2.2 0.0
assign (resid 24 and name    HN) (resid 25 and name    HN)      4.8 3.0 0.0
assign (resid 24 and name    HN) (resid 34 and name    HB)      4.4 2.6 0.0
assign (resid 24 and name    HN) (resid 35 and name    HA)      3.6 1.6 0.0
assign (resid 24 and name    HN) (resid 34 and name    HN)      3.6 1.6 0.0
assign (resid 25 and name    HA) (resid 25 and name    HN)      2.9 1.0 0.0
assign (resid 25 and name   HB1) (resid 25 and name    HN)      4.0 2.2 0.0
assign (resid 25 and name   HB2) (resid 25 and name    HN)      3.2 1.2 0.0
assign (resid 25 and name    HA) (resid 26 and name    HN)      2.4 0.6 0.0
assign (resid 25 and name   HB1) (resid 26 and name    HN)      4.8 3.0 0.0
assign (resid 25 and name   HB2) (resid 26 and name    HN)      4.8 3.0 0.0
assign (resid 26 and name   HA1) (resid 26 and name    HN)      2.9 1.8 0.0
assign (resid 26 and name   HA2) (resid 26 and name    HN)      2.9 0.8 0.0
assign (resid 26 and name   HA1) (resid 27 and name    HN)      3.2 1.4 0.0
assign (resid 26 and name   HA2) (resid 27 and name    HN)      2.6 0.6 0.0
assign (resid 26 and name    HN) (resid 32 and name    HN)      3.6 1.5 0.0
assign (resid 26 and name    HN) (resid 33 and name    HA)      3.6 1.8 0.0
assign (resid 27 and name   HA1) (resid 27 and name    HN)      3.0 1.2 0.0
assign (resid 27 and name   HA2) (resid 27 and name    HN)      2.6 0.6 0.0
assign (resid 27 and name   HA1) (resid 28 and name    HN)      2.6 0.8 0.0
assign (resid 27 and name   HA2) (resid 28 and name    HN)      3.4 1.6 0.0
assign (resid 27 and name    HN) (resid 28 and name    HN)      4.4 2.6 0.0
assign (resid 28 and name    HA) (resid 28 and name    HN)      2.9 1.1 0.0
assign (resid 28 and name   HB1) (resid 28 and name    HN)      3.2 1.2 0.0
assign (resid 28 and name   HB2) (resid 28 and name    HN)      3.2 1.2 0.0
assign (resid 28 and name    HA) (resid 29 and name    HN)      2.4 0.4 0.0
assign (resid 28 and name   HB#) (resid 29 and name    HN)      4.4 2.6 0.0
assign (resid 28 and name    HN) (resid 29 and name    HN)      4.8 2.6 0.0
assign (resid 29 and name    HA) (resid 29 and name    HN)      2.2 0.4 0.0
assign (resid 29 and name   HB1) (resid 29 and name    HN)      4.8 3.0 0.0
assign (resid 29 and name   HB2) (resid 29 and name    HN)      4.8 3.0 0.0
assign (resid 29 and name   HD2) (resid 29 and name    HN)      2.8 1.0 0.0
assign (resid 29 and name    HA) (resid 30 and name    HN)      3.4 1.4 0.0
assign (resid 29 and name   HD2) (resid 30 and name    HN)      4.8 3.0 0.0
assign (resid 29 and name    HN) (resid 30 and name    HN)      2.8 1.0 0.0
assign (resid 30 and name    HA) (resid 30 and name    HN)      2.4 0.6 0.0
assign (resid 30 and name   HB1) (resid 30 and name    HN)      3.6 1.8 0.0
assign (resid 30 and name   HB2) (resid 30 and name    HN)      3.6 1.8 0.0
assign (resid 30 and name    HN) (resid 28 and name    HA)      4.0 2.2 0.0
assign (resid 30 and name    HA) (resid 31 and name    HN)      3.2 1.4 0.0
assign (resid 30 and name    HN) (resid 31 and name    HN)      2.8 1.0 0.0
assign (resid 30 and name    HN) (resid 32 and name    HN)      4.8 3.0 0.0
assign (resid 31 and name    HA) (resid 31 and name    HN)      2.9 1.1 0.0
assign (resid 31 and name   HB2) (resid 31 and name    HN)      2.8 0.8 0.0
assign (resid 31 and name   HB1) (resid 31 and name    HN)      4.0 2.2 0.0
assign (resid 31 and name    HG) (resid 31 and name    HN)      3.2 1.4 0.0
assign (resid 31 and name  HD1#) (resid 31 and name    HN)      5.4 4.0 0.0
assign (resid 31 and name  HD2#) (resid 31 and name    HN)      5.4 4.0 0.0
assign (resid 31 and name    HA) (resid 32 and name    HN)      3.6 1.8 0.0
assign (resid 31 and name    HN) (resid 32 and name    HN)      2.8 1.0 0.0
assign (resid 31 and name    HN) (resid 29 and name   HB1)      4.8 3.0 0.0
assign (resid 31 and name    HN) (resid 29 and name   HB2)      4.8 3.0 0.0
assign (resid 31 and name   HB1) (resid 32 and name    HN)      4.8 3.0 0.0
assign (resid 31 and name   HB2) (resid 32 and name    HN)      4.8 3.0 0.0
assign (resid 32 and name    HA) (resid 32 and name    HN)      2.9 1.1 0.0
assign (resid 32 and name   HB1) (resid 32 and name    HN)      2.8 1.0 0.0
assign (resid 32 and name   HB2) (resid 32 and name    HN)      2.8 1.0 0.0
assign (resid 32 and name   HG#) (resid 32 and name    HN)      5.0 3.2 0.0
assign (resid 32 and name    HA) (resid 33 and name    HN)      2.4 0.4 0.0
assign (resid 32 and name   HB1) (resid 33 and name    HN)      4.8 2.8 0.0
assign (resid 32 and name   HB2) (resid 33 and name    HN)      4.4 2.4 0.0
assign (resid 32 and name    HN) (resid 33 and name    HN)      4.7 2.9 0.0
assign (resid 33 and name    HA) (resid 33 and name    HN)      2.9 1.1 0.0
assign (resid 33 and name   HB1) (resid 33 and name    HN)      3.6 1.6 0.0
assign (resid 33 and name   HB2) (resid 33 and name    HN)      2.6 0.6 0.0
assign (resid 33 and name    HN) (resid  2 and name   HD#)      6.8 3.6 0.0
assign (resid 33 and name    HA) (resid 34 and name    HN)      2.2 0.6 0.0
assign (resid 33 and name   HB1) (resid 34 and name    HN)      4.8 3.0 0.0
assign (resid 33 and name   HB2) (resid 34 and name    HN)      4.8 3.0 0.0
assign (resid 33 and name    HN) (resid 34 and name    HN)      4.8 3.0 0.0
assign (resid 34 and name    HA) (resid 34 and name    HN)      2.9 1.1 0.0
assign (resid 34 and name    HB) (resid 34 and name    HN)      2.4 0.6 0.0
assign (resid 34 and name  HG2#) (resid 34 and name    HN)      4.8 3.0 0.0
assign (resid 34 and name    HA) (resid 35 and name    HN)      2.4 0.6 0.0
assign (resid 34 and name  HG2#) (resid 35 and name    HN)      3.8 2.0 0.0
assign (resid 34 and name    HB) (resid 35 and name    HN)      4.8 3.0 0.0
assign (resid 34 and name    HN) (resid 35 and name    HN)      4.6 2.8 0.0
assign (resid 34 and name    HN) (resid 25 and name    HA)      3.6 1.6 0.0
assign (resid 35 and name    HA) (resid 35 and name    HN)      2.9 1.1 0.0
assign (resid 35 and name   HB2) (resid 35 and name    HN)      2.8 0.8 0.0
assign (resid 35 and name   HB1) (resid 35 and name    HN)      4.0 2.2 0.0
assign (resid 35 and name    HA) (resid 36 and name    HN)      2.4 0.6 0.0
assign (resid 36 and name    HA) (resid 36 and name    HN)      2.9 1.1 0.0
assign (resid 36 and name   HB1) (resid 36 and name    HN)      4.8 3.0 0.0
assign (resid 36 and name   HB2) (resid 36 and name    HN)      4.8 3.0 0.0
assign (resid 36 and name    HN) (resid 23 and name   HA1)      4.4 2.6 0.0
assign (resid 36 and name    HN) (resid 23 and name   HA2)      3.6 1.8 0.0
assign (resid 36 and name    HN) (resid 14 and name   HB1)      4.8 4.0 0.0
assign (resid 36 and name    HN) (resid 37 and name    HN)      4.8 3.0 0.0
assign (resid 36 and name    HA) (resid 37 and name    HN)      2.4 0.6 0.0
assign (resid 36 and name   HB1) (resid 37 and name    HN)      4.0 0.6 0.0
assign (resid 36 and name   HB2) (resid 37 and name    HN)      3.2 0.6 0.0
assign (resid 37 and name    HA) (resid 37 and name    HN)      2.9 1.1 0.0
assign (resid 37 and name   HB1) (resid 37 and name    HN)      3.6 1.8 0.0
assign (resid 37 and name   HB2) (resid 37 and name    HN)      3.6 1.8 0.0
assign (resid 37 and name   HG1) (resid 37 and name    HN)      4.0 2.2 0.0
assign (resid 37 and name   HG2) (resid 37 and name    HN)      4.0 2.2 0.0
assign (resid 37 and name    HA) (resid 38 and name    HN)      2.2 0.4 0.0
assign (resid 37 and name    HN) (resid 38 and name    HN)      4.6 0.6 0.0
assign (resid 37 and name   HB1) (resid 38 and name    HN)      4.0 2.2 0.0
assign (resid 37 and name   HB2) (resid 38 and name    HN)      4.0 2.2 0.0
assign (resid 38 and name    HA) (resid 38 and name    HN)      2.9 1.1 0.0
assign (resid 38 and name   HB1) (resid 38 and name    HN)      2.8 1.0 0.0
assign (resid 38 and name   HB2) (resid 38 and name    HN)      2.8 1.0 0.0
assign (resid 38 and name    HN) (resid 20 and name    HA)      4.4 2.2 0.0
assign (resid 38 and name    HA) (resid 39 and name    HN)      2.4 0.4 0.0
assign (resid 38 and name   HB1) (resid 39 and name    HN)      4.4 2.6 0.0
assign (resid 38 and name   HB2) (resid 39 and name    HN)      4.4 2.6 0.0
assign (resid 39 and name   HA1) (resid 39 and name    HN)      2.6 0.8 0.0
assign (resid 39 and name   HA2) (resid 39 and name    HN)      2.9 0.8 0.0
assign (resid 11 and name    HE1) (resid 22 and name   HA1)     3.6 1.8 0.0
assign (resid 11 and name    HE1) (resid 22 and name   HA2)     4.0 2.2 0.0
assign (resid 13 and name    HE1) (resid 17 and name   HD#)     4.4 2.6 0.0
assign (resid 11 and name    HD2) (resid 11 and name    HA)     4.8 3.0 0.0
assign (resid 11 and name    HD2) (resid 12 and name    HA)     4.8 3.0 0.0
assign (resid 13 and name    HD2) (resid 13 and name    HA)     4.8 3.0 0.0
assign (resid 13 and name    HD2) (resid 14 and name    HA)     4.4 2.6 0.0
assign (resid 13 and name    HD2) (resid  2 and name   HB1)     4.8 3.0 0.0
assign (resid 13 and name    HD2) (resid  2 and name   HB2)     4.8 3.0 0.0
assign (resid 29 and name    HD2) (resid 28 and name    HA)     4.8 3.0 0.0
assign (resid 29 and name    HD2) (resid 29 and name    HA)     2.8 1.0 0.0
assign (resid 29 and name    HD2) (resid 29 and name   HB1)     4.8 3.0 0.0
assign (resid 29 and name    HD2) (resid 29 and name   HB2)     4.8 3.0 0.0
assign (resid 24 and name    HE#) (resid 26 and name   HA1)     5.6 3.6 0.0
assign (resid 24 and name    HE#) (resid 26 and name   HA2)     6.0 4.0 0.0
assign (resid 24 and name    HE#) (resid 34 and name  HG2#)     4.4 2.6 0.0
assign (resid 24 and name    HD#) (resid 34 and name    HB)     5.8 4.0 0.0
assign (resid 24 and name    HE#) (resid 34 and name    HB)     5.4 3.6 0.0
assign (resid  2 and name    HD#) (resid  1 and name   HA1)     5.8 4.0 0.0
assign (resid  2 and name    HD#) (resid  1 and name   HA2)     5.8 4.0 0.0
assign (resid 36 and name    HD#) (resid 23 and name   HA2)     5.8 4.0 0.0
assign (resid 36 and name    HD#) (resid 21 and name   HB1)     5.8 4.0 0.0
assign (resid 36 and name    HD#) (resid 21 and name   HB2)     5.8 4.0 0.0
assign (resid 36 and name    HE#) (resid 21 and name   HB1)     5.4 3.6 0.0
assign (resid 35 and name     HA) (resid 23 and name   HA1)     2.6 0.4 0.0
assign (resid 35 and name     HA) (resid 23 and name   HA2)     2.6 0.4 0.0
assign (resid 35 and name     HA) (resid 14 and name   HB1)     4.8 3.0 0.0
assign (resid 35 and name     HA) (resid 14 and name   HB2)     4.8 3.0 0.0
assign (resid 25 and name     HA) (resid 33 and name    HA)     2.8 0.8 0.0
assign (resid 25 and name     HA) (resid 26 and name   HA1)     4.8 3.0 0.0
assign (resid 25 and name     HA) (resid 26 and name   HA2)     4.8 3.0 0.0
assign (resid 36 and name     HA) (resid 36 and name   HB1)     2.4 0.6 0.0
assign (resid 36 and name     HA) (resid 36 and name   HB2)     2.6 0.6 0.0
assign (resid  5 and name     HA) (resid  4 and name   HB1)     3.8 2.0 0.0
assign (resid  4 and name     HA) (resid  5 and name    HA)     2.4 0.4 0.0
assign (resid  5 and name     HA) (resid 25 and name   HB1)     4.4 2.6 0.0
assign (resid  5 and name     HA) (resid 25 and name   HB2)     4.4 2.6 0.0
assign (resid  5 and name     HA) (resid 30 and name   HG1)     4.8 3.0 0.0
assign (resid  5 and name     HA) (resid 30 and name   HG2)     4.8 3.0 0.0
assign (resid  5 and name    HD1) (resid 31 and name  HD2#)     3.6 1.8 0.0
assign (resid  4 and name     HA) (resid  5 and name   HD1)     4.8 0.8 0.0
assign (resid  4 and name     HA) (resid 31 and name    HA)     4.8 3.0 0.0
assign (resid  4 and name     HA) (resid 25 and name   HB1)     4.8 0.8 0.0
assign (resid 31 and name     HA) (resid 4 and name    HB1)     3.0 1.2 0.0
assign (resid 31 and name     HA) (resid 4 and name    HB2)     3.0 1.2 0.0
assign (resid 31 and name     HA) (resid 5 and name    HD1)     4.8 3.0 0.0
assign (resid 38 and name     HA) (resid 21 and name   HB1)     4.4 2.4 0.0
assign (resid 38 and name     HA) (resid 21 and name   HB2)     3.2 1.0 0.0
assign (resid 10 and name     HA) (resid 13 and name   HB1)     4.4 2.4 0.0
assign (resid 10 and name     HA) (resid 13 and name   HB2)     4.4 2.4 0.0
assign (resid 10 and name     HA) (resid  2 and name   HB1)     3.6 1.0 0.0
assign (resid 10 and name     HA) (resid  2 and name   HB2)     4.8 3.0 0.0
assign (resid  7 and name     HA) (resid 10 and name   HB1)     4.4 2.6 0.0
assign (resid  7 and name     HA) (resid 10 and name   HB2)     4.4 2.6 0.0
assign (resid 37 and name     HA) (resid 20 and name   HD1)     4.8 3.0 0.0
assign (resid 37 and name     HA) (resid 20 and name   HD2)     4.8 3.0 0.0
assign (resid 37 and name     HA) (resid 20 and name   HA)      2.6 0.2 0.0
assign (resid 26 and name    HA1) (resid 30 and name    HA)     4.8 3.0 0.0
assign (resid 26 and name    HA2) (resid 30 and name    HA)     3.6 1.6 0.0
assign (resid 26 and name    HA2) (resid 30 and name   HB1)     4.8 3.0 0.0
assign (resid 26 and name    HA2) (resid 30 and name   HB2)     4.8 3.0 0.0
assign (resid  3 and name    HA1) (resid  9 and name   HB1)     3.6 1.8 0.0
assign (resid  3 and name    HA1) (resid  9 and name   HB2)     3.6 1.8 0.0
assign (resid  3 and name    HA2) (resid  9 and name   HB1)     4.8 3.0 0.0
assign (resid 17 and name     HA) (resid 18 and name   HD1)     2.4 0.6 0.0
assign (resid 17 and name     HA) (resid 18 and name   HD2)     2.4 0.6 0.0
assign (resid 17 and name     HA) (resid 18 and name   HG1)     5.0 3.2 0.0
assign (resid 17 and name     HA) (resid 18 and name   HG2)     5.0 3.2 0.0
assign (resid 18 and name    HD1) (resid  17 and name HG2#)     4.0 2.2 0.0
assign (resid 18 and name    HD2) (resid  17 and name HG2#)     4.0 2.2 0.0
assign (resid  9 and name     HA) (resid  12 and name  HB1)     3.6 1.6 0.0
assign (resid  9 and name     HA) (resid  12 and name  HB2)     3.6 1.6 0.0
assign (resid 11 and name     HA) (resid  14 and name  HB1)     4.4 2.4 0.0
assign (resid 11 and name     HA) (resid  14 and name  HB2)     4.4 2.4 0.0
assign (resid 14 and name     HA) (resid  17 and name HD2#)     4.8 3.0 0.0
assign (resid 29 and name    HB1) (resid  31 and name   HG)     3.6 1.8 0.0
assign (resid 29 and name    HB2) (resid  31 and name   HG)     3.6 1.8 0.0
assign (resid 20 and name    HG1) (resid  17 and name HG2#)     5.8 4.0 0.0
assign (resid 20 and name    HG2) (resid  17 and name HG2#)     5.8 4.0 0.0
assign (resid 35 and name    HB1) (resid  14 and name  HB1)     3.2 1.6 0.0
assign (resid 27 and name    HA1) (resid  32 and name  HB1)     4.8 3.0 0.0
assign (resid 27 and name    HA1) (resid  32 and name  HB2)     4.8 3.0 0.0
assign (resid 25 and name     HN) (resid   7 and name   HA)     4.4 0.4 0.0
assign (resid 28 and name    HE3) (resid  29 and name  HB1)     4.8 3.0 0.0
assign (resid 28 and name    HD1) (resid  29 and name  HE1)     4.8 3.0 0.0
assign (resid 28 and name    HE1) (resid  29 and name  HE1)     4.8 3.0 0.0
assign (resid 28 and name    HE3) (resid  31 and name HD1#)     4.4 2.6 0.0
assign (resid 28 and name    HZ3) (resid  31 and name HD1#)     3.4 1.6 0.0
assign (resid  8 and name    HD#) (resid   9 and name  HB2)     6.8 5.0 0.0
assign (resid  8 and name    HD#) (resid   9 and name  HA)      5.8 4.0 0.0
assign (resid  2 and name    HD#) (resid  33 and name  HB2)     5.6 2.6 0.0
assign (resid  2 and name    HB2) (resid  33 and name  HB2)     4.0 1.2 0.0
assign (resid 11 and name    HD2) (resid  15 and name  HE1)     4.8 3.0 0.0
assign (resid 11 and name    HD2) (resid  15 and name  HE2)     4.8 3.0 0.0
assign (resid 11 and name    HE1) (resid  15 and name  HE2)     4.8 3.0 0.0
assign (resid 11 and name    HE1) (resid  15 and name  HE1)     4.8 3.0 0.0
assign (resid 24 and name    HD#) (resid  36 and name  HE#)     6.8 5.0 0.0
assign (resid 25 and name    HB1) (resid  30 and name  HG1)     4.8 3.0 0.0
assign (resid 25 and name    HB1) (resid  30 and name  HG2)     4.8 3.0 0.0
assign (resid 14 and name    HB1) (resid  20 and name  HB1)     4.8 3.0 0.0
assign (resid 35 and name    HB1) (resid  20 and name  HB1)     4.8 3.0 0.0
assign (resid 21 and name     HA) (resid  15 and name   HA)     4.8 3.0 0.0
assign (resid 21 and name     HA) (resid  38 and name   HA)     5.2 1.2 0.0
assign (resid 21 and name     HN) (resid  38 and name   HA)     4.8 0.8 0.0
assign (resid 21 and name    HB2) (resid  38 and name  HB2)     2.8 0.8 0.0
assign (resid 22 and name    HA2) (resid  11 and name   HA)     4.8 0.8 0.0
assign (resid 22 and name    HA2) (resid  15 and name  HG1)     4.8 3.0 0.0
assign (resid 22 and name    HA2) (resid  15 and name  HG2)     4.8 3.0 0.0
                                             

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H    GLY   1          1H        GLY   1  -8.678   4.293   3.304
    2   2H    GLY   1          2H        GLY   1  -7.643   3.365   2.325
    3   3H    GLY   1          3H        GLY   1  -8.473   4.696   1.669
    4   1HA   GLY   1          2HA       GLY   1  -7.154   6.248   2.752
    5   2HA   GLY   1          1HA       GLY   1  -6.579   5.048   3.908
    6    H    PHE   2           H        PHE   2  -4.657   6.489   2.698
    7    HA   PHE   2           HA       PHE   2  -2.701   6.345   1.413
    8   1HB   PHE   2          2HB       PHE   2  -3.364   3.386   1.363
    9   2HB   PHE   2          1HB       PHE   2  -1.779   4.111   1.099
   10    HD1  PHE   2           HD1      PHE   2  -3.976   2.711   3.517
   11    HD2  PHE   2           HD2      PHE   2  -0.880   5.650   3.034
   12    HE1  PHE   2           HE1      PHE   2  -3.555   2.668   5.960
   13    HE2  PHE   2           HE2      PHE   2  -0.458   5.607   5.478
   14    HZ   PHE   2           HZ       PHE   2  -1.796   4.116   6.941
   15    H    GLY   3           H        GLY   3  -5.299   6.734   0.011
   16   1HA   GLY   3          2HA       GLY   3  -5.970   6.992  -2.214
   17   2HA   GLY   3          1HA       GLY   3  -4.360   6.465  -2.697
   18    H    CYS   4           H        CYS   4  -7.050   4.849  -0.951
   19    HA   CYS   4           HA       CYS   4  -6.724   2.545  -2.821
   20   1HB   CYS   4          2HB       CYS   4  -7.613   2.772   0.041
   21   2HB   CYS   4          1HB       CYS   4  -8.163   1.410  -0.933
   22    HA   PRO   5           HA       PRO   5  -7.967   0.657  -2.858
   23   1HB   PRO   5          2HB       PRO   5  -9.270  -0.554  -4.947
   24   2HB   PRO   5          1HB       PRO   5  -9.873  -0.555  -3.281
   25   1HG   PRO   5          2HG       PRO   5 -10.862   0.983  -5.628
   26   2HG   PRO   5          1HG       PRO   5 -11.725   0.502  -4.159
   27   1HD   PRO   5          2HD       PRO   5 -10.652   3.080  -4.727
   28   2HD   PRO   5          1HD       PRO   5 -11.317   2.525  -3.176
   29    H    ASN   6           H        ASN   6  -7.452   3.228  -4.647
   30    HA   ASN   6           HA       ASN   6  -6.650   2.457  -7.246
   31   1HB   ASN   6          2HB       ASN   6  -6.730   4.815  -6.162
   32   2HB   ASN   6          1HB       ASN   6  -5.094   4.459  -5.614
   33   1HD2  ASN   6          1HD2      ASN   6  -7.020   5.332  -8.396
   34   2HD2  ASN   6          2HD2      ASN   6  -5.739   5.391  -9.508
   35    H    ASN   7           H        ASN   7  -4.952   1.286  -8.012
   36    HA   ASN   7           HA       ASN   7  -3.187  -0.097  -6.142
   37   1HB   ASN   7          2HB       ASN   7  -3.437  -0.075  -9.157
   38   2HB   ASN   7          1HB       ASN   7  -2.169  -0.979  -8.330
   39   1HD2  ASN   7          1HD2      ASN   7  -2.934  -2.669  -6.718
   40   2HD2  ASN   7          2HD2      ASN   7  -4.440  -3.409  -6.973
   41    H    TYR   8           H        TYR   8  -2.835   2.521  -8.521
   42    HA   TYR   8           HA       TYR   8   0.019   2.728  -8.388
   43   1HB   TYR   8          2HB       TYR   8  -1.595   3.790 -10.096
   44   2HB   TYR   8          1HB       TYR   8  -1.851   5.050  -8.890
   45    HD1  TYR   8           HD1      TYR   8  -0.237   6.761  -8.528
   46    HD2  TYR   8           HD2      TYR   8   0.751   3.345 -10.940
   47    HE1  TYR   8           HE1      TYR   8   1.858   7.874  -9.248
   48    HE2  TYR   8           HE2      TYR   8   2.847   4.458 -11.657
   49    HH   TYR   8           HH       TYR   8   4.325   6.684 -10.236
   50    H    GLN   9           H        GLN   9  -2.526   4.629  -6.721
   51    HA   GLN   9           HA       GLN   9  -0.720   6.148  -5.104
   52   1HB   GLN   9          2HB       GLN   9  -3.613   5.382  -4.612
   53   2HB   GLN   9          1HB       GLN   9  -2.726   6.595  -3.688
   54   1HG   GLN   9          2HG       GLN   9  -2.819   6.794  -6.687
   55   2HG   GLN   9          1HG       GLN   9  -4.193   7.352  -5.735
   56   1HE2  GLN   9          1HE2      GLN   9  -3.852   9.190  -4.279
   57   2HE2  GLN   9          2HE2      GLN   9  -2.490  10.190  -4.433
   58    H    CYS  10           H        CYS  10  -2.391   3.054  -4.514
   59    HA   CYS  10           HA       CYS  10  -1.500   2.740  -1.799
   60   1HB   CYS  10          2HB       CYS  10  -3.332   1.416  -3.019
   61   2HB   CYS  10          1HB       CYS  10  -2.023   0.466  -3.721
   62    H    HIS  11           H        HIS  11  -0.156   1.719  -4.930
   63    HA   HIS  11           HA       HIS  11   2.084   0.277  -3.854
   64   1HB   HIS  11          2HB       HIS  11   1.113   0.335  -6.291
   65   2HB   HIS  11          1HB       HIS  11   2.193   1.713  -6.497
   66    HD1  HIS  11           HD1      HIS  11   2.155  -1.868  -6.777
   67    HD2  HIS  11           HD2      HIS  11   5.006   0.940  -5.614
   68    HE1  HIS  11           HE1      HIS  11   4.407  -3.020  -6.944
   69    H    ARG  12           H        ARG  12   1.583   3.675  -4.752
   70    HA   ARG  12           HA       ARG  12   4.290   4.555  -4.502
   71   1HB   ARG  12          2HB       ARG  12   2.170   5.806  -5.400
   72   2HB   ARG  12          1HB       ARG  12   1.962   6.295  -3.718
   73   1HG   ARG  12          2HG       ARG  12   4.209   7.265  -3.690
   74   2HG   ARG  12          1HG       ARG  12   4.490   6.714  -5.341
   75   1HD   ARG  12          2HD       ARG  12   3.362   8.462  -6.220
   76   2HD   ARG  12          1HD       ARG  12   2.017   8.252  -5.099
   77    HE   ARG  12           HE       ARG  12   3.585   9.463  -3.413
   78   1HH1  ARG  12          1HH2      ARG  12   2.087  11.252  -5.339
   79   2HH1  ARG  12          2HH2      ARG  12   3.356  12.271  -5.931
   80   1HH2  ARG  12          2HH1      ARG  12   5.905  10.186  -4.818
   81   2HH2  ARG  12          1HH1      ARG  12   5.526  11.665  -5.635
   82    H    HIS  13           H        HIS  13   1.678   4.225  -2.105
   83    HA   HIS  13           HA       HIS  13   3.083   5.420   0.094
   84   1HB   HIS  13          2HB       HIS  13   0.687   5.102   0.245
   85   2HB   HIS  13          1HB       HIS  13   0.853   3.364   0.002
   86    HD1  HIS  13           HD1      HIS  13   2.319   5.914   2.457
   87    HD2  HIS  13           HD2      HIS  13   0.736   2.058   2.416
   88    HE1  HIS  13           HE1      HIS  13   2.377   5.090   4.852
   89    H    CYS  14           H        CYS  14   2.825   2.050  -1.047
   90    HA   CYS  14           HA       CYS  14   4.383   0.872   1.050
   91   1HB   CYS  14          2HB       CYS  14   4.021  -0.036  -1.822
   92   2HB   CYS  14          1HB       CYS  14   4.642  -1.032  -0.507
   93    H    LYS  15           H        LYS  15   5.259   2.412  -2.009
   94    HA   LYS  15           HA       LYS  15   8.011   1.610  -2.064
   95   1HB   LYS  15          2HB       LYS  15   6.534   3.957  -3.274
   96   2HB   LYS  15          1HB       LYS  15   8.256   3.684  -3.541
   97   1HG   LYS  15          2HG       LYS  15   6.804   1.222  -3.953
   98   2HG   LYS  15          1HG       LYS  15   6.099   2.503  -4.938
   99   1HD   LYS  15          2HD       LYS  15   8.208   2.982  -5.982
  100   2HD   LYS  15          1HD       LYS  15   9.076   1.959  -4.835
  101   1HE   LYS  15          2HE       LYS  15   7.974  -0.032  -5.713
  102   2HE   LYS  15          1HE       LYS  15   6.986   0.953  -6.790
  103   1HZ   LYS  15          1HZ       LYS  15   8.925  -0.036  -7.899
  104   2HZ   LYS  15          2HZ       LYS  15   9.954   0.830  -6.861
  105   3HZ   LYS  15          3HZ       LYS  15   8.948   1.659  -7.952
  106    H    SER  16           H        SER  16   6.403   4.511  -0.705
  107    HA   SER  16           HA       SER  16   8.837   5.769   0.163
  108   1HB   SER  16          2HB       SER  16   7.287   7.050   1.724
  109   2HB   SER  16          1HB       SER  16   6.899   7.157   0.012
  110    HG   SER  16           HG       SER  16   5.077   6.199   0.410
  111    H    ILE  17           H        ILE  17   6.818   3.255   1.572
  112    HA   ILE  17           HA       ILE  17   7.907   3.437   4.249
  113    HB   ILE  17           HB       ILE  17   6.617   1.082   2.824
  114   1HG1  ILE  17          2HG1      ILE  17   5.293   2.819   4.893
  115   2HG1  ILE  17          1HG1      ILE  17   5.355   3.365   3.218
  116   1HG2  ILE  17          1HG2      ILE  17   7.976   0.473   4.837
  117   2HG2  ILE  17          2HG2      ILE  17   6.252   0.177   5.062
  118   3HG2  ILE  17          3HG2      ILE  17   7.005   1.595   5.791
  119   1HD1  ILE  17          1HD1      ILE  17   4.585   0.604   3.243
  120   2HD1  ILE  17          2HD1      ILE  17   3.654   1.995   2.688
  121   3HD1  ILE  17          3HD1      ILE  17   3.557   1.484   4.373
  122    HA   PRO  18           HA       PRO  18  11.839   1.629   3.297
  123   1HB   PRO  18          2HB       PRO  18  12.684   1.371   5.903
  124   2HB   PRO  18          1HB       PRO  18  12.696   2.902   5.009
  125   1HG   PRO  18          2HG       PRO  18  10.827   1.990   7.150
  126   2HG   PRO  18          1HG       PRO  18  11.304   3.637   6.703
  127   1HD   PRO  18          2HD       PRO  18   8.872   2.386   6.005
  128   2HD   PRO  18          1HD       PRO  18   9.527   3.865   5.270
  129    H    GLY  19           H        GLY  19  12.523  -0.471   3.020
  130   1HA   GLY  19          2HA       GLY  19  12.777  -2.790   3.452
  131   2HA   GLY  19          1HA       GLY  19  11.771  -2.606   4.889
  132    H    ARG  20           H        ARG  20  10.897  -1.586   1.602
  133    HA   ARG  20           HA       ARG  20   9.007  -3.854   1.360
  134   1HB   ARG  20          2HB       ARG  20   8.258  -1.060   1.913
  135   2HB   ARG  20          1HB       ARG  20   7.417  -1.771   0.539
  136   1HG   ARG  20          2HG       ARG  20   6.012  -2.556   2.163
  137   2HG   ARG  20          1HG       ARG  20   7.230  -3.822   2.299
  138   1HD   ARG  20          2HD       ARG  20   8.020  -3.036   4.297
  139   2HD   ARG  20          1HD       ARG  20   7.754  -1.350   3.856
  140    HE   ARG  20           HE       ARG  20   5.392  -1.628   4.485
  141   1HH1  ARG  20          2HH1      ARG  20   7.081  -2.535   6.870
  142   2HH1  ARG  20          1HH1      ARG  20   6.260  -3.989   7.328
  143   1HH2  ARG  20          1HH2      ARG  20   4.509  -4.253   4.334
  144   2HH2  ARG  20          2HH2      ARG  20   4.804  -4.967   5.884
  145    H    CYS  21           H        CYS  21   7.823  -3.627  -0.845
  146    HA   CYS  21           HA       CYS  21   9.579  -2.367  -2.893
  147   1HB   CYS  21          2HB       CYS  21   9.352  -5.189  -2.399
  148   2HB   CYS  21          1HB       CYS  21   8.633  -4.828  -3.969
  149    H    GLY  22           H        GLY  22   6.553  -4.250  -2.489
  150   1HA   GLY  22          2HA       GLY  22   5.120  -2.131  -3.997
  151   2HA   GLY  22          1HA       GLY  22   4.986  -3.793  -4.570
  152    H    GLY  23           H        GLY  23   2.618  -2.809  -3.954
  153   1HA   GLY  23          2HA       GLY  23   1.783  -4.364  -1.639
  154   2HA   GLY  23          1HA       GLY  23   1.645  -2.631  -1.363
  155    H    TYR  24           H        TYR  24  -0.692  -3.628  -1.175
  156    HA   TYR  24           HA       TYR  24  -2.115  -2.847  -3.630
  157   1HB   TYR  24          2HB       TYR  24  -3.351  -4.921  -3.863
  158   2HB   TYR  24          1HB       TYR  24  -1.632  -5.307  -3.891
  159    HD1  TYR  24           HD1      TYR  24  -4.776  -5.669  -2.084
  160    HD2  TYR  24           HD2      TYR  24  -0.526  -6.260  -1.853
  161    HE1  TYR  24           HE1      TYR  24  -5.091  -7.174  -0.140
  162    HE2  TYR  24           HE2      TYR  24  -0.844  -7.765   0.092
  163    HH   TYR  24           HH       TYR  24  -3.392  -9.274   0.851
  164    H    CYS  25           H        CYS  25  -4.496  -2.690  -3.216
  165    HA   CYS  25           HA       CYS  25  -4.990  -1.748  -0.464
  166   1HB   CYS  25          2HB       CYS  25  -6.627  -1.657  -3.010
  167   2HB   CYS  25          1HB       CYS  25  -7.237  -1.086  -1.457
  168    H    GLY  26           H        GLY  26  -5.555  -3.294   0.996
  169   1HA   GLY  26          2HA       GLY  26  -7.946  -4.855   0.695
  170   2HA   GLY  26          1HA       GLY  26  -6.536  -5.881   0.430
  171    H    GLY  27           H        GLY  27  -8.493  -5.910   2.661
  172   1HA   GLY  27          2HA       GLY  27  -7.482  -6.821   4.848
  173   2HA   GLY  27          1HA       GLY  27  -6.688  -5.250   4.954
  174    H    TRP  28           H        TRP  28  -8.455  -3.402   4.464
  175    HA   TRP  28           HA       TRP  28 -10.842  -3.992   6.164
  176   1HB   TRP  28          2HB       TRP  28  -9.140  -2.596   7.345
  177   2HB   TRP  28          1HB       TRP  28  -9.275  -1.395   6.064
  178    HD1  TRP  28           HD1      TRP  28 -11.379  -3.040   8.836
  179    HE1  TRP  28           HE1      TRP  28 -13.282  -1.428   9.479
  180    HE3  TRP  28           HE3      TRP  28 -10.691   0.592   5.312
  181    HZ2  TRP  28           HZ2      TRP  28 -14.369   1.071   8.617
  182    HZ3  TRP  28           HZ3      TRP  28 -12.173   2.576   5.248
  183    HH2  TRP  28           HH2      TRP  28 -14.011   2.819   6.893
  184    H    HIS  29           H        HIS  29 -12.252  -4.268   4.419
  185    HA   HIS  29           HA       HIS  29 -13.693  -3.642   2.691
  186   1HB   HIS  29          2HB       HIS  29 -13.062  -0.852   3.707
  187   2HB   HIS  29          1HB       HIS  29 -14.444  -1.300   2.712
  188    HD1  HIS  29           HD1      HIS  29 -14.537  -0.160   5.725
  189    HD2  HIS  29           HD2      HIS  29 -15.048  -4.130   4.570
  190    HE1  HIS  29           HE1      HIS  29 -15.797  -1.296   7.606
  191    H    ARG  30           H        ARG  30 -10.830  -3.924   2.083
  192    HA   ARG  30           HA       ARG  30  -9.348  -3.548   0.310
  193   1HB   ARG  30          2HB       ARG  30 -11.568  -4.032  -0.910
  194   2HB   ARG  30          1HB       ARG  30 -11.677  -2.290  -1.146
  195   1HG   ARG  30          2HG       ARG  30  -9.604  -2.248  -2.378
  196   2HG   ARG  30          1HG       ARG  30  -9.264  -3.928  -1.965
  197   1HD   ARG  30          2HD       ARG  30 -10.920  -4.755  -3.407
  198   2HD   ARG  30          1HD       ARG  30 -11.793  -3.223  -3.439
  199    HE   ARG  30           HE       ARG  30  -9.092  -3.172  -4.625
  200   1HH1  ARG  30          2HH1      ARG  30 -11.853  -1.607  -5.037
  201   2HH1  ARG  30          1HH1      ARG  30 -12.119  -1.989  -6.704
  202   1HH2  ARG  30          1HH2      ARG  30  -9.704  -4.488  -6.789
  203   2HH2  ARG  30          2HH2      ARG  30 -10.899  -3.627  -7.699
  204    H    LEU  31           H        LEU  31  -9.831  -1.411   2.362
  205    HA   LEU  31           HA       LEU  31  -9.055   0.980   0.749
  206   1HB   LEU  31          2HB       LEU  31 -10.402   0.749   3.448
  207   2HB   LEU  31          1HB       LEU  31  -9.749   2.265   2.828
  208    HG   LEU  31           HG       LEU  31 -11.708   0.599   1.239
  209   1HD1  LEU  31          1HD1      LEU  31 -13.470   2.125   2.069
  210   2HD1  LEU  31          2HD1      LEU  31 -12.303   2.867   3.163
  211   3HD1  LEU  31          3HD1      LEU  31 -12.767   1.179   3.381
  212   1HD2  LEU  31          1HD2      LEU  31 -12.099   2.777   0.117
  213   2HD2  LEU  31          2HD2      LEU  31 -10.406   2.295   0.012
  214   3HD2  LEU  31          3HD2      LEU  31 -10.902   3.527   1.172
  215    H    ARG  32           H        ARG  32  -7.922  -1.317   3.065
  216    HA   ARG  32           HA       ARG  32  -5.829   0.447   4.145
  217   1HB   ARG  32          2HB       ARG  32  -6.914  -1.354   5.527
  218   2HB   ARG  32          1HB       ARG  32  -6.168  -2.552   4.471
  219   1HG   ARG  32          2HG       ARG  32  -4.698  -2.344   6.339
  220   2HG   ARG  32          1HG       ARG  32  -3.929  -1.446   5.033
  221   1HD   ARG  32          2HD       ARG  32  -4.771   0.661   5.924
  222   2HD   ARG  32          1HD       ARG  32  -5.681  -0.195   7.169
  223    HE   ARG  32           HE       ARG  32  -2.743  -0.592   7.133
  224   1HH1  ARG  32          1HH2      ARG  32  -4.722  -1.178   9.415
  225   2HH1  ARG  32          2HH2      ARG  32  -4.343   0.108  10.510
  226   1HH2  ARG  32          2HH1      ARG  32  -2.598   1.961   8.142
  227   2HH2  ARG  32          1HH1      ARG  32  -3.134   1.892   9.788
  228    H    CYS  33           H        CYS  33  -3.656   0.377   3.525
  229    HA   CYS  33           HA       CYS  33  -3.106  -0.993   0.956
  230   1HB   CYS  33          2HB       CYS  33  -1.927   1.306   2.436
  231   2HB   CYS  33          1HB       CYS  33  -0.829   0.357   1.433
  232    H    THR  34           H        THR  34  -2.394  -3.052   1.155
  233    HA   THR  34           HA       THR  34  -0.694  -3.784   3.479
  234    HB   THR  34           HB       THR  34  -2.077  -5.494   1.388
  235    HG1  THR  34           HG1      THR  34  -3.677  -5.251   2.708
  236   1HG2  THR  34          1HG2      THR  34  -1.426  -7.389   2.841
  237   2HG2  THR  34          2HG2      THR  34  -0.516  -6.280   3.867
  238   3HG2  THR  34          3HG2      THR  34  -0.011  -6.555   2.199
  239    H    CYS  35           H        CYS  35   1.440  -3.482   3.116
  240    HA   CYS  35           HA       CYS  35   2.530  -3.936   0.374
  241   1HB   CYS  35          2HB       CYS  35   4.035  -2.637   2.640
  242   2HB   CYS  35          1HB       CYS  35   4.284  -2.453   0.905
  243    H    TYR  36           H        TYR  36   4.428  -5.248   0.127
  244    HA   TYR  36           HA       TYR  36   4.912  -7.100   2.427
  245   1HB   TYR  36          2HB       TYR  36   5.808  -8.601   0.427
  246   2HB   TYR  36          1HB       TYR  36   4.095  -8.558   0.831
  247    HD1  TYR  36           HD1      TYR  36   2.481  -7.605  -0.666
  248    HD2  TYR  36           HD2      TYR  36   6.681  -7.231  -1.486
  249    HE1  TYR  36           HE1      TYR  36   1.961  -6.784  -2.945
  250    HE2  TYR  36           HE2      TYR  36   6.161  -6.410  -3.767
  251    HH   TYR  36           HH       TYR  36   3.039  -5.435  -4.708
  252    H    ARG  37           H        ARG  37   7.083  -7.785   2.815
  253    HA   ARG  37           HA       ARG  37   9.082  -5.751   2.407
  254   1HB   ARG  37          2HB       ARG  37   9.071  -8.507   3.580
  255   2HB   ARG  37          1HB       ARG  37  10.612  -7.718   3.255
  256   1HG   ARG  37          2HG       ARG  37  10.103  -5.894   4.698
  257   2HG   ARG  37          1HG       ARG  37   8.402  -6.346   4.792
  258   1HD   ARG  37          2HD       ARG  37   9.289  -8.576   5.802
  259   2HD   ARG  37          1HD       ARG  37  10.777  -7.671   6.084
  260    HE   ARG  37           HE       ARG  37   9.203  -6.004   7.316
  261   1HH1  ARG  37          2HH1      ARG  37   6.887  -7.999   6.756
  262   2HH1  ARG  37          1HH1      ARG  37   6.749  -8.754   8.309
  263   1HH2  ARG  37          1HH2      ARG  37   9.807  -7.557   9.450
  264   2HH2  ARG  37          2HH2      ARG  37   8.406  -8.495   9.843
  265    H    CYS  38           H        CYS  38  10.810  -5.697   0.985
  266    HA   CYS  38           HA       CYS  38  10.551  -7.299  -1.458
  267   1HB   CYS  38          2HB       CYS  38  11.287  -4.766  -1.157
  268   2HB   CYS  38          1HB       CYS  38  12.885  -5.486  -0.967
  269    H    GLY  39           HN       GLY  39  11.736  -9.092  -1.936
  270   1HA   GLY  39          2HA       GLY  39  13.706 -10.046   0.052
  271   2HA   GLY  39          1HA       GLY  39  13.022 -11.001  -1.263
  Start of MODEL    2
    1   1H    GLY   1          1H        GLY   1  -7.463   3.536   2.256
    2   2H    GLY   1          2H        GLY   1  -8.220   4.687   1.259
    3   3H    GLY   1          3H        GLY   1  -8.612   4.600   2.910
    4   1HA   GLY   1          2HA       GLY   1  -7.116   6.483   2.299
    5   2HA   GLY   1          1HA       GLY   1  -6.505   5.421   3.565
    6    H    PHE   2           H        PHE   2  -4.644   6.868   2.265
    7    HA   PHE   2           HA       PHE   2  -2.628   6.711   1.082
    8   1HB   PHE   2          2HB       PHE   2  -3.122   3.723   1.050
    9   2HB   PHE   2          1HB       PHE   2  -1.572   4.560   0.995
   10    HD1  PHE   2           HD1      PHE   2  -1.197   6.268   3.040
   11    HD2  PHE   2           HD2      PHE   2  -3.806   2.857   3.097
   12    HE1  PHE   2           HE1      PHE   2  -1.094   6.231   5.518
   13    HE2  PHE   2           HE2      PHE   2  -3.703   2.819   5.575
   14    HZ   PHE   2           HZ       PHE   2  -2.347   4.507   6.784
   15    H    GLY   3           H        GLY   3  -5.179   6.963  -0.407
   16   1HA   GLY   3          2HA       GLY   3  -5.754   7.145  -2.668
   17   2HA   GLY   3          1HA       GLY   3  -4.146   6.549  -3.075
   18    H    CYS   4           H        CYS   4  -6.831   5.046  -1.237
   19    HA   CYS   4           HA       CYS   4  -6.563   2.657  -3.003
   20   1HB   CYS   4          2HB       CYS   4  -7.461   3.064  -0.169
   21   2HB   CYS   4          1HB       CYS   4  -8.090   1.687  -1.071
   22    HA   PRO   5           HA       PRO   5  -7.835   0.810  -2.991
   23   1HB   PRO   5          2HB       PRO   5  -9.111  -0.466  -5.059
   24   2HB   PRO   5          1HB       PRO   5  -9.750  -0.390  -3.408
   25   1HG   PRO   5          2HG       PRO   5 -10.662   1.067  -5.836
   26   2HG   PRO   5          1HG       PRO   5 -11.565   0.659  -4.368
   27   1HD   PRO   5          2HD       PRO   5 -10.440   3.195  -5.014
   28   2HD   PRO   5          1HD       PRO   5 -11.145   2.712  -3.456
   29    H    ASN   6           H        ASN   6  -7.339   3.304  -4.959
   30    HA   ASN   6           HA       ASN   6  -6.442   2.363  -7.462
   31   1HB   ASN   6          2HB       ASN   6  -6.574   4.791  -6.551
   32   2HB   ASN   6          1HB       ASN   6  -4.949   4.492  -5.938
   33   1HD2  ASN   6          1HD2      ASN   6  -6.702   5.460  -8.713
   34   2HD2  ASN   6          2HD2      ASN   6  -5.441   5.322  -9.842
   35    H    ASN   7           H        ASN   7  -4.815   1.016  -8.023
   36    HA   ASN   7           HA       ASN   7  -3.038  -0.086  -5.993
   37   1HB   ASN   7          2HB       ASN   7  -3.294  -0.508  -8.978
   38   2HB   ASN   7          1HB       ASN   7  -2.072  -1.327  -8.003
   39   1HD2  ASN   7          1HD2      ASN   7  -2.757  -3.362  -7.317
   40   2HD2  ASN   7          2HD2      ASN   7  -4.364  -3.789  -6.981
   41    H    TYR   8           H        TYR   8  -2.721   2.266  -8.624
   42    HA   TYR   8           HA       TYR   8   0.153   2.416  -8.575
   43   1HB   TYR   8          2HB       TYR   8  -1.465   3.343 -10.363
   44   2HB   TYR   8          1HB       TYR   8  -1.685   4.714  -9.278
   45    HD1  TYR   8           HD1      TYR   8   0.827   2.803 -11.241
   46    HD2  TYR   8           HD2      TYR   8   0.002   6.394  -9.032
   47    HE1  TYR   8           HE1      TYR   8   2.938   3.801 -12.074
   48    HE2  TYR   8           HE2      TYR   8   2.113   7.391  -9.866
   49    HH   TYR   8           HH       TYR   8   4.485   6.174 -10.780
   50    H    GLN   9           H        GLN   9  -2.368   4.468  -7.070
   51    HA   GLN   9           HA       GLN   9  -0.553   6.106  -5.577
   52   1HB   GLN   9          2HB       GLN   9  -3.481   5.441  -5.309
   53   2HB   GLN   9          1HB       GLN   9  -2.668   6.413  -4.083
   54   1HG   GLN   9          2HG       GLN   9  -2.143   7.220  -6.884
   55   2HG   GLN   9          1HG       GLN   9  -3.799   7.461  -6.326
   56   1HE2  GLN   9          1HE2      GLN   9  -0.403   8.332  -5.633
   57   2HE2  GLN   9          2HE2      GLN   9  -0.778   9.686  -4.681
   58    H    CYS  10           H        CYS  10  -2.352   3.149  -4.717
   59    HA   CYS  10           HA       CYS  10  -1.473   2.956  -2.011
   60   1HB   CYS  10          2HB       CYS  10  -3.296   1.584  -3.125
   61   2HB   CYS  10          1HB       CYS  10  -2.018   0.624  -3.865
   62    H    HIS  11           H        HIS  11  -0.093   1.667  -5.033
   63    HA   HIS  11           HA       HIS  11   2.088   0.242  -3.881
   64   1HB   HIS  11          2HB       HIS  11   1.377   0.052  -6.267
   65   2HB   HIS  11          1HB       HIS  11   2.012   1.670  -6.559
   66    HD1  HIS  11           HD1      HIS  11   3.026  -1.861  -6.304
   67    HD2  HIS  11           HD2      HIS  11   4.926   1.848  -6.195
   68    HE1  HIS  11           HE1      HIS  11   5.497  -2.312  -6.627
   69    H    ARG  12           H        ARG  12   1.857   3.621  -5.020
   70    HA   ARG  12           HA       ARG  12   4.556   4.368  -4.522
   71   1HB   ARG  12          2HB       ARG  12   2.424   5.642  -5.592
   72   2HB   ARG  12          1HB       ARG  12   2.449   6.400  -4.000
   73   1HG   ARG  12          2HG       ARG  12   5.121   6.170  -5.185
   74   2HG   ARG  12          1HG       ARG  12   4.022   7.140  -6.165
   75   1HD   ARG  12          2HD       ARG  12   4.435   7.546  -3.189
   76   2HD   ARG  12          1HD       ARG  12   5.275   8.470  -4.434
   77    HE   ARG  12           HE       ARG  12   2.707   8.900  -5.162
   78   1HH1  ARG  12          1HH2      ARG  12   2.091   7.984  -2.271
   79   2HH1  ARG  12          2HH2      ARG  12   1.949   9.521  -1.482
   80   1HH2  ARG  12          2HH1      ARG  12   3.454  11.284  -4.072
   81   2HH2  ARG  12          1HH1      ARG  12   2.728  11.395  -2.505
   82    H    HIS  13           H        HIS  13   1.703   4.449  -2.373
   83    HA   HIS  13           HA       HIS  13   2.965   5.689  -0.134
   84   1HB   HIS  13          2HB       HIS  13   0.568   5.487  -0.142
   85   2HB   HIS  13          1HB       HIS  13   0.654   3.736  -0.321
   86    HD1  HIS  13           HD1      HIS  13   1.985   6.312   2.181
   87    HD2  HIS  13           HD2      HIS  13   0.335   2.486   2.108
   88    HE1  HIS  13           HE1      HIS  13   1.827   5.555   4.591
   89    H    CYS  14           H        CYS  14   2.746   2.272  -1.118
   90    HA   CYS  14           HA       CYS  14   4.054   1.221   1.224
   91   1HB   CYS  14          2HB       CYS  14   3.586   0.156  -1.561
   92   2HB   CYS  14          1HB       CYS  14   4.507  -0.760  -0.367
   93    H    LYS  15           H        LYS  15   5.217   2.544  -1.830
   94    HA   LYS  15           HA       LYS  15   7.930   1.628  -1.622
   95   1HB   LYS  15          2HB       LYS  15   6.594   3.889  -3.111
   96   2HB   LYS  15          1HB       LYS  15   8.345   3.680  -3.154
   97   1HG   LYS  15          2HG       LYS  15   6.474   1.391  -3.770
   98   2HG   LYS  15          1HG       LYS  15   6.973   2.531  -5.019
   99   1HD   LYS  15          2HD       LYS  15   9.378   1.936  -3.848
  100   2HD   LYS  15          1HD       LYS  15   8.526   0.402  -3.688
  101   1HE   LYS  15          2HE       LYS  15   9.435   0.150  -5.809
  102   2HE   LYS  15          1HE       LYS  15   7.877   0.867  -6.216
  103   1HZ   LYS  15          1HZ       LYS  15   9.562   2.051  -7.378
  104   2HZ   LYS  15          2HZ       LYS  15  10.483   2.266  -5.967
  105   3HZ   LYS  15          3HZ       LYS  15   8.995   3.067  -6.145
  106    H    SER  16           H        SER  16   6.314   4.652  -0.563
  107    HA   SER  16           HA       SER  16   8.680   5.909   0.453
  108   1HB   SER  16          2HB       SER  16   6.957   7.119   1.988
  109   2HB   SER  16          1HB       SER  16   6.853   7.372   0.251
  110    HG   SER  16           HG       SER  16   5.297   5.648   1.883
  111    H    ILE  17           H        ILE  17   6.577   3.419   1.764
  112    HA   ILE  17           HA       ILE  17   7.644   3.601   4.480
  113    HB   ILE  17           HB       ILE  17   6.077   1.374   3.132
  114   1HG1  ILE  17          2HG1      ILE  17   4.998   3.387   5.102
  115   2HG1  ILE  17          1HG1      ILE  17   5.049   3.760   3.379
  116   1HG2  ILE  17          1HG2      ILE  17   7.415   0.790   5.219
  117   2HG2  ILE  17          2HG2      ILE  17   5.675   0.523   5.339
  118   3HG2  ILE  17          3HG2      ILE  17   6.402   1.945   6.088
  119   1HD1  ILE  17          1HD1      ILE  17   2.969   2.481   4.567
  120   2HD1  ILE  17          2HD1      ILE  17   3.947   1.100   4.074
  121   3HD1  ILE  17          3HD1      ILE  17   3.400   2.267   2.871
  122    HA   PRO  18           HA       PRO  18  11.322   1.344   3.456
  123   1HB   PRO  18          2HB       PRO  18  12.250   1.119   6.037
  124   2HB   PRO  18          1HB       PRO  18  12.388   2.592   5.061
  125   1HG   PRO  18          2HG       PRO  18  10.530   2.004   7.321
  126   2HG   PRO  18          1HG       PRO  18  11.163   3.563   6.764
  127   1HD   PRO  18          2HD       PRO  18   8.580   2.551   6.234
  128   2HD   PRO  18          1HD       PRO  18   9.354   3.913   5.396
  129    H    GLY  19           H        GLY  19  11.916  -0.816   3.384
  130   1HA   GLY  19          2HA       GLY  19  12.005  -3.100   4.080
  131   2HA   GLY  19          1HA       GLY  19  10.789  -2.753   5.306
  132    H    ARG  20           H        ARG  20  10.042  -1.570   2.135
  133    HA   ARG  20           HA       ARG  20   8.476  -4.012   1.482
  134   1HB   ARG  20          2HB       ARG  20   7.114  -1.356   1.183
  135   2HB   ARG  20          1HB       ARG  20   6.405  -2.955   1.383
  136   1HG   ARG  20          2HG       ARG  20   8.016  -1.780   3.632
  137   2HG   ARG  20          1HG       ARG  20   6.361  -1.234   3.380
  138   1HD   ARG  20          2HD       ARG  20   6.059  -3.950   3.179
  139   2HD   ARG  20          1HD       ARG  20   7.351  -3.831   4.374
  140    HE   ARG  20           HE       ARG  20   4.589  -2.797   4.703
  141   1HH1  ARG  20          1HH2      ARG  20   7.110  -1.201   5.782
  142   2HH1  ARG  20          2HH2      ARG  20   7.033  -1.664   7.447
  143   1HH2  ARG  20          2HH1      ARG  20   4.792  -4.263   6.894
  144   2HH2  ARG  20          1HH1      ARG  20   5.716  -3.403   8.080
  145    H    CYS  21           H        CYS  21   8.143  -4.292  -0.748
  146    HA   CYS  21           HA       CYS  21   9.686  -2.430  -2.490
  147   1HB   CYS  21          2HB       CYS  21   9.503  -5.251  -2.382
  148   2HB   CYS  21          1HB       CYS  21   8.699  -4.764  -3.875
  149    H    GLY  22           H        GLY  22   6.550  -4.142  -2.371
  150   1HA   GLY  22          2HA       GLY  22   5.364  -1.897  -3.930
  151   2HA   GLY  22          1HA       GLY  22   5.054  -3.558  -4.433
  152    H    GLY  23           H        GLY  23   2.753  -2.645  -3.978
  153   1HA   GLY  23          2HA       GLY  23   1.813  -3.828  -1.513
  154   2HA   GLY  23          1HA       GLY  23   1.763  -2.072  -1.419
  155    H    TYR  24           H        TYR  24  -0.567  -3.535  -1.244
  156    HA   TYR  24           HA       TYR  24  -2.003  -2.650  -3.690
  157   1HB   TYR  24          2HB       TYR  24  -3.206  -4.743  -3.900
  158   2HB   TYR  24          1HB       TYR  24  -1.483  -5.115  -3.895
  159    HD1  TYR  24           HD1      TYR  24  -4.650  -5.450  -2.109
  160    HD2  TYR  24           HD2      TYR  24  -0.402  -6.030  -1.833
  161    HE1  TYR  24           HE1      TYR  24  -4.977  -6.913  -0.135
  162    HE2  TYR  24           HE2      TYR  24  -0.732  -7.494   0.142
  163    HH   TYR  24           HH       TYR  24  -3.343  -7.553   1.964
  164    H    CYS  25           H        CYS  25  -4.410  -2.576  -3.277
  165    HA   CYS  25           HA       CYS  25  -4.914  -1.595  -0.535
  166   1HB   CYS  25          2HB       CYS  25  -6.565  -1.548  -3.076
  167   2HB   CYS  25          1HB       CYS  25  -7.160  -0.955  -1.526
  168    H    GLY  26           H        GLY  26  -5.453  -3.162   0.928
  169   1HA   GLY  26          2HA       GLY  26  -7.784  -4.832   0.508
  170   2HA   GLY  26          1HA       GLY  26  -6.297  -5.773   0.425
  171    H    GLY  27           H        GLY  27  -8.508  -5.729   2.462
  172   1HA   GLY  27          2HA       GLY  27  -7.737  -6.536   4.769
  173   2HA   GLY  27          1HA       GLY  27  -6.898  -4.989   4.873
  174    H    TRP  28           H        TRP  28  -8.151  -3.063   5.083
  175    HA   TRP  28           HA       TRP  28 -10.761  -3.504   6.379
  176   1HB   TRP  28          2HB       TRP  28  -9.028  -1.964   7.353
  177   2HB   TRP  28          1HB       TRP  28  -9.257  -0.903   5.965
  178    HD1  TRP  28           HD1      TRP  28 -11.219  -2.363   8.943
  179    HE1  TRP  28           HE1      TRP  28 -13.153  -0.759   9.504
  180    HE3  TRP  28           HE3      TRP  28 -10.741   0.975   5.107
  181    HZ2  TRP  28           HZ2      TRP  28 -14.342   1.625   8.468
  182    HZ3  TRP  28           HZ3      TRP  28 -12.286   2.902   4.921
  183    HH2  TRP  28           HH2      TRP  28 -14.087   3.230   6.593
  184    H    HIS  29           H        HIS  29 -12.153  -4.005   4.665
  185    HA   HIS  29           HA       HIS  29 -13.610  -3.592   2.887
  186   1HB   HIS  29          2HB       HIS  29 -13.052  -0.691   3.579
  187   2HB   HIS  29          1HB       HIS  29 -14.450  -1.303   2.702
  188    HD1  HIS  29           HD1      HIS  29 -14.502   0.195   5.545
  189    HD2  HIS  29           HD2      HIS  29 -14.852  -3.909   4.923
  190    HE1  HIS  29           HE1      HIS  29 -15.649  -0.744   7.598
  191    H    ARG  30           H        ARG  30 -10.709  -3.814   2.329
  192    HA   ARG  30           HA       ARG  30  -9.257  -3.595   0.508
  193   1HB   ARG  30          2HB       ARG  30 -11.397  -4.279  -0.685
  194   2HB   ARG  30          1HB       ARG  30 -11.672  -2.567  -1.004
  195   1HG   ARG  30          2HG       ARG  30  -9.931  -2.421  -2.508
  196   2HG   ARG  30          1HG       ARG  30  -8.988  -3.670  -1.696
  197   1HD   ARG  30          2HD       ARG  30 -11.563  -4.358  -3.104
  198   2HD   ARG  30          1HD       ARG  30 -10.049  -4.241  -3.999
  199    HE   ARG  30           HE       ARG  30 -10.808  -6.479  -2.443
  200   1HH1  ARG  30          1HH2      ARG  30  -8.255  -5.729  -4.216
  201   2HH1  ARG  30          2HH2      ARG  30  -7.017  -6.240  -3.118
  202   1HH2  ARG  30          2HH1      ARG  30  -9.173  -6.534  -0.407
  203   2HH2  ARG  30          1HH1      ARG  30  -7.539  -6.702  -0.958
  204    H    LEU  31           H        LEU  31  -9.803  -1.276   2.353
  205    HA   LEU  31           HA       LEU  31  -9.061   0.964   0.523
  206   1HB   LEU  31          2HB       LEU  31 -10.307   1.035   3.285
  207   2HB   LEU  31          1HB       LEU  31  -9.835   2.460   2.361
  208    HG   LEU  31           HG       LEU  31 -11.678   0.408   1.151
  209   1HD1  LEU  31          1HD1      LEU  31 -13.597   1.675   1.992
  210   2HD1  LEU  31          2HD1      LEU  31 -12.519   2.769   2.859
  211   3HD1  LEU  31          3HD1      LEU  31 -12.637   1.079   3.346
  212   1HD2  LEU  31          1HD2      LEU  31 -11.235   3.387   0.776
  213   2HD2  LEU  31          2HD2      LEU  31 -12.464   2.447  -0.072
  214   3HD2  LEU  31          3HD2      LEU  31 -10.754   2.105  -0.336
  215    H    ARG  32           H        ARG  32  -7.801  -1.145   2.902
  216    HA   ARG  32           HA       ARG  32  -5.785   0.783   3.877
  217   1HB   ARG  32          2HB       ARG  32  -6.926  -1.093   5.281
  218   2HB   ARG  32          1HB       ARG  32  -5.788  -2.172   4.474
  219   1HG   ARG  32          2HG       ARG  32  -3.926  -0.651   5.226
  220   2HG   ARG  32          1HG       ARG  32  -5.112   0.244   6.176
  221   1HD   ARG  32          2HD       ARG  32  -4.841  -2.742   6.480
  222   2HD   ARG  32          1HD       ARG  32  -3.769  -1.648   7.353
  223    HE   ARG  32           HE       ARG  32  -6.622  -1.026   7.652
  224   1HH1  ARG  32          1HH2      ARG  32  -5.826  -3.882   8.602
  225   2HH1  ARG  32          2HH2      ARG  32  -5.570  -3.582  10.289
  226   1HH2  ARG  32          2HH1      ARG  32  -5.437  -0.127   9.920
  227   2HH2  ARG  32          1HH1      ARG  32  -5.349  -1.446  11.037
  228    H    CYS  33           H        CYS  33  -3.570   0.632   3.367
  229    HA   CYS  33           HA       CYS  33  -2.978  -0.846   0.866
  230   1HB   CYS  33          2HB       CYS  33  -1.786   1.498   2.284
  231   2HB   CYS  33          1HB       CYS  33  -0.725   0.528   1.263
  232    H    THR  34           H        THR  34  -2.340  -2.922   1.244
  233    HA   THR  34           HA       THR  34  -0.614  -3.523   3.584
  234    HB   THR  34           HB       THR  34  -1.983  -5.352   1.583
  235    HG1  THR  34           HG1      THR  34  -2.541  -4.824   4.316
  236   1HG2  THR  34          1HG2      THR  34  -0.057  -6.506   2.401
  237   2HG2  THR  34          2HG2      THR  34  -1.415  -7.098   3.358
  238   3HG2  THR  34          3HG2      THR  34  -0.308  -5.906   4.040
  239    H    CYS  35           H        CYS  35   1.545  -3.345   3.227
  240    HA   CYS  35           HA       CYS  35   2.601  -3.724   0.473
  241   1HB   CYS  35          2HB       CYS  35   4.264  -2.820   2.807
  242   2HB   CYS  35          1HB       CYS  35   4.446  -2.430   1.100
  243    H    TYR  36           H        TYR  36   4.632  -4.979   0.215
  244    HA   TYR  36           HA       TYR  36   4.933  -7.138   2.259
  245   1HB   TYR  36          2HB       TYR  36   5.468  -8.618   0.167
  246   2HB   TYR  36          1HB       TYR  36   3.787  -8.309   0.590
  247    HD1  TYR  36           HD1      TYR  36   6.546  -7.370  -1.707
  248    HD2  TYR  36           HD2      TYR  36   2.363  -6.958  -0.811
  249    HE1  TYR  36           HE1      TYR  36   6.168  -6.347  -3.935
  250    HE2  TYR  36           HE2      TYR  36   1.987  -5.935  -3.037
  251    HH   TYR  36           HH       TYR  36   3.510  -6.185  -5.457
  252    H    ARG  37           H        ARG  37   7.050  -8.151   2.293
  253    HA   ARG  37           HA       ARG  37   9.232  -6.301   2.012
  254   1HB   ARG  37          2HB       ARG  37   9.211  -9.309   2.406
  255   2HB   ARG  37          1HB       ARG  37  10.656  -8.306   2.516
  256   1HG   ARG  37          2HG       ARG  37   8.519  -7.183   4.122
  257   2HG   ARG  37          1HG       ARG  37   8.822  -8.858   4.581
  258   1HD   ARG  37          2HD       ARG  37  11.377  -7.836   4.268
  259   2HD   ARG  37          1HD       ARG  37  10.496  -6.483   4.980
  260    HE   ARG  37           HE       ARG  37  10.605  -9.203   6.233
  261   1HH1  ARG  37          2HH1      ARG  37  12.529  -7.271   7.327
  262   2HH1  ARG  37          1HH1      ARG  37  11.648  -6.516   8.612
  263   1HH2  ARG  37          1HH2      ARG  37   8.546  -7.585   7.465
  264   2HH2  ARG  37          2HH2      ARG  37   9.385  -6.696   8.691
  265    H    CYS  38           H        CYS  38  11.121  -6.568   0.614
  266    HA   CYS  38           HA       CYS  38  10.335  -7.323  -2.132
  267   1HB   CYS  38          2HB       CYS  38  11.675  -5.181  -1.328
  268   2HB   CYS  38          1HB       CYS  38  13.056  -6.269  -1.458
  269    H    GLY  39           HN       GLY  39  10.880  -9.256  -2.987
  270   1HA   GLY  39          2HA       GLY  39  12.756 -11.016  -1.533
  271   2HA   GLY  39          1HA       GLY  39  11.704 -11.501  -2.863
  Start of MODEL    3
    1   1H    GLY   1          1H        GLY   1  -8.176   4.566   1.369
    2   2H    GLY   1          2H        GLY   1  -8.483   4.449   3.035
    3   3H    GLY   1          3H        GLY   1  -7.357   3.408   2.301
    4   1HA   GLY   1          2HA       GLY   1  -7.017   6.353   2.325
    5   2HA   GLY   1          1HA       GLY   1  -6.394   5.320   3.610
    6    H    PHE   2           H        PHE   2  -4.494   6.674   2.347
    7    HA   PHE   2           HA       PHE   2  -2.488   6.477   1.153
    8   1HB   PHE   2          2HB       PHE   2  -3.077   3.510   1.060
    9   2HB   PHE   2          1HB       PHE   2  -1.502   4.296   1.021
   10    HD1  PHE   2           HD1      PHE   2  -3.820   2.646   3.090
   11    HD2  PHE   2           HD2      PHE   2  -1.033   5.915   3.105
   12    HE1  PHE   2           HE1      PHE   2  -3.713   2.543   5.565
   13    HE2  PHE   2           HE2      PHE   2  -0.928   5.812   5.581
   14    HZ   PHE   2           HZ       PHE   2  -2.268   4.125   6.810
   15    H    GLY   3           H        GLY   3  -5.024   6.847  -0.328
   16   1HA   GLY   3          2HA       GLY   3  -5.609   7.078  -2.582
   17   2HA   GLY   3          1HA       GLY   3  -4.020   6.445  -3.006
   18    H    CYS   4           H        CYS   4  -6.635   4.912  -1.110
   19    HA   CYS   4           HA       CYS   4  -6.499   2.595  -2.980
   20   1HB   CYS   4          2HB       CYS   4  -7.285   2.916  -0.099
   21   2HB   CYS   4          1HB       CYS   4  -7.946   1.569  -1.024
   22    HA   PRO   5           HA       PRO   5  -7.856   0.738  -2.852
   23   1HB   PRO   5          2HB       PRO   5  -9.249  -0.504  -4.864
   24   2HB   PRO   5          1HB       PRO   5  -9.825  -0.397  -3.192
   25   1HG   PRO   5          2HG       PRO   5 -10.769   1.084  -5.596
   26   2HG   PRO   5          1HG       PRO   5 -11.636   0.707  -4.098
   27   1HD   PRO   5          2HD       PRO   5 -10.459   3.205  -4.783
   28   2HD   PRO   5          1HD       PRO   5 -11.110   2.741  -3.198
   29    H    ASN   6           H        ASN   6  -7.380   3.205  -4.878
   30    HA   ASN   6           HA       ASN   6  -6.557   2.156  -7.379
   31   1HB   ASN   6          2HB       ASN   6  -6.722   4.626  -6.564
   32   2HB   ASN   6          1HB       ASN   6  -5.061   4.390  -6.018
   33   1HD2  ASN   6          1HD2      ASN   6  -6.976   5.169  -8.752
   34   2HD2  ASN   6          2HD2      ASN   6  -5.765   5.010  -9.930
   35    H    ASN   7           H        ASN   7  -4.892   0.844  -7.931
   36    HA   ASN   7           HA       ASN   7  -3.043  -0.134  -5.902
   37   1HB   ASN   7          2HB       ASN   7  -3.513  -0.706  -8.814
   38   2HB   ASN   7          1HB       ASN   7  -2.038  -1.285  -8.038
   39   1HD2  ASN   7          1HD2      ASN   7  -2.395  -2.623  -5.974
   40   2HD2  ASN   7          2HD2      ASN   7  -3.787  -3.589  -5.890
   41    H    TYR   8           H        TYR   8  -2.875   2.197  -8.552
   42    HA   TYR   8           HA       TYR   8  -0.012   2.428  -8.644
   43   1HB   TYR   8          2HB       TYR   8  -1.574   3.327 -10.395
   44   2HB   TYR   8          1HB       TYR   8  -2.073   4.574  -9.253
   45    HD1  TYR   8           HD1      TYR   8  -0.727   6.501  -8.853
   46    HD2  TYR   8           HD2      TYR   8   0.840   3.214 -11.133
   47    HE1  TYR   8           HE1      TYR   8   1.222   7.885  -9.507
   48    HE2  TYR   8           HE2      TYR   8   2.790   4.599 -11.786
   49    HH   TYR   8           HH       TYR   8   3.681   7.365 -10.257
   50    H    GLN   9           H        GLN   9  -2.501   4.372  -6.950
   51    HA   GLN   9           HA       GLN   9  -0.602   5.994  -5.517
   52   1HB   GLN   9          2HB       GLN   9  -3.510   5.334  -4.973
   53   2HB   GLN   9          1HB       GLN   9  -2.580   6.498  -4.029
   54   1HG   GLN   9          2HG       GLN   9  -2.428   6.861  -6.962
   55   2HG   GLN   9          1HG       GLN   9  -4.016   7.156  -6.255
   56   1HE2  GLN   9          1HE2      GLN   9  -4.191   9.394  -5.949
   57   2HE2  GLN   9          2HE2      GLN   9  -2.987  10.372  -5.261
   58    H    CYS  10           H        CYS  10  -2.340   2.984  -4.729
   59    HA   CYS  10           HA       CYS  10  -1.453   2.732  -2.028
   60   1HB   CYS  10          2HB       CYS  10  -3.214   1.322  -3.261
   61   2HB   CYS  10          1HB       CYS  10  -1.859   0.399  -3.908
   62    H    HIS  11           H        HIS  11  -0.028   1.646  -5.101
   63    HA   HIS  11           HA       HIS  11   2.239   0.296  -4.002
   64   1HB   HIS  11          2HB       HIS  11   1.603   0.007  -6.345
   65   2HB   HIS  11          1HB       HIS  11   1.875   1.718  -6.659
   66    HD1  HIS  11           HD1      HIS  11   4.168  -0.558  -4.664
   67    HD2  HIS  11           HD2      HIS  11   4.147   1.531  -8.268
   68    HE1  HIS  11           HE1      HIS  11   6.502  -0.764  -5.619
   69    H    ARG  12           H        ARG  12   1.709   3.679  -4.968
   70    HA   ARG  12           HA       ARG  12   4.358   4.640  -4.565
   71   1HB   ARG  12          2HB       ARG  12   2.292   5.836  -5.590
   72   2HB   ARG  12          1HB       ARG  12   1.901   6.274  -3.928
   73   1HG   ARG  12          2HG       ARG  12   3.916   7.507  -3.663
   74   2HG   ARG  12          1HG       ARG  12   4.634   6.794  -5.107
   75   1HD   ARG  12          2HD       ARG  12   3.807   8.472  -6.353
   76   2HD   ARG  12          1HD       ARG  12   2.170   8.025  -5.872
   77    HE   ARG  12           HE       ARG  12   2.205   9.775  -4.263
   78   1HH1  ARG  12          2HH1      ARG  12   4.132  10.914  -6.433
   79   2HH1  ARG  12          1HH1      ARG  12   5.377  11.564  -5.418
   80   1HH2  ARG  12          1HH2      ARG  12   4.315   9.855  -2.581
   81   2HH2  ARG  12          2HH2      ARG  12   5.483  10.958  -3.228
   82    H    HIS  13           H        HIS  13   1.631   4.300  -2.290
   83    HA   HIS  13           HA       HIS  13   2.947   5.503  -0.038
   84   1HB   HIS  13          2HB       HIS  13   0.541   5.221  -0.001
   85   2HB   HIS  13          1HB       HIS  13   0.695   3.476  -0.204
   86    HD1  HIS  13           HD1      HIS  13   2.129   6.036   2.259
   87    HD2  HIS  13           HD2      HIS  13   0.417   2.237   2.234
   88    HE1  HIS  13           HE1      HIS  13   2.070   5.260   4.670
   89    H    CYS  14           H        CYS  14   2.665   2.105  -1.116
   90    HA   CYS  14           HA       CYS  14   4.079   0.930   1.065
   91   1HB   CYS  14          2HB       CYS  14   3.787   0.054  -1.818
   92   2HB   CYS  14          1HB       CYS  14   4.536  -0.941  -0.569
   93    H    LYS  15           H        LYS  15   5.227   2.389  -1.962
   94    HA   LYS  15           HA       LYS  15   7.979   1.605  -1.668
   95   1HB   LYS  15          2HB       LYS  15   6.557   3.750  -3.236
   96   2HB   LYS  15          1HB       LYS  15   8.320   3.699  -3.188
   97   1HG   LYS  15          2HG       LYS  15   8.119   1.233  -3.855
   98   2HG   LYS  15          1HG       LYS  15   6.427   1.575  -4.215
   99   1HD   LYS  15          2HD       LYS  15   8.662   3.242  -5.377
  100   2HD   LYS  15          1HD       LYS  15   8.099   1.769  -6.166
  101   1HE   LYS  15          2HE       LYS  15   6.274   2.814  -6.975
  102   2HE   LYS  15          1HE       LYS  15   5.854   3.431  -5.377
  103   1HZ   LYS  15          1HZ       LYS  15   7.564   4.655  -7.445
  104   2HZ   LYS  15          2HZ       LYS  15   7.756   5.083  -5.810
  105   3HZ   LYS  15          3HZ       LYS  15   6.267   5.337  -6.590
  106    H    SER  16           H        SER  16   6.096   4.385  -0.508
  107    HA   SER  16           HA       SER  16   8.329   5.900   0.481
  108   1HB   SER  16          2HB       SER  16   6.728   7.273   1.566
  109   2HB   SER  16          1HB       SER  16   5.898   6.690   0.131
  110    HG   SER  16           HG       SER  16   5.019   5.012   1.512
  111    H    ILE  17           H        ILE  17   6.524   3.169   1.747
  112    HA   ILE  17           HA       ILE  17   7.576   3.400   4.462
  113    HB   ILE  17           HB       ILE  17   6.278   1.028   3.074
  114   1HG1  ILE  17          2HG1      ILE  17   4.911   2.841   5.046
  115   2HG1  ILE  17          1HG1      ILE  17   4.999   3.315   3.350
  116   1HG2  ILE  17          1HG2      ILE  17   7.464   0.298   5.042
  117   2HG2  ILE  17          2HG2      ILE  17   5.754   0.387   5.468
  118   3HG2  ILE  17          3HG2      ILE  17   6.859   1.663   5.980
  119   1HD1  ILE  17          1HD1      ILE  17   4.218   0.517   3.680
  120   2HD1  ILE  17          2HD1      ILE  17   3.441   1.796   2.745
  121   3HD1  ILE  17          3HD1      ILE  17   3.094   1.626   4.466
  122    HA   PRO  18           HA       PRO  18  11.464   1.550   3.384
  123   1HB   PRO  18          2HB       PRO  18  12.424   1.395   5.957
  124   2HB   PRO  18          1HB       PRO  18  12.404   2.886   5.001
  125   1HG   PRO  18          2HG       PRO  18  10.632   2.081   7.262
  126   2HG   PRO  18          1HG       PRO  18  11.093   3.703   6.721
  127   1HD   PRO  18          2HD       PRO  18   8.629   2.429   6.191
  128   2HD   PRO  18          1HD       PRO  18   9.248   3.879   5.371
  129    H    GLY  19           H        GLY  19  12.041  -0.571   3.103
  130   1HA   GLY  19          2HA       GLY  19  12.404  -2.841   3.849
  131   2HA   GLY  19          1HA       GLY  19  11.175  -2.605   5.088
  132    H    ARG  20           H        ARG  20   9.661  -1.271   2.555
  133    HA   ARG  20           HA       ARG  20   8.459  -3.879   1.727
  134   1HB   ARG  20          2HB       ARG  20   7.189  -1.147   1.460
  135   2HB   ARG  20          1HB       ARG  20   6.402  -2.717   1.335
  136   1HG   ARG  20          2HG       ARG  20   7.818  -1.961   3.880
  137   2HG   ARG  20          1HG       ARG  20   6.193  -1.352   3.565
  138   1HD   ARG  20          2HD       ARG  20   5.776  -3.928   2.943
  139   2HD   ARG  20          1HD       ARG  20   7.104  -4.144   4.084
  140    HE   ARG  20           HE       ARG  20   4.741  -2.515   4.894
  141   1HH1  ARG  20          1HH2      ARG  20   4.024  -5.336   5.112
  142   2HH1  ARG  20          2HH2      ARG  20   4.608  -5.786   6.679
  143   1HH2  ARG  20          2HH1      ARG  20   6.723  -3.036   6.963
  144   2HH2  ARG  20          1HH1      ARG  20   6.148  -4.476   7.732
  145    H    CYS  21           H        CYS  21   7.997  -4.222  -0.498
  146    HA   CYS  21           HA       CYS  21   9.586  -2.501  -2.353
  147   1HB   CYS  21          2HB       CYS  21   9.360  -5.340  -2.065
  148   2HB   CYS  21          1HB       CYS  21   8.681  -4.897  -3.631
  149    H    GLY  22           H        GLY  22   6.568  -4.431  -2.338
  150   1HA   GLY  22          2HA       GLY  22   5.245  -2.221  -3.834
  151   2HA   GLY  22          1HA       GLY  22   5.086  -3.879  -4.410
  152    H    GLY  23           H        GLY  23   2.714  -2.877  -3.900
  153   1HA   GLY  23          2HA       GLY  23   1.774  -4.379  -1.594
  154   2HA   GLY  23          1HA       GLY  23   1.660  -2.641  -1.343
  155    H    TYR  24           H        TYR  24  -0.689  -3.530  -1.206
  156    HA   TYR  24           HA       TYR  24  -2.052  -2.769  -3.692
  157   1HB   TYR  24          2HB       TYR  24  -3.287  -4.840  -3.963
  158   2HB   TYR  24          1HB       TYR  24  -1.569  -5.236  -3.946
  159    HD1  TYR  24           HD1      TYR  24  -4.761  -5.644  -2.270
  160    HD2  TYR  24           HD2      TYR  24  -0.515  -6.123  -1.825
  161    HE1  TYR  24           HE1      TYR  24  -5.133  -7.129  -0.321
  162    HE2  TYR  24           HE2      TYR  24  -0.890  -7.609   0.126
  163    HH   TYR  24           HH       TYR  24  -3.576  -7.744   1.838
  164    H    CYS  25           H        CYS  25  -4.483  -2.713  -3.303
  165    HA   CYS  25           HA       CYS  25  -4.997  -1.794  -0.534
  166   1HB   CYS  25          2HB       CYS  25  -6.671  -1.639  -3.059
  167   2HB   CYS  25          1HB       CYS  25  -7.173  -1.001  -1.493
  168    H    GLY  26           H        GLY  26  -5.598  -3.392   0.862
  169   1HA   GLY  26          2HA       GLY  26  -7.962  -4.990   0.365
  170   2HA   GLY  26          1HA       GLY  26  -6.501  -5.966   0.245
  171    H    GLY  27           H        GLY  27  -8.766  -5.798   2.300
  172   1HA   GLY  27          2HA       GLY  27  -8.072  -6.766   4.572
  173   2HA   GLY  27          1HA       GLY  27  -7.082  -5.315   4.727
  174    H    TRP  28           H        TRP  28  -8.130  -3.290   5.054
  175    HA   TRP  28           HA       TRP  28 -10.728  -3.503   6.394
  176   1HB   TRP  28          2HB       TRP  28  -8.836  -2.067   7.246
  177   2HB   TRP  28          1HB       TRP  28  -9.084  -1.011   5.857
  178    HD1  TRP  28           HD1      TRP  28 -10.915  -2.292   8.990
  179    HE1  TRP  28           HE1      TRP  28 -12.729  -0.580   9.631
  180    HE3  TRP  28           HE3      TRP  28 -10.548   0.910   5.030
  181    HZ2  TRP  28           HZ2      TRP  28 -13.873   1.830   8.604
  182    HZ3  TRP  28           HZ3      TRP  28 -12.009   2.906   4.888
  183    HH2  TRP  28           HH2      TRP  28 -13.672   3.368   6.667
  184    H    HIS  29           H        HIS  29 -12.182  -3.975   4.701
  185    HA   HIS  29           HA       HIS  29 -13.668  -3.501   2.962
  186   1HB   HIS  29          2HB       HIS  29 -12.972  -0.616   3.588
  187   2HB   HIS  29          1HB       HIS  29 -14.438  -1.200   2.808
  188    HD1  HIS  29           HD1      HIS  29 -14.230   0.360   5.628
  189    HD2  HIS  29           HD2      HIS  29 -14.842  -3.727   5.097
  190    HE1  HIS  29           HE1      HIS  29 -15.303  -0.487   7.761
  191    H    ARG  30           H        ARG  30 -10.786  -3.843   2.343
  192    HA   ARG  30           HA       ARG  30  -9.351  -3.667   0.505
  193   1HB   ARG  30          2HB       ARG  30 -11.529  -4.323  -0.645
  194   2HB   ARG  30          1HB       ARG  30 -11.761  -2.610  -0.994
  195   1HG   ARG  30          2HG       ARG  30 -10.039  -2.542  -2.523
  196   2HG   ARG  30          1HG       ARG  30  -9.112  -3.788  -1.691
  197   1HD   ARG  30          2HD       ARG  30  -9.889  -4.767  -3.739
  198   2HD   ARG  30          1HD       ARG  30 -10.872  -5.455  -2.447
  199    HE   ARG  30           HE       ARG  30 -12.728  -4.498  -3.516
  200   1HH1  ARG  30          2HH1      ARG  30 -10.469  -3.787  -5.684
  201   2HH1  ARG  30          1HH1      ARG  30 -10.981  -2.178  -6.067
  202   1HH2  ARG  30          1HH2      ARG  30 -13.158  -1.947  -3.366
  203   2HH2  ARG  30          2HH2      ARG  30 -12.519  -1.137  -4.757
  204    H    LEU  31           H        LEU  31  -9.721  -1.364   2.338
  205    HA   LEU  31           HA       LEU  31  -8.996   0.862   0.479
  206   1HB   LEU  31          2HB       LEU  31 -10.228   0.974   3.247
  207   2HB   LEU  31          1HB       LEU  31  -9.719   2.386   2.320
  208    HG   LEU  31           HG       LEU  31 -11.636   0.377   1.143
  209   1HD1  LEU  31          1HD1      LEU  31 -12.532   1.169   3.340
  210   2HD1  LEU  31          2HD1      LEU  31 -13.499   1.708   1.968
  211   3HD1  LEU  31          3HD1      LEU  31 -12.392   2.828   2.759
  212   1HD2  LEU  31          1HD2      LEU  31 -11.036   3.317   0.685
  213   2HD2  LEU  31          2HD2      LEU  31 -12.346   2.442  -0.110
  214   3HD2  LEU  31          3HD2      LEU  31 -10.670   1.978  -0.406
  215    H    ARG  32           H        ARG  32  -7.773  -1.243   2.894
  216    HA   ARG  32           HA       ARG  32  -5.719   0.650   3.845
  217   1HB   ARG  32          2HB       ARG  32  -6.833  -1.147   5.305
  218   2HB   ARG  32          1HB       ARG  32  -5.851  -2.316   4.422
  219   1HG   ARG  32          2HG       ARG  32  -3.821  -0.926   5.047
  220   2HG   ARG  32          1HG       ARG  32  -4.875  -0.008   6.123
  221   1HD   ARG  32          2HD       ARG  32  -5.233  -1.829   7.544
  222   2HD   ARG  32          1HD       ARG  32  -4.828  -3.009   6.296
  223    HE   ARG  32           HE       ARG  32  -2.440  -1.706   6.659
  224   1HH1  ARG  32          2HH1      ARG  32  -3.422  -4.466   7.809
  225   2HH1  ARG  32          1HH1      ARG  32  -2.863  -4.313   9.441
  226   1HH2  ARG  32          1HH2      ARG  32  -2.288  -0.890   9.197
  227   2HH2  ARG  32          2HH2      ARG  32  -2.219  -2.278  10.230
  228    H    CYS  33           H        CYS  33  -3.540   0.538   3.266
  229    HA   CYS  33           HA       CYS  33  -2.959  -0.940   0.772
  230   1HB   CYS  33          2HB       CYS  33  -1.757   1.373   2.217
  231   2HB   CYS  33          1HB       CYS  33  -0.671   0.386   1.239
  232    H    THR  34           H        THR  34  -2.513  -3.067   1.254
  233    HA   THR  34           HA       THR  34  -0.753  -3.719   3.537
  234    HB   THR  34           HB       THR  34  -2.187  -5.473   1.517
  235    HG1  THR  34           HG1      THR  34  -2.620  -5.027   4.287
  236   1HG2  THR  34          1HG2      THR  34  -0.160  -6.593   2.270
  237   2HG2  THR  34          2HG2      THR  34  -1.551  -7.330   3.064
  238   3HG2  THR  34          3HG2      THR  34  -0.530  -6.198   3.948
  239    H    CYS  35           H        CYS  35   1.384  -3.431   3.154
  240    HA   CYS  35           HA       CYS  35   2.465  -4.017   0.437
  241   1HB   CYS  35          2HB       CYS  35   4.043  -2.708   2.640
  242   2HB   CYS  35          1HB       CYS  35   4.225  -2.536   0.895
  243    H    TYR  36           H        TYR  36   4.335  -5.375   0.230
  244    HA   TYR  36           HA       TYR  36   4.736  -7.206   2.561
  245   1HB   TYR  36          2HB       TYR  36   5.676  -8.732   0.602
  246   2HB   TYR  36          1HB       TYR  36   3.951  -8.662   0.948
  247    HD1  TYR  36           HD1      TYR  36   2.402  -7.646  -0.591
  248    HD2  TYR  36           HD2      TYR  36   6.634  -7.438  -1.304
  249    HE1  TYR  36           HE1      TYR  36   1.974  -6.833  -2.891
  250    HE2  TYR  36           HE2      TYR  36   6.203  -6.626  -3.607
  251    HH   TYR  36           HH       TYR  36   3.172  -5.522  -4.634
  252    H    ARG  37           H        ARG  37   6.893  -7.996   2.949
  253    HA   ARG  37           HA       ARG  37   8.939  -5.980   2.702
  254   1HB   ARG  37          2HB       ARG  37   9.062  -8.889   3.546
  255   2HB   ARG  37          1HB       ARG  37  10.431  -7.782   3.646
  256   1HG   ARG  37          2HG       ARG  37   9.072  -6.275   5.091
  257   2HG   ARG  37          1HG       ARG  37   7.760  -7.451   5.044
  258   1HD   ARG  37          2HD       ARG  37   8.731  -8.349   6.885
  259   2HD   ARG  37          1HD       ARG  37   9.918  -9.013   5.764
  260    HE   ARG  37           HE       ARG  37  10.636  -7.262   7.767
  261   1HH1  ARG  37          2HH1      ARG  37  12.257  -8.183   5.243
  262   2HH1  ARG  37          1HH1      ARG  37  12.866  -6.651   4.712
  263   1HH2  ARG  37          1HH2      ARG  37  10.688  -4.806   6.702
  264   2HH2  ARG  37          2HH2      ARG  37  11.969  -4.730   5.540
  265    H    CYS  38           H        CYS  38  10.809  -5.973   1.406
  266    HA   CYS  38           HA       CYS  38  10.562  -7.443  -1.143
  267   1HB   CYS  38          2HB       CYS  38  11.266  -4.918  -0.741
  268   2HB   CYS  38          1HB       CYS  38  12.866  -5.629  -0.537
  269    H    GLY  39           HN       GLY  39  11.611  -9.330  -1.477
  270   1HA   GLY  39          2HA       GLY  39  13.943  -9.996   0.272
  271   2HA   GLY  39          1HA       GLY  39  12.858 -11.197  -0.427
  Start of MODEL    4
    1   1H    GLY   1          1H        GLY   1  -7.465   3.402   2.546
    2   2H    GLY   1          2H        GLY   1  -8.317   4.545   1.621
    3   3H    GLY   1          3H        GLY   1  -8.609   4.411   3.289
    4   1HA   GLY   1          2HA       GLY   1  -7.176   6.347   2.525
    5   2HA   GLY   1          1HA       GLY   1  -6.577   5.369   3.865
    6    H    PHE   2           H        PHE   2  -4.600   6.627   2.720
    7    HA   PHE   2           HA       PHE   2  -2.554   6.402   1.601
    8   1HB   PHE   2          2HB       PHE   2  -3.254   3.455   1.505
    9   2HB   PHE   2          1HB       PHE   2  -1.643   4.165   1.425
   10    HD1  PHE   2           HD1      PHE   2  -4.187   2.864   3.581
   11    HD2  PHE   2           HD2      PHE   2  -0.878   5.601   3.449
   12    HE1  PHE   2           HE1      PHE   2  -4.042   2.809   6.055
   13    HE2  PHE   2           HE2      PHE   2  -0.734   5.546   5.925
   14    HZ   PHE   2           HZ       PHE   2  -2.316   4.149   7.228
   15    H    GLY   3           H        GLY   3  -5.062   6.794   0.019
   16   1HA   GLY   3          2HA       GLY   3  -5.518   7.081  -2.260
   17   2HA   GLY   3          1HA       GLY   3  -3.925   6.415  -2.620
   18    H    CYS   4           H        CYS   4  -6.562   4.858  -0.795
   19    HA   CYS   4           HA       CYS   4  -6.469   2.614  -2.753
   20   1HB   CYS   4          2HB       CYS   4  -7.281   2.828   0.138
   21   2HB   CYS   4          1HB       CYS   4  -7.870   1.493  -0.848
   22    HA   PRO   5           HA       PRO   5  -7.912   0.742  -2.558
   23   1HB   PRO   5          2HB       PRO   5  -9.333  -0.451  -4.582
   24   2HB   PRO   5          1HB       PRO   5  -9.911  -0.334  -2.912
   25   1HG   PRO   5          2HG       PRO   5 -10.796   1.193  -5.312
   26   2HG   PRO   5          1HG       PRO   5 -11.685   0.824  -3.826
   27   1HD   PRO   5          2HD       PRO   5 -10.448   3.298  -4.471
   28   2HD   PRO   5          1HD       PRO   5 -11.099   2.826  -2.887
   29    H    ASN   6           H        ASN   6  -7.408   3.200  -4.603
   30    HA   ASN   6           HA       ASN   6  -6.555   2.119  -7.078
   31   1HB   ASN   6          2HB       ASN   6  -6.742   4.599  -6.289
   32   2HB   ASN   6          1HB       ASN   6  -5.085   4.377  -5.727
   33   1HD2  ASN   6          1HD2      ASN   6  -6.908   5.278  -8.434
   34   2HD2  ASN   6          2HD2      ASN   6  -5.716   5.052  -9.621
   35    H    ASN   7           H        ASN   7  -5.007   0.634  -7.457
   36    HA   ASN   7           HA       ASN   7  -3.109  -0.181  -5.420
   37   1HB   ASN   7          2HB       ASN   7  -3.593  -0.949  -8.290
   38   2HB   ASN   7          1HB       ASN   7  -2.162  -1.530  -7.439
   39   1HD2  ASN   7          1HD2      ASN   7  -2.443  -3.271  -5.978
   40   2HD2  ASN   7          2HD2      ASN   7  -3.953  -3.927  -5.571
   41    H    TYR   8           H        TYR   8  -2.981   1.957  -8.220
   42    HA   TYR   8           HA       TYR   8  -0.115   2.155  -8.387
   43   1HB   TYR   8          2HB       TYR   8  -1.831   2.951 -10.118
   44   2HB   TYR   8          1HB       TYR   8  -2.081   4.353  -9.079
   45    HD1  TYR   8           HD1      TYR   8  -0.520   6.151  -9.029
   46    HD2  TYR   8           HD2      TYR   8   0.483   2.486 -11.031
   47    HE1  TYR   8           HE1      TYR   8   1.489   7.231  -9.999
   48    HE2  TYR   8           HE2      TYR   8   2.494   3.565 -12.000
   49    HH   TYR   8           HH       TYR   8   3.919   6.096 -10.924
   50    H    GLN   9           H        GLN   9  -2.567   4.225  -6.793
   51    HA   GLN   9           HA       GLN   9  -0.671   5.971  -5.526
   52   1HB   GLN   9          2HB       GLN   9  -3.450   5.276  -4.531
   53   2HB   GLN   9          1HB       GLN   9  -2.530   6.736  -4.172
   54   1HG   GLN   9          2HG       GLN   9  -2.572   6.639  -6.962
   55   2HG   GLN   9          1HG       GLN   9  -4.191   6.121  -6.496
   56   1HE2  GLN   9          1HE2      GLN   9  -1.911   8.831  -6.371
   57   2HE2  GLN   9          2HE2      GLN   9  -3.040   9.983  -5.843
   58    H    CYS  10           H        CYS  10  -2.328   3.005  -4.425
   59    HA   CYS  10           HA       CYS  10  -1.273   2.955  -1.770
   60   1HB   CYS  10          2HB       CYS  10  -3.115   1.476  -2.683
   61   2HB   CYS  10          1HB       CYS  10  -1.868   0.539  -3.500
   62    H    HIS  11           H        HIS  11  -0.024   1.672  -4.847
   63    HA   HIS  11           HA       HIS  11   2.275   0.357  -3.778
   64   1HB   HIS  11          2HB       HIS  11   1.294   0.250  -6.180
   65   2HB   HIS  11          1HB       HIS  11   2.251   1.699  -6.481
   66    HD1  HIS  11           HD1      HIS  11   3.007  -0.838  -7.995
   67    HD2  HIS  11           HD2      HIS  11   4.647   0.150  -4.292
   68    HE1  HIS  11           HE1      HIS  11   5.190  -2.112  -7.809
   69    H    ARG  12           H        ARG  12   1.802   3.686  -4.975
   70    HA   ARG  12           HA       ARG  12   4.485   4.588  -4.687
   71   1HB   ARG  12          2HB       ARG  12   2.188   5.739  -5.563
   72   2HB   ARG  12          1HB       ARG  12   2.326   6.504  -3.980
   73   1HG   ARG  12          2HG       ARG  12   4.748   6.360  -5.746
   74   2HG   ARG  12          1HG       ARG  12   3.518   7.580  -6.079
   75   1HD   ARG  12          2HD       ARG  12   4.995   7.190  -3.457
   76   2HD   ARG  12          1HD       ARG  12   5.224   8.517  -4.594
   77    HE   ARG  12           HE       ARG  12   2.638   8.890  -4.067
   78   1HH1  ARG  12          1HH2      ARG  12   4.524  10.479  -2.430
   79   2HH1  ARG  12          2HH2      ARG  12   4.099  10.034  -0.810
   80   1HH2  ARG  12          2HH1      ARG  12   2.357   7.186  -1.776
   81   2HH2  ARG  12          1HH1      ARG  12   2.862   8.164  -0.439
   82    H    HIS  13           H        HIS  13   1.811   4.420  -2.355
   83    HA   HIS  13           HA       HIS  13   3.155   5.711  -0.174
   84   1HB   HIS  13          2HB       HIS  13   0.748   5.413  -0.103
   85   2HB   HIS  13          1HB       HIS  13   0.917   3.663  -0.230
   86    HD1  HIS  13           HD1      HIS  13   2.405   6.313   2.100
   87    HD2  HIS  13           HD2      HIS  13   0.603   2.559   2.265
   88    HE1  HIS  13           HE1      HIS  13   2.345   5.654   4.545
   89    H    CYS  14           H        CYS  14   2.835   2.265  -1.083
   90    HA   CYS  14           HA       CYS  14   4.312   1.168   1.089
   91   1HB   CYS  14          2HB       CYS  14   3.988   0.210  -1.769
   92   2HB   CYS  14          1HB       CYS  14   4.746  -0.749  -0.497
   93    H    LYS  15           H        LYS  15   5.379   2.503  -2.024
   94    HA   LYS  15           HA       LYS  15   8.141   1.771  -1.812
   95   1HB   LYS  15          2HB       LYS  15   6.820   4.102  -3.239
   96   2HB   LYS  15          1HB       LYS  15   8.504   3.629  -3.454
   97   1HG   LYS  15          2HG       LYS  15   7.039   1.252  -3.774
   98   2HG   LYS  15          1HG       LYS  15   6.116   2.479  -4.642
   99   1HD   LYS  15          2HD       LYS  15   8.353   3.192  -5.688
  100   2HD   LYS  15          1HD       LYS  15   8.998   1.673  -5.063
  101   1HE   LYS  15          2HE       LYS  15   6.472   1.192  -6.380
  102   2HE   LYS  15          1HE       LYS  15   7.554   2.062  -7.466
  103   1HZ   LYS  15          1HZ       LYS  15   7.748  -0.423  -7.500
  104   2HZ   LYS  15          2HZ       LYS  15   8.397  -0.332  -5.933
  105   3HZ   LYS  15          3HZ       LYS  15   9.201   0.410  -7.232
  106    H    SER  16           H        SER  16   6.317   4.615  -0.682
  107    HA   SER  16           HA       SER  16   8.576   6.117   0.240
  108   1HB   SER  16          2HB       SER  16   7.013   7.532   1.319
  109   2HB   SER  16          1HB       SER  16   6.139   6.910  -0.074
  110    HG   SER  16           HG       SER  16   5.224   5.332   1.336
  111    H    ILE  17           H        ILE  17   6.770   3.445   1.645
  112    HA   ILE  17           HA       ILE  17   7.870   3.772   4.325
  113    HB   ILE  17           HB       ILE  17   6.579   1.335   3.050
  114   1HG1  ILE  17          2HG1      ILE  17   5.209   3.223   4.951
  115   2HG1  ILE  17          1HG1      ILE  17   5.290   3.629   3.238
  116   1HG2  ILE  17          1HG2      ILE  17   7.925   0.924   5.128
  117   2HG2  ILE  17          2HG2      ILE  17   6.206   0.596   5.337
  118   3HG2  ILE  17          3HG2      ILE  17   6.901   2.086   5.972
  119   1HD1  ILE  17          1HD1      ILE  17   3.858   1.375   4.585
  120   2HD1  ILE  17          2HD1      ILE  17   4.478   1.115   2.954
  121   3HD1  ILE  17          3HD1      ILE  17   3.322   2.410   3.262
  122    HA   PRO  18           HA       PRO  18  11.767   1.913   3.302
  123   1HB   PRO  18          2HB       PRO  18  12.732   1.850   5.878
  124   2HB   PRO  18          1HB       PRO  18  12.699   3.309   4.874
  125   1HG   PRO  18          2HG       PRO  18  10.933   2.564   7.162
  126   2HG   PRO  18          1HG       PRO  18  11.385   4.172   6.569
  127   1HD   PRO  18          2HD       PRO  18   8.927   2.869   6.081
  128   2HD   PRO  18          1HD       PRO  18   9.539   4.292   5.213
  129    H    GLY  19           H        GLY  19  12.390  -0.215   3.122
  130   1HA   GLY  19          2HA       GLY  19  12.715  -2.479   3.836
  131   2HA   GLY  19          1HA       GLY  19  11.618  -2.190   5.184
  132    H    ARG  20           H        ARG  20  10.569  -1.140   2.040
  133    HA   ARG  20           HA       ARG  20   8.917  -3.600   1.715
  134   1HB   ARG  20          2HB       ARG  20   7.914  -0.741   1.544
  135   2HB   ARG  20          1HB       ARG  20   6.966  -2.171   1.140
  136   1HG   ARG  20          2HG       ARG  20   8.212  -1.672   3.862
  137   2HG   ARG  20          1HG       ARG  20   6.534  -1.307   3.461
  138   1HD   ARG  20          2HD       ARG  20   6.661  -3.875   2.606
  139   2HD   ARG  20          1HD       ARG  20   7.846  -3.936   3.907
  140    HE   ARG  20           HE       ARG  20   5.005  -3.815   4.272
  141   1HH1  ARG  20          2HH1      ARG  20   7.182  -4.607   6.286
  142   2HH1  ARG  20          1HH1      ARG  20   6.945  -3.409   7.513
  143   1HH2  ARG  20          1HH2      ARG  20   5.031  -1.335   5.481
  144   2HH2  ARG  20          2HH2      ARG  20   5.709  -1.553   7.060
  145    H    CYS  21           H        CYS  21   7.936  -3.683  -0.537
  146    HA   CYS  21           HA       CYS  21   9.687  -2.299  -2.530
  147   1HB   CYS  21          2HB       CYS  21   9.584  -5.064  -2.020
  148   2HB   CYS  21          1HB       CYS  21   8.653  -4.834  -3.500
  149    H    GLY  22           H        GLY  22   6.647  -4.184  -2.286
  150   1HA   GLY  22          2HA       GLY  22   5.268  -2.035  -3.794
  151   2HA   GLY  22          1HA       GLY  22   5.161  -3.680  -4.417
  152    H    GLY  23           H        GLY  23   2.770  -2.614  -3.800
  153   1HA   GLY  23          2HA       GLY  23   1.882  -4.276  -1.567
  154   2HA   GLY  23          1HA       GLY  23   1.734  -2.552  -1.245
  155    H    TYR  24           H        TYR  24  -0.594  -3.432  -1.108
  156    HA   TYR  24           HA       TYR  24  -1.997  -2.648  -3.567
  157   1HB   TYR  24          2HB       TYR  24  -3.266  -4.722  -3.791
  158   2HB   TYR  24          1HB       TYR  24  -1.546  -5.089  -3.897
  159    HD1  TYR  24           HD1      TYR  24  -4.609  -5.529  -1.975
  160    HD2  TYR  24           HD2      TYR  24  -0.348  -6.071  -1.926
  161    HE1  TYR  24           HE1      TYR  24  -4.831  -7.079  -0.054
  162    HE2  TYR  24           HE2      TYR  24  -0.569  -7.623  -0.004
  163    HH   TYR  24           HH       TYR  24  -3.192  -9.143   0.840
  164    H    CYS  25           H        CYS  25  -4.490  -2.868  -3.103
  165    HA   CYS  25           HA       CYS  25  -4.943  -1.880  -0.327
  166   1HB   CYS  25          2HB       CYS  25  -6.630  -1.614  -2.834
  167   2HB   CYS  25          1HB       CYS  25  -7.088  -0.993  -1.250
  168    H    GLY  26           H        GLY  26  -5.830  -3.320   1.078
  169   1HA   GLY  26          2HA       GLY  26  -8.118  -4.949   0.403
  170   2HA   GLY  26          1HA       GLY  26  -6.657  -5.933   0.471
  171    H    GLY  27           H        GLY  27  -9.132  -5.648   2.278
  172   1HA   GLY  27          2HA       GLY  27  -8.617  -6.541   4.653
  173   2HA   GLY  27          1HA       GLY  27  -7.722  -5.034   4.841
  174    H    TRP  28           H        TRP  28  -8.881  -3.073   5.022
  175    HA   TRP  28           HA       TRP  28 -11.660  -3.391   5.954
  176   1HB   TRP  28          2HB       TRP  28  -9.989  -2.033   7.238
  177   2HB   TRP  28          1HB       TRP  28  -9.923  -0.904   5.887
  178    HD1  TRP  28           HD1      TRP  28 -12.413  -2.293   8.480
  179    HE1  TRP  28           HE1      TRP  28 -14.267  -0.542   8.840
  180    HE3  TRP  28           HE3      TRP  28 -11.106   1.127   4.919
  181    HZ2  TRP  28           HZ2      TRP  28 -15.088   1.977   7.766
  182    HZ3  TRP  28           HZ3      TRP  28 -12.439   3.192   4.612
  183    HH2  TRP  28           HH2      TRP  28 -14.428   3.620   6.027
  184    H    HIS  29           H        HIS  29 -12.892  -3.672   4.088
  185    HA   HIS  29           HA       HIS  29 -14.057  -3.072   2.155
  186   1HB   HIS  29          2HB       HIS  29 -13.347  -0.263   3.060
  187   2HB   HIS  29          1HB       HIS  29 -14.654  -0.703   1.964
  188    HD1  HIS  29           HD1      HIS  29 -14.990   0.672   4.848
  189    HD2  HIS  29           HD2      HIS  29 -15.591  -3.355   3.963
  190    HE1  HIS  29           HE1      HIS  29 -16.491  -0.245   6.670
  191    H    ARG  30           H        ARG  30 -11.172  -3.582   1.927
  192    HA   ARG  30           HA       ARG  30  -9.469  -3.434   0.334
  193   1HB   ARG  30          2HB       ARG  30 -11.599  -3.790  -1.108
  194   2HB   ARG  30          1HB       ARG  30 -11.452  -2.076  -1.485
  195   1HG   ARG  30          2HG       ARG  30  -9.508  -2.364  -2.695
  196   2HG   ARG  30          1HG       ARG  30  -8.996  -3.751  -1.736
  197   1HD   ARG  30          2HD       ARG  30  -9.596  -4.637  -3.868
  198   2HD   ARG  30          1HD       ARG  30 -10.939  -5.028  -2.796
  199    HE   ARG  30           HE       ARG  30 -10.986  -3.009  -4.964
  200   1HH1  ARG  30          2HH1      ARG  30 -12.848  -5.432  -4.022
  201   2HH1  ARG  30          1HH1      ARG  30 -14.282  -4.532  -3.659
  202   1HH2  ARG  30          1HH2      ARG  30 -12.682  -1.446  -3.741
  203   2HH2  ARG  30          2HH2      ARG  30 -14.187  -2.268  -3.500
  204    H    LEU  31           H        LEU  31  -9.961  -1.171   2.209
  205    HA   LEU  31           HA       LEU  31  -8.874   1.080   0.579
  206   1HB   LEU  31          2HB       LEU  31 -10.452   1.032   3.152
  207   2HB   LEU  31          1HB       LEU  31  -9.575   2.467   2.621
  208    HG   LEU  31           HG       LEU  31 -11.647   1.011   0.951
  209   1HD1  LEU  31          1HD1      LEU  31 -12.857   2.012   2.728
  210   2HD1  LEU  31          2HD1      LEU  31 -12.946   3.186   1.415
  211   3HD1  LEU  31          3HD1      LEU  31 -11.815   3.434   2.745
  212   1HD2  LEU  31          1HD2      LEU  31 -11.393   3.575  -0.011
  213   2HD2  LEU  31          2HD2      LEU  31 -10.566   2.170  -0.684
  214   3HD2  LEU  31          3HD2      LEU  31  -9.736   3.210   0.473
  215    H    ARG  32           H        ARG  32  -8.079  -1.213   3.025
  216    HA   ARG  32           HA       ARG  32  -5.963   0.375   4.276
  217   1HB   ARG  32          2HB       ARG  32  -7.170  -1.464   5.477
  218   2HB   ARG  32          1HB       ARG  32  -6.432  -2.624   4.371
  219   1HG   ARG  32          2HG       ARG  32  -4.191  -1.430   5.140
  220   2HG   ARG  32          1HG       ARG  32  -5.160  -1.002   6.550
  221   1HD   ARG  32          2HD       ARG  32  -5.126  -3.122   7.343
  222   2HD   ARG  32          1HD       ARG  32  -5.484  -3.806   5.758
  223    HE   ARG  32           HE       ARG  32  -3.131  -3.979   5.334
  224   1HH1  ARG  32          1HH2      ARG  32  -3.548  -4.332   8.483
  225   2HH1  ARG  32          2HH2      ARG  32  -2.096  -3.560   9.026
  226   1HH2  ARG  32          2HH1      ARG  32  -1.389  -2.135   5.934
  227   2HH2  ARG  32          1HH1      ARG  32  -0.869  -2.311   7.578
  228    H    CYS  33           H        CYS  33  -3.778   0.337   3.727
  229    HA   CYS  33           HA       CYS  33  -3.107  -0.957   1.147
  230   1HB   CYS  33          2HB       CYS  33  -2.045   1.333   2.708
  231   2HB   CYS  33          1HB       CYS  33  -0.858   0.399   1.800
  232    H    THR  34           H        THR  34  -2.032  -2.845   1.102
  233    HA   THR  34           HA       THR  34  -0.504  -3.679   3.533
  234    HB   THR  34           HB       THR  34  -1.830  -5.377   1.397
  235    HG1  THR  34           HG1      THR  34  -3.427  -5.573   2.769
  236   1HG2  THR  34          1HG2      THR  34  -0.655  -6.347   3.998
  237   2HG2  THR  34          2HG2      THR  34   0.333  -6.225   2.543
  238   3HG2  THR  34          3HG2      THR  34  -1.077  -7.285   2.567
  239    H    CYS  35           H        CYS  35   1.647  -3.387   3.168
  240    HA   CYS  35           HA       CYS  35   2.699  -3.761   0.401
  241   1HB   CYS  35          2HB       CYS  35   4.258  -2.565   2.688
  242   2HB   CYS  35          1HB       CYS  35   4.482  -2.324   0.956
  243    H    TYR  36           H        TYR  36   4.482  -5.154   0.042
  244    HA   TYR  36           HA       TYR  36   5.027  -7.067   2.276
  245   1HB   TYR  36          2HB       TYR  36   5.805  -8.555   0.245
  246   2HB   TYR  36          1HB       TYR  36   4.092  -8.423   0.633
  247    HD1  TYR  36           HD1      TYR  36   6.771  -7.217  -1.639
  248    HD2  TYR  36           HD2      TYR  36   2.550  -7.332  -0.850
  249    HE1  TYR  36           HE1      TYR  36   6.320  -6.322  -3.907
  250    HE2  TYR  36           HE2      TYR  36   2.100  -6.437  -3.117
  251    HH   TYR  36           HH       TYR  36   4.120  -6.514  -5.557
  252    H    ARG  37           H        ARG  37   7.204  -7.853   2.516
  253    HA   ARG  37           HA       ARG  37   9.228  -5.818   2.072
  254   1HB   ARG  37          2HB       ARG  37   9.237  -8.585   3.261
  255   2HB   ARG  37          1HB       ARG  37  10.754  -7.741   2.958
  256   1HG   ARG  37          2HG       ARG  37   9.285  -5.778   4.185
  257   2HG   ARG  37          1HG       ARG  37   8.687  -7.220   5.004
  258   1HD   ARG  37          2HD       ARG  37  11.644  -6.933   4.629
  259   2HD   ARG  37          1HD       ARG  37  10.863  -5.958   5.873
  260    HE   ARG  37           HE       ARG  37  10.075  -8.747   6.046
  261   1HH1  ARG  37          2HH1      ARG  37  13.079  -8.848   5.986
  262   2HH1  ARG  37          1HH1      ARG  37  13.480  -8.684   7.663
  263   1HH2  ARG  37          1HH2      ARG  37  10.341  -7.490   8.563
  264   2HH2  ARG  37          2HH2      ARG  37  11.923  -7.911   9.128
  265    H    CYS  38           H        CYS  38  11.032  -5.924   0.695
  266    HA   CYS  38           HA       CYS  38  10.615  -7.404  -1.793
  267   1HB   CYS  38          2HB       CYS  38  11.764  -4.999  -1.215
  268   2HB   CYS  38          1HB       CYS  38  13.193  -6.019  -1.366
  269    H    GLY  39           HN       GLY  39  11.702  -9.235  -2.442
  270   1HA   GLY  39          2HA       GLY  39  13.413 -10.579  -0.435
  271   2HA   GLY  39          1HA       GLY  39  12.729 -11.329  -1.878
  Start of MODEL    5
    1   1H    GLY   1          1H        GLY   1  -7.791   3.377   2.104
    2   2H    GLY   1          2H        GLY   1  -8.672   4.608   1.329
    3   3H    GLY   1          3H        GLY   1  -8.922   4.290   2.980
    4   1HA   GLY   1          2HA       GLY   1  -7.519   6.309   2.401
    5   2HA   GLY   1          1HA       GLY   1  -6.881   5.195   3.608
    6    H    PHE   2           H        PHE   2  -5.082   6.767   2.330
    7    HA   PHE   2           HA       PHE   2  -3.104   6.744   1.082
    8   1HB   PHE   2          2HB       PHE   2  -3.547   3.772   1.473
    9   2HB   PHE   2          1HB       PHE   2  -2.080   4.449   0.767
   10    HD1  PHE   2           HD1      PHE   2  -3.722   3.561   3.801
   11    HD2  PHE   2           HD2      PHE   2  -0.886   6.329   2.146
   12    HE1  PHE   2           HE1      PHE   2  -2.842   4.019   6.073
   13    HE2  PHE   2           HE2      PHE   2  -0.006   6.786   4.418
   14    HZ   PHE   2           HZ       PHE   2  -0.984   5.631   6.382
   15    H    GLY   3           H        GLY   3  -5.639   6.861  -0.398
   16   1HA   GLY   3          2HA       GLY   3  -6.251   6.952  -2.652
   17   2HA   GLY   3          1HA       GLY   3  -4.614   6.448  -3.060
   18    H    CYS   4           H        CYS   4  -7.292   4.854  -1.276
   19    HA   CYS   4           HA       CYS   4  -6.855   2.454  -2.996
   20   1HB   CYS   4          2HB       CYS   4  -7.838   2.818  -0.176
   21   2HB   CYS   4          1HB       CYS   4  -8.288   1.376  -1.083
   22    HA   PRO   5           HA       PRO   5  -8.128   0.500  -2.808
   23   1HB   PRO   5          2HB       PRO   5  -9.312  -0.906  -4.848
   24   2HB   PRO   5          1HB       PRO   5  -9.999  -0.768  -3.221
   25   1HG   PRO   5          2HG       PRO   5 -10.864   0.566  -5.741
   26   2HG   PRO   5          1HG       PRO   5 -11.809   0.181  -4.294
   27   1HD   PRO   5          2HD       PRO   5 -10.761   2.728  -4.982
   28   2HD   PRO   5          1HD       PRO   5 -11.461   2.266  -3.417
   29    H    ASN   6           H        ASN   6  -7.733   2.897  -4.967
   30    HA   ASN   6           HA       ASN   6  -6.639   1.783  -7.326
   31   1HB   ASN   6          2HB       ASN   6  -7.067   4.275  -6.653
   32   2HB   ASN   6          1HB       ASN   6  -5.425   4.208  -6.014
   33   1HD2  ASN   6          1HD2      ASN   6  -7.087   5.066  -8.757
   34   2HD2  ASN   6          2HD2      ASN   6  -5.876   4.797  -9.915
   35    H    ASN   7           H        ASN   7  -4.768   0.672  -7.718
   36    HA   ASN   7           HA       ASN   7  -3.001   0.041  -5.460
   37   1HB   ASN   7          2HB       ASN   7  -3.289  -0.941  -8.280
   38   2HB   ASN   7          1HB       ASN   7  -1.787  -1.252  -7.412
   39   1HD2  ASN   7          1HD2      ASN   7  -3.910  -3.221  -8.217
   40   2HD2  ASN   7          2HD2      ASN   7  -4.410  -3.963  -6.775
   41    H    TYR   8           H        TYR   8  -3.010   2.281  -8.119
   42    HA   TYR   8           HA       TYR   8  -0.162   2.634  -8.368
   43   1HB   TYR   8          2HB       TYR   8  -1.957   3.448  -9.998
   44   2HB   TYR   8          1HB       TYR   8  -2.272   4.755  -8.859
   45    HD1  TYR   8           HD1      TYR   8  -0.778   6.616  -8.645
   46    HD2  TYR   8           HD2      TYR   8   0.311   3.226 -11.050
   47    HE1  TYR   8           HE1      TYR   8   1.136   7.889  -9.573
   48    HE2  TYR   8           HE2      TYR   8   2.227   4.500 -11.977
   49    HH   TYR   8           HH       TYR   8   3.645   6.787 -10.818
   50    H    GLN   9           H        GLN   9  -2.632   4.603  -6.659
   51    HA   GLN   9           HA       GLN   9  -0.717   6.241  -5.276
   52   1HB   GLN   9          2HB       GLN   9  -3.568   5.557  -4.487
   53   2HB   GLN   9          1HB       GLN   9  -2.615   6.896  -3.848
   54   1HG   GLN   9          2HG       GLN   9  -2.939   6.685  -6.818
   55   2HG   GLN   9          1HG       GLN   9  -4.304   7.269  -5.869
   56   1HE2  GLN   9          1HE2      GLN   9  -0.954   8.003  -6.810
   57   2HE2  GLN   9          2HE2      GLN   9  -0.978   9.610  -6.265
   58    H    CYS  10           H        CYS  10  -2.418   3.236  -4.421
   59    HA   CYS  10           HA       CYS  10  -1.472   3.013  -1.732
   60   1HB   CYS  10          2HB       CYS  10  -3.283   1.613  -2.907
   61   2HB   CYS  10          1HB       CYS  10  -1.956   0.669  -3.580
   62    H    HIS  11           H        HIS  11  -0.132   1.885  -4.833
   63    HA   HIS  11           HA       HIS  11   2.135   0.518  -3.752
   64   1HB   HIS  11          2HB       HIS  11   1.349   0.292  -6.115
   65   2HB   HIS  11          1HB       HIS  11   1.919   1.930  -6.430
   66    HD1  HIS  11           HD1      HIS  11   3.194  -1.517  -5.544
   67    HD2  HIS  11           HD2      HIS  11   4.701   2.160  -6.794
   68    HE1  HIS  11           HE1      HIS  11   5.638  -1.894  -6.092
   69    H    ARG  12           H        ARG  12   1.629   3.904  -4.733
   70    HA   ARG  12           HA       ARG  12   4.304   4.823  -4.461
   71   1HB   ARG  12          2HB       ARG  12   2.084   6.035  -5.270
   72   2HB   ARG  12          1HB       ARG  12   2.029   6.571  -3.590
   73   1HG   ARG  12          2HG       ARG  12   4.650   7.034  -4.178
   74   2HG   ARG  12          1HG       ARG  12   3.907   7.322  -5.752
   75   1HD   ARG  12          2HD       ARG  12   2.619   9.100  -4.970
   76   2HD   ARG  12          1HD       ARG  12   2.658   8.528  -3.303
   77    HE   ARG  12           HE       ARG  12   5.308   9.155  -3.869
   78   1HH1  ARG  12          2HH1      ARG  12   3.526  10.638  -1.897
   79   2HH1  ARG  12          1HH1      ARG  12   3.615  12.256  -2.507
   80   1HH2  ARG  12          1HH2      ARG  12   4.895  11.300  -5.594
   81   2HH2  ARG  12          2HH2      ARG  12   4.396  12.633  -4.609
   82    H    HIS  13           H        HIS  13   1.705   4.503  -2.040
   83    HA   HIS  13           HA       HIS  13   3.138   5.647   0.163
   84   1HB   HIS  13          2HB       HIS  13   0.743   5.321   0.338
   85   2HB   HIS  13          1HB       HIS  13   0.907   3.589   0.055
   86    HD1  HIS  13           HD1      HIS  13   2.437   6.065   2.546
   87    HD2  HIS  13           HD2      HIS  13   0.763   2.250   2.450
   88    HE1  HIS  13           HE1      HIS  13   2.496   5.199   4.924
   89    H    CYS  14           H        CYS  14   2.847   2.283  -0.998
   90    HA   CYS  14           HA       CYS  14   4.511   1.134   1.054
   91   1HB   CYS  14          2HB       CYS  14   3.899   0.162  -1.755
   92   2HB   CYS  14          1HB       CYS  14   4.667  -0.807  -0.499
   93    H    LYS  15           H        LYS  15   5.168   2.628  -2.072
   94    HA   LYS  15           HA       LYS  15   7.875   1.789  -2.394
   95   1HB   LYS  15          2HB       LYS  15   6.311   4.177  -3.370
   96   2HB   LYS  15          1HB       LYS  15   8.027   4.000  -3.738
   97   1HG   LYS  15          2HG       LYS  15   6.655   1.501  -4.221
   98   2HG   LYS  15          1HG       LYS  15   5.859   2.806  -5.098
   99   1HD   LYS  15          2HD       LYS  15   7.518   2.152  -6.612
  100   2HD   LYS  15          1HD       LYS  15   8.297   3.492  -5.771
  101   1HE   LYS  15          2HE       LYS  15   8.666   0.933  -4.393
  102   2HE   LYS  15          1HE       LYS  15   9.328   0.926  -6.028
  103   1HZ   LYS  15          1HZ       LYS  15  10.484   3.016  -5.481
  104   2HZ   LYS  15          2HZ       LYS  15  10.981   1.718  -4.504
  105   3HZ   LYS  15          3HZ       LYS  15   9.924   2.895  -3.883
  106    H    SER  16           H        SER  16   6.492   4.674  -0.772
  107    HA   SER  16           HA       SER  16   9.048   5.783  -0.042
  108   1HB   SER  16          2HB       SER  16   7.704   7.118   1.619
  109   2HB   SER  16          1HB       SER  16   7.120   7.232  -0.037
  110    HG   SER  16           HG       SER  16   6.058   5.813   2.157
  111    H    ILE  17           H        ILE  17   7.106   3.220   1.323
  112    HA   ILE  17           HA       ILE  17   8.333   3.299   3.963
  113    HB   ILE  17           HB       ILE  17   6.776   1.107   2.555
  114   1HG1  ILE  17          2HG1      ILE  17   5.838   2.885   4.811
  115   2HG1  ILE  17          1HG1      ILE  17   5.683   3.395   3.130
  116   1HG2  ILE  17          1HG2      ILE  17   7.618   1.411   5.457
  117   2HG2  ILE  17          2HG2      ILE  17   8.195   0.181   4.330
  118   3HG2  ILE  17          3HG2      ILE  17   6.510   0.179   4.851
  119   1HD1  ILE  17          1HD1      ILE  17   4.691   0.868   2.963
  120   2HD1  ILE  17          2HD1      ILE  17   3.690   2.290   3.253
  121   3HD1  ILE  17          3HD1      ILE  17   4.214   1.289   4.606
  122    HA   PRO  18           HA       PRO  18  12.063   1.285   2.612
  123   1HB   PRO  18          2HB       PRO  18  13.248   1.278   5.092
  124   2HB   PRO  18          1HB       PRO  18  13.176   2.703   4.043
  125   1HG   PRO  18          2HG       PRO  18  11.620   2.114   6.513
  126   2HG   PRO  18          1HG       PRO  18  12.037   3.679   5.797
  127   1HD   PRO  18          2HD       PRO  18   9.526   2.369   5.612
  128   2HD   PRO  18          1HD       PRO  18  10.043   3.784   4.674
  129    H    GLY  19           H        GLY  19  12.862  -0.848   2.681
  130   1HA   GLY  19          2HA       GLY  19  13.145  -3.052   3.592
  131   2HA   GLY  19          1HA       GLY  19  11.896  -2.697   4.784
  132    H    ARG  20           H        ARG  20  10.370  -1.572   2.218
  133    HA   ARG  20           HA       ARG  20   9.310  -4.246   1.412
  134   1HB   ARG  20          2HB       ARG  20   7.977  -1.688   2.150
  135   2HB   ARG  20          1HB       ARG  20   7.239  -2.630   0.855
  136   1HG   ARG  20          2HG       ARG  20   6.228  -3.435   2.852
  137   2HG   ARG  20          1HG       ARG  20   7.432  -4.649   2.425
  138   1HD   ARG  20          2HD       ARG  20   8.909  -3.974   4.115
  139   2HD   ARG  20          1HD       ARG  20   8.166  -2.381   4.260
  140    HE   ARG  20           HE       ARG  20   7.284  -4.805   5.619
  141   1HH1  ARG  20          2HH1      ARG  20   7.154  -1.909   6.592
  142   2HH1  ARG  20          1HH1      ARG  20   5.443  -1.639   6.612
  143   1HH2  ARG  20          1HH2      ARG  20   4.725  -4.401   4.619
  144   2HH2  ARG  20          2HH2      ARG  20   4.060  -3.055   5.483
  145    H    CYS  21           H        CYS  21   7.989  -3.935  -0.768
  146    HA   CYS  21           HA       CYS  21   9.652  -2.304  -2.644
  147   1HB   CYS  21          2HB       CYS  21   9.222  -5.176  -2.580
  148   2HB   CYS  21          1HB       CYS  21   8.649  -4.490  -4.101
  149    H    GLY  22           H        GLY  22   6.554  -4.109  -2.417
  150   1HA   GLY  22          2HA       GLY  22   5.193  -1.755  -3.606
  151   2HA   GLY  22          1HA       GLY  22   4.980  -3.319  -4.388
  152    H    GLY  23           H        GLY  23   2.654  -2.481  -3.688
  153   1HA   GLY  23          2HA       GLY  23   1.840  -4.182  -1.462
  154   2HA   GLY  23          1HA       GLY  23   1.637  -2.465  -1.123
  155    H    TYR  24           H        TYR  24  -0.676  -3.448  -1.005
  156    HA   TYR  24           HA       TYR  24  -2.058  -2.695  -3.493
  157   1HB   TYR  24          2HB       TYR  24  -3.288  -4.786  -3.707
  158   2HB   TYR  24          1HB       TYR  24  -1.562  -5.140  -3.755
  159    HD1  TYR  24           HD1      TYR  24  -0.414  -6.091  -1.745
  160    HD2  TYR  24           HD2      TYR  24  -4.672  -5.539  -1.895
  161    HE1  TYR  24           HE1      TYR  24  -0.682  -7.600   0.206
  162    HE2  TYR  24           HE2      TYR  24  -4.939  -7.047   0.054
  163    HH   TYR  24           HH       TYR  24  -2.533  -7.862   2.090
  164    H    CYS  25           H        CYS  25  -4.495  -2.728  -3.109
  165    HA   CYS  25           HA       CYS  25  -5.029  -1.713  -0.379
  166   1HB   CYS  25          2HB       CYS  25  -6.654  -1.672  -2.935
  167   2HB   CYS  25          1HB       CYS  25  -7.256  -1.067  -1.393
  168    H    GLY  26           H        GLY  26  -5.505  -3.328   1.052
  169   1HA   GLY  26          2HA       GLY  26  -7.895  -4.910   0.729
  170   2HA   GLY  26          1HA       GLY  26  -6.461  -5.909   0.483
  171    H    GLY  27           H        GLY  27  -8.506  -5.827   2.709
  172   1HA   GLY  27          2HA       GLY  27  -7.530  -6.766   4.914
  173   2HA   GLY  27          1HA       GLY  27  -6.699  -5.214   5.010
  174    H    TRP  28           H        TRP  28  -8.461  -3.354   4.408
  175    HA   TRP  28           HA       TRP  28 -10.843  -3.844   6.145
  176   1HB   TRP  28          2HB       TRP  28  -9.150  -2.401   7.263
  177   2HB   TRP  28          1HB       TRP  28  -9.245  -1.272   5.914
  178    HD1  TRP  28           HD1      TRP  28 -11.411  -2.714   8.752
  179    HE1  TRP  28           HE1      TRP  28 -13.296  -1.037   9.271
  180    HE3  TRP  28           HE3      TRP  28 -10.627   0.685   5.020
  181    HZ2  TRP  28           HZ2      TRP  28 -14.335   1.420   8.245
  182    HZ3  TRP  28           HZ3      TRP  28 -12.078   2.683   4.817
  183    HH2  TRP  28           HH2      TRP  28 -13.931   3.053   6.421
  184    H    HIS  29           H        HIS  29 -12.270  -4.192   4.427
  185    HA   HIS  29           HA       HIS  29 -13.713  -3.643   2.676
  186   1HB   HIS  29          2HB       HIS  29 -13.054  -0.813   3.553
  187   2HB   HIS  29          1HB       HIS  29 -14.439  -1.292   2.578
  188    HD1  HIS  29           HD1      HIS  29 -14.559   0.000   5.512
  189    HD2  HIS  29           HD2      HIS  29 -15.041  -4.034   4.588
  190    HE1  HIS  29           HE1      HIS  29 -15.825  -1.032   7.448
  191    H    ARG  30           H        ARG  30 -10.837  -3.955   2.073
  192    HA   ARG  30           HA       ARG  30  -9.374  -3.674   0.265
  193   1HB   ARG  30          2HB       ARG  30 -11.696  -4.147  -0.861
  194   2HB   ARG  30          1HB       ARG  30 -11.636  -2.439  -1.284
  195   1HG   ARG  30          2HG       ARG  30  -9.839  -2.709  -2.715
  196   2HG   ARG  30          1HG       ARG  30  -9.208  -4.095  -1.827
  197   1HD   ARG  30          2HD       ARG  30 -10.846  -5.563  -2.753
  198   2HD   ARG  30          1HD       ARG  30 -11.804  -4.220  -3.373
  199    HE   ARG  30           HE       ARG  30 -10.379  -4.148  -5.257
  200   1HH1  ARG  30          1HH2      ARG  30  -7.790  -3.816  -3.830
  201   2HH1  ARG  30          2HH2      ARG  30  -6.946  -5.277  -4.230
  202   1HH2  ARG  30          2HH1      ARG  30  -9.810  -6.954  -5.267
  203   2HH2  ARG  30          1HH1      ARG  30  -8.095  -7.059  -5.048
  204    H    LEU  31           H        LEU  31  -9.893  -1.417   2.211
  205    HA   LEU  31           HA       LEU  31  -9.029   0.860   0.480
  206   1HB   LEU  31          2HB       LEU  31 -10.596   0.809   3.062
  207   2HB   LEU  31          1HB       LEU  31  -9.838   2.279   2.452
  208    HG   LEU  31           HG       LEU  31 -11.814   0.589   0.889
  209   1HD1  LEU  31          1HD1      LEU  31 -13.445   2.309   1.362
  210   2HD1  LEU  31          2HD1      LEU  31 -12.239   3.293   2.192
  211   3HD1  LEU  31          3HD1      LEU  31 -12.773   1.770   2.900
  212   1HD2  LEU  31          1HD2      LEU  31 -10.318   3.157   0.358
  213   2HD2  LEU  31          2HD2      LEU  31 -11.858   2.834  -0.438
  214   3HD2  LEU  31          3HD2      LEU  31 -10.493   1.747  -0.687
  215    H    ARG  32           H        ARG  32  -7.968  -1.339   2.848
  216    HA   ARG  32           HA       ARG  32  -6.036   0.497   4.103
  217   1HB   ARG  32          2HB       ARG  32  -7.248  -1.574   5.186
  218   2HB   ARG  32          1HB       ARG  32  -5.962  -2.494   4.405
  219   1HG   ARG  32          2HG       ARG  32  -4.681  -1.998   6.195
  220   2HG   ARG  32          1HG       ARG  32  -4.626  -0.346   5.580
  221   1HD   ARG  32          2HD       ARG  32  -6.016   0.422   7.197
  222   2HD   ARG  32          1HD       ARG  32  -7.102  -0.960   7.040
  223    HE   ARG  32           HE       ARG  32  -5.174  -2.181   8.371
  224   1HH1  ARG  32          2HH1      ARG  32  -3.767   0.453   8.864
  225   2HH1  ARG  32          1HH1      ARG  32  -4.366   0.882  10.432
  226   1HH2  ARG  32          1HH2      ARG  32  -7.014  -1.369  10.321
  227   2HH2  ARG  32          2HH2      ARG  32  -6.212  -0.154  11.261
  228    H    CYS  33           H        CYS  33  -3.875   0.628   3.531
  229    HA   CYS  33           HA       CYS  33  -3.082  -0.730   1.031
  230   1HB   CYS  33          2HB       CYS  33  -2.136   1.629   2.578
  231   2HB   CYS  33          1HB       CYS  33  -0.915   0.746   1.661
  232    H    THR  34           H        THR  34  -2.304  -2.765   1.291
  233    HA   THR  34           HA       THR  34  -0.615  -3.364   3.671
  234    HB   THR  34           HB       THR  34  -1.934  -5.247   1.689
  235    HG1  THR  34           HG1      THR  34  -3.608  -4.959   2.899
  236   1HG2  THR  34          1HG2      THR  34  -1.406  -6.909   3.566
  237   2HG2  THR  34          2HG2      THR  34  -0.326  -5.675   4.212
  238   3HG2  THR  34          3HG2      THR  34  -0.033  -6.352   2.611
  239    H    CYS  35           H        CYS  35   1.520  -3.092   3.268
  240    HA   CYS  35           HA       CYS  35   2.574  -3.559   0.527
  241   1HB   CYS  35          2HB       CYS  35   4.148  -2.484   2.870
  242   2HB   CYS  35          1HB       CYS  35   4.455  -2.257   1.148
  243    H    TYR  36           H        TYR  36   4.110  -5.164   0.098
  244    HA   TYR  36           HA       TYR  36   4.566  -7.110   2.317
  245   1HB   TYR  36          2HB       TYR  36   5.223  -8.652   0.327
  246   2HB   TYR  36          1HB       TYR  36   3.518  -8.306   0.592
  247    HD1  TYR  36           HD1      TYR  36   6.480  -7.476  -1.484
  248    HD2  TYR  36           HD2      TYR  36   2.237  -7.014  -0.985
  249    HE1  TYR  36           HE1      TYR  36   6.307  -6.551  -3.777
  250    HE2  TYR  36           HE2      TYR  36   2.065  -6.088  -3.278
  251    HH   TYR  36           HH       TYR  36   4.873  -5.232  -5.132
  252    H    ARG  37           H        ARG  37   6.664  -8.013   2.623
  253    HA   ARG  37           HA       ARG  37   8.844  -6.183   2.416
  254   1HB   ARG  37          2HB       ARG  37   8.603  -9.093   3.104
  255   2HB   ARG  37          1HB       ARG  37  10.202  -8.384   2.883
  256   1HG   ARG  37          2HG       ARG  37   9.879  -6.826   4.648
  257   2HG   ARG  37          1HG       ARG  37   8.139  -7.113   4.686
  258   1HD   ARG  37          2HD       ARG  37   9.669  -9.569   5.093
  259   2HD   ARG  37          1HD       ARG  37  10.028  -8.349   6.314
  260    HE   ARG  37           HE       ARG  37   7.186  -9.042   5.724
  261   1HH1  ARG  37          2HH1      ARG  37   8.364  -7.205   7.950
  262   2HH1  ARG  37          1HH1      ARG  37   8.139  -8.225   9.331
  263   1HH2  ARG  37          1HH2      ARG  37   7.559 -11.089   7.448
  264   2HH2  ARG  37          2HH2      ARG  37   7.682 -10.434   9.046
  265    H    CYS  38           H        CYS  38  10.704  -6.228   1.080
  266    HA   CYS  38           HA       CYS  38  10.221  -7.346  -1.620
  267   1HB   CYS  38          2HB       CYS  38  11.041  -4.928  -1.101
  268   2HB   CYS  38          1HB       CYS  38  12.614  -5.685  -0.848
  269    H    GLY  39           HN       GLY  39  11.115  -9.251  -2.190
  270   1HA   GLY  39          2HA       GLY  39  13.254 -10.421  -0.511
  271   2HA   GLY  39          1HA       GLY  39  12.317 -11.280  -1.733
  Start of MODEL    6
    1   1H    GLY   1          1H        GLY   1  -8.695   4.731   1.329
    2   2H    GLY   1          2H        GLY   1  -8.888   4.308   2.963
    3   3H    GLY   1          3H        GLY   1  -7.781   3.462   1.988
    4   1HA   GLY   1          2HA       GLY   1  -7.503   6.370   2.427
    5   2HA   GLY   1          1HA       GLY   1  -6.862   5.214   3.593
    6    H    PHE   2           H        PHE   2  -5.089   6.852   2.326
    7    HA   PHE   2           HA       PHE   2  -3.124   6.872   1.054
    8   1HB   PHE   2          2HB       PHE   2  -3.478   3.864   1.272
    9   2HB   PHE   2          1HB       PHE   2  -1.992   4.683   0.791
   10    HD1  PHE   2           HD1      PHE   2  -1.439   6.776   2.518
   11    HD2  PHE   2           HD2      PHE   2  -3.501   3.130   3.476
   12    HE1  PHE   2           HE1      PHE   2  -0.821   7.052   4.904
   13    HE2  PHE   2           HE2      PHE   2  -2.882   3.407   5.860
   14    HZ   PHE   2           HZ       PHE   2  -1.543   5.368   6.574
   15    H    GLY   3           H        GLY   3  -5.709   6.918  -0.392
   16   1HA   GLY   3          2HA       GLY   3  -6.388   6.960  -2.628
   17   2HA   GLY   3          1HA       GLY   3  -4.717   6.619  -3.071
   18    H    CYS   4           H        CYS   4  -7.379   4.862  -1.429
   19    HA   CYS   4           HA       CYS   4  -6.681   2.475  -3.087
   20   1HB   CYS   4          2HB       CYS   4  -7.653   2.777  -0.263
   21   2HB   CYS   4          1HB       CYS   4  -8.055   1.312  -1.157
   22    HA   PRO   5           HA       PRO   5  -7.740   0.444  -3.013
   23   1HB   PRO   5          2HB       PRO   5  -8.814  -1.008  -5.079
   24   2HB   PRO   5          1HB       PRO   5  -9.487  -0.980  -3.441
   25   1HG   PRO   5          2HG       PRO   5 -10.515   0.327  -5.909
   26   2HG   PRO   5          1HG       PRO   5 -11.395  -0.178  -4.458
   27   1HD   PRO   5          2HD       PRO   5 -10.591   2.472  -5.102
   28   2HD   PRO   5          1HD       PRO   5 -11.238   1.912  -3.544
   29    H    ASN   6           H        ASN   6  -7.419   2.952  -4.957
   30    HA   ASN   6           HA       ASN   6  -6.417   2.143  -7.458
   31   1HB   ASN   6          2HB       ASN   6  -6.720   4.528  -6.505
   32   2HB   ASN   6          1HB       ASN   6  -5.103   4.321  -5.833
   33   1HD2  ASN   6          1HD2      ASN   6  -6.830   5.174  -8.684
   34   2HD2  ASN   6          2HD2      ASN   6  -5.509   5.180  -9.749
   35    H    ASN   7           H        ASN   7  -4.593   1.098  -8.113
   36    HA   ASN   7           HA       ASN   7  -2.830  -0.100  -6.119
   37   1HB   ASN   7          2HB       ASN   7  -3.115  -0.257  -9.104
   38   2HB   ASN   7          1HB       ASN   7  -1.629  -0.838  -8.355
   39   1HD2  ASN   7          1HD2      ASN   7  -2.057  -2.397  -6.385
   40   2HD2  ASN   7          2HD2      ASN   7  -3.326  -3.508  -6.577
   41    H    TYR   8           H        TYR   8  -2.485   2.388  -8.656
   42    HA   TYR   8           HA       TYR   8   0.316   2.827  -8.348
   43   1HB   TYR   8          2HB       TYR   8  -1.313   3.727 -10.162
   44   2HB   TYR   8          1HB       TYR   8  -1.635   5.030  -9.020
   45    HD1  TYR   8           HD1      TYR   8  -0.413   6.965  -9.412
   46    HD2  TYR   8           HD2      TYR   8   1.401   3.155 -10.218
   47    HE1  TYR   8           HE1      TYR   8   1.667   8.107 -10.131
   48    HE2  TYR   8           HE2      TYR   8   3.480   4.297 -10.937
   49    HH   TYR   8           HH       TYR   8   3.923   6.848 -11.940
   50    H    GLN   9           H        GLN   9  -2.460   4.536  -6.855
   51    HA   GLN   9           HA       GLN   9  -0.934   6.306  -5.228
   52   1HB   GLN   9          2HB       GLN   9  -3.715   5.169  -5.026
   53   2HB   GLN   9          1HB       GLN   9  -3.068   6.170  -3.728
   54   1HG   GLN   9          2HG       GLN   9  -2.679   7.242  -6.461
   55   2HG   GLN   9          1HG       GLN   9  -4.352   7.177  -5.907
   56   1HE2  GLN   9          1HE2      GLN   9  -1.116   8.429  -4.987
   57   2HE2  GLN   9          2HE2      GLN   9  -1.708   9.679  -4.005
   58    H    CYS  10           H        CYS  10  -2.294   3.086  -4.476
   59    HA   CYS  10           HA       CYS  10  -1.298   2.933  -1.801
   60   1HB   CYS  10          2HB       CYS  10  -3.002   1.403  -3.033
   61   2HB   CYS  10          1HB       CYS  10  -1.580   0.529  -3.599
   62    H    HIS  11           H        HIS  11   0.107   1.998  -4.923
   63    HA   HIS  11           HA       HIS  11   2.447   0.712  -3.931
   64   1HB   HIS  11          2HB       HIS  11   1.597   0.696  -6.326
   65   2HB   HIS  11          1HB       HIS  11   2.271   2.317  -6.492
   66    HD1  HIS  11           HD1      HIS  11   3.418  -1.183  -5.508
   67    HD2  HIS  11           HD2      HIS  11   4.966   2.332  -7.129
   68    HE1  HIS  11           HE1      HIS  11   5.825  -1.679  -6.124
   69    H    ARG  12           H        ARG  12   1.830   4.137  -4.753
   70    HA   ARG  12           HA       ARG  12   4.485   5.084  -4.313
   71   1HB   ARG  12          2HB       ARG  12   2.290   6.282  -5.234
   72   2HB   ARG  12          1HB       ARG  12   2.156   6.803  -3.552
   73   1HG   ARG  12          2HG       ARG  12   4.503   7.648  -3.665
   74   2HG   ARG  12          1HG       ARG  12   4.543   7.221  -5.377
   75   1HD   ARG  12          2HD       ARG  12   2.308   8.674  -5.425
   76   2HD   ARG  12          1HD       ARG  12   3.044   9.413  -4.001
   77    HE   ARG  12           HE       ARG  12   5.117   9.559  -5.707
   78   1HH1  ARG  12          1HH2      ARG  12   3.161   9.030  -7.968
   79   2HH1  ARG  12          2HH2      ARG  12   2.762  10.640  -8.466
   80   1HH2  ARG  12          2HH1      ARG  12   4.015  12.118  -5.577
   81   2HH2  ARG  12          1HH1      ARG  12   3.253  12.398  -7.107
   82    H    HIS  13           H        HIS  13   1.725   4.738  -2.081
   83    HA   HIS  13           HA       HIS  13   3.049   5.823   0.223
   84   1HB   HIS  13          2HB       HIS  13   0.611   5.564   0.148
   85   2HB   HIS  13          1HB       HIS  13   0.779   3.814   0.023
   86    HD1  HIS  13           HD1      HIS  13   2.098   6.502   2.407
   87    HD2  HIS  13           HD2      HIS  13   0.496   2.656   2.500
   88    HE1  HIS  13           HE1      HIS  13   1.979   5.835   4.848
   89    H    CYS  14           H        CYS  14   2.642   2.464  -0.935
   90    HA   CYS  14           HA       CYS  14   4.087   1.237   1.214
   91   1HB   CYS  14          2HB       CYS  14   3.438   0.371  -1.604
   92   2HB   CYS  14          1HB       CYS  14   4.384  -0.647  -0.517
   93    H    LYS  15           H        LYS  15   5.124   2.630  -1.874
   94    HA   LYS  15           HA       LYS  15   7.827   1.648  -1.773
   95   1HB   LYS  15          2HB       LYS  15   6.385   3.779  -3.306
   96   2HB   LYS  15          1HB       LYS  15   8.149   3.794  -3.302
   97   1HG   LYS  15          2HG       LYS  15   7.643   1.139  -3.749
   98   2HG   LYS  15          1HG       LYS  15   6.287   1.894  -4.587
   99   1HD   LYS  15          2HD       LYS  15   7.617   2.755  -6.213
  100   2HD   LYS  15          1HD       LYS  15   8.865   3.233  -5.064
  101   1HE   LYS  15          2HE       LYS  15   8.451   0.325  -5.724
  102   2HE   LYS  15          1HE       LYS  15   9.409   1.351  -6.791
  103   1HZ   LYS  15          1HZ       LYS  15  10.838   0.314  -5.187
  104   2HZ   LYS  15          2HZ       LYS  15   9.884   0.873  -3.897
  105   3HZ   LYS  15          3HZ       LYS  15  10.761   1.975  -4.848
  106    H    SER  16           H        SER  16   6.301   4.680  -0.632
  107    HA   SER  16           HA       SER  16   8.716   5.973   0.178
  108   1HB   SER  16          2HB       SER  16   7.307   7.416   1.536
  109   2HB   SER  16          1HB       SER  16   6.488   7.103   0.010
  110    HG   SER  16           HG       SER  16   5.893   6.245   2.595
  111    H    ILE  17           H        ILE  17   6.799   3.439   1.672
  112    HA   ILE  17           HA       ILE  17   8.149   3.637   4.265
  113    HB   ILE  17           HB       ILE  17   6.374   1.461   3.104
  114   1HG1  ILE  17          2HG1      ILE  17   5.522   3.321   5.284
  115   2HG1  ILE  17          1HG1      ILE  17   5.566   3.958   3.641
  116   1HG2  ILE  17          1HG2      ILE  17   7.725   0.534   4.882
  117   2HG2  ILE  17          2HG2      ILE  17   6.116   0.836   5.539
  118   3HG2  ILE  17          3HG2      ILE  17   7.438   1.946   5.902
  119   1HD1  ILE  17          1HD1      ILE  17   4.301   1.694   3.084
  120   2HD1  ILE  17          2HD1      ILE  17   3.417   3.096   3.684
  121   3HD1  ILE  17          3HD1      ILE  17   3.850   1.789   4.786
  122    HA   PRO  18           HA       PRO  18  11.629   1.268   2.843
  123   1HB   PRO  18          2HB       PRO  18  12.876   1.120   5.290
  124   2HB   PRO  18          1HB       PRO  18  12.913   2.556   4.252
  125   1HG   PRO  18          2HG       PRO  18  11.361   2.088   6.756
  126   2HG   PRO  18          1HG       PRO  18  11.926   3.613   6.054
  127   1HD   PRO  18          2HD       PRO  18   9.288   2.599   5.912
  128   2HD   PRO  18          1HD       PRO  18   9.945   3.939   4.947
  129    H    GLY  19           H        GLY  19  12.202  -0.926   2.841
  130   1HA   GLY  19          2HA       GLY  19  12.327  -3.149   3.780
  131   2HA   GLY  19          1HA       GLY  19  11.076  -2.705   4.937
  132    H    ARG  20           H        ARG  20   9.734  -1.446   2.315
  133    HA   ARG  20           HA       ARG  20   8.483  -4.029   1.465
  134   1HB   ARG  20          2HB       ARG  20   7.113  -1.347   1.298
  135   2HB   ARG  20          1HB       ARG  20   6.386  -2.951   1.272
  136   1HG   ARG  20          2HG       ARG  20   7.914  -2.011   3.695
  137   2HG   ARG  20          1HG       ARG  20   6.228  -1.554   3.466
  138   1HD   ARG  20          2HD       ARG  20   6.045  -4.200   2.946
  139   2HD   ARG  20          1HD       ARG  20   7.400  -4.215   4.074
  140    HE   ARG  20           HE       ARG  20   4.695  -3.111   4.718
  141   1HH1  ARG  20          1HH2      ARG  20   5.422  -5.738   5.881
  142   2HH1  ARG  20          2HH2      ARG  20   6.084  -5.308   7.423
  143   1HH2  ARG  20          2HH1      ARG  20   6.561  -1.967   6.580
  144   2HH2  ARG  20          1HH1      ARG  20   6.735  -3.169   7.816
  145    H    CYS  21           H        CYS  21   8.063  -4.303  -0.758
  146    HA   CYS  21           HA       CYS  21   9.564  -2.444  -2.542
  147   1HB   CYS  21          2HB       CYS  21   9.255  -5.310  -2.450
  148   2HB   CYS  21          1HB       CYS  21   8.668  -4.706  -3.999
  149    H    GLY  22           H        GLY  22   6.472  -4.237  -2.405
  150   1HA   GLY  22          2HA       GLY  22   5.224  -2.012  -3.947
  151   2HA   GLY  22          1HA       GLY  22   4.913  -3.685  -4.405
  152    H    GLY  23           H        GLY  23   2.628  -2.661  -3.887
  153   1HA   GLY  23          2HA       GLY  23   1.776  -3.826  -1.363
  154   2HA   GLY  23          1HA       GLY  23   1.690  -2.067  -1.342
  155    H    TYR  24           H        TYR  24  -0.579  -3.677  -1.076
  156    HA   TYR  24           HA       TYR  24  -2.096  -2.893  -3.511
  157   1HB   TYR  24          2HB       TYR  24  -3.222  -5.017  -3.641
  158   2HB   TYR  24          1HB       TYR  24  -1.495  -5.363  -3.581
  159    HD1  TYR  24           HD1      TYR  24  -0.443  -6.069  -1.393
  160    HD2  TYR  24           HD2      TYR  24  -4.695  -5.741  -1.906
  161    HE1  TYR  24           HE1      TYR  24  -0.795  -7.434   0.646
  162    HE2  TYR  24           HE2      TYR  24  -5.045  -7.107   0.131
  163    HH   TYR  24           HH       TYR  24  -3.800  -7.682   2.199
  164    H    CYS  25           H        CYS  25  -4.451  -2.744  -3.071
  165    HA   CYS  25           HA       CYS  25  -4.937  -1.746  -0.333
  166   1HB   CYS  25          2HB       CYS  25  -6.643  -1.696  -2.840
  167   2HB   CYS  25          1HB       CYS  25  -7.121  -0.988  -1.297
  168    H    GLY  26           H        GLY  26  -5.458  -3.323   1.112
  169   1HA   GLY  26          2HA       GLY  26  -7.871  -4.877   0.811
  170   2HA   GLY  26          1HA       GLY  26  -6.452  -5.895   0.578
  171    H    GLY  27           H        GLY  27  -8.476  -5.808   2.802
  172   1HA   GLY  27          2HA       GLY  27  -7.530  -6.712   5.018
  173   2HA   GLY  27          1HA       GLY  27  -6.645  -5.188   5.088
  174    H    TRP  28           H        TRP  28  -8.357  -3.282   4.454
  175    HA   TRP  28           HA       TRP  28 -10.704  -3.653   6.265
  176   1HB   TRP  28          2HB       TRP  28  -8.877  -2.151   7.167
  177   2HB   TRP  28          1HB       TRP  28  -9.193  -1.065   5.815
  178    HD1  TRP  28           HD1      TRP  28 -10.917  -2.543   8.919
  179    HE1  TRP  28           HE1      TRP  28 -12.828  -0.966   9.621
  180    HE3  TRP  28           HE3      TRP  28 -10.786   0.784   5.047
  181    HZ2  TRP  28           HZ2      TRP  28 -14.129   1.395   8.670
  182    HZ3  TRP  28           HZ3      TRP  28 -12.370   2.686   4.972
  183    HH2  TRP  28           HH2      TRP  28 -14.042   2.995   6.776
  184    H    HIS  29           H        HIS  29 -12.059  -4.183   4.480
  185    HA   HIS  29           HA       HIS  29 -13.548  -3.726   2.738
  186   1HB   HIS  29          2HB       HIS  29 -13.056  -0.825   3.479
  187   2HB   HIS  29          1HB       HIS  29 -14.470  -1.482   2.660
  188    HD1  HIS  29           HD1      HIS  29 -14.333  -0.022   5.567
  189    HD2  HIS  29           HD2      HIS  29 -14.793  -4.096   4.823
  190    HE1  HIS  29           HE1      HIS  29 -15.388  -1.014   7.646
  191    H    ARG  30           H        ARG  30 -10.652  -3.881   2.161
  192    HA   ARG  30           HA       ARG  30  -9.206  -3.568   0.348
  193   1HB   ARG  30          2HB       ARG  30 -11.374  -4.195  -0.867
  194   2HB   ARG  30          1HB       ARG  30 -11.596  -2.469  -1.143
  195   1HG   ARG  30          2HG       ARG  30  -9.375  -2.378  -2.253
  196   2HG   ARG  30          1HG       ARG  30  -9.202  -4.115  -2.017
  197   1HD   ARG  30          2HD       ARG  30 -11.651  -3.062  -3.398
  198   2HD   ARG  30          1HD       ARG  30 -10.139  -3.187  -4.298
  199    HE   ARG  30           HE       ARG  30 -10.168  -5.656  -3.514
  200   1HH1  ARG  30          1HH2      ARG  30 -12.768  -5.415  -2.029
  201   2HH1  ARG  30          2HH2      ARG  30 -13.909  -5.988  -3.199
  202   1HH2  ARG  30          2HH1      ARG  30 -11.719  -5.658  -5.879
  203   2HH2  ARG  30          1HH1      ARG  30 -13.312  -6.129  -5.389
  204    H    LEU  31           H        LEU  31  -9.702  -1.392   2.312
  205    HA   LEU  31           HA       LEU  31  -8.986   0.956   0.609
  206   1HB   LEU  31          2HB       LEU  31 -10.352   0.865   3.311
  207   2HB   LEU  31          1HB       LEU  31  -9.830   2.347   2.511
  208    HG   LEU  31           HG       LEU  31 -11.695   0.352   1.206
  209   1HD1  LEU  31          1HD1      LEU  31 -12.764   1.198   3.242
  210   2HD1  LEU  31          2HD1      LEU  31 -13.516   1.924   1.822
  211   3HD1  LEU  31          3HD1      LEU  31 -12.367   2.854   2.783
  212   1HD2  LEU  31          1HD2      LEU  31 -12.267   2.543  -0.061
  213   2HD2  LEU  31          2HD2      LEU  31 -10.736   1.755  -0.440
  214   3HD2  LEU  31          3HD2      LEU  31 -10.764   3.163   0.620
  215    H    ARG  32           H        ARG  32  -7.830  -1.226   3.005
  216    HA   ARG  32           HA       ARG  32  -5.865   0.665   4.117
  217   1HB   ARG  32          2HB       ARG  32  -7.051  -1.388   5.304
  218   2HB   ARG  32          1HB       ARG  32  -5.724  -2.294   4.578
  219   1HG   ARG  32          2HG       ARG  32  -4.267  -0.308   5.575
  220   2HG   ARG  32          1HG       ARG  32  -5.637  -0.155   6.674
  221   1HD   ARG  32          2HD       ARG  32  -4.460  -1.725   7.861
  222   2HD   ARG  32          1HD       ARG  32  -5.308  -2.827   6.776
  223    HE   ARG  32           HE       ARG  32  -3.019  -2.223   5.365
  224   1HH1  ARG  32          2HH1      ARG  32  -3.571  -4.894   6.726
  225   2HH1  ARG  32          1HH1      ARG  32  -2.161  -5.067   7.717
  226   1HH2  ARG  32          1HH2      ARG  32  -1.244  -1.723   7.449
  227   2HH2  ARG  32          2HH2      ARG  32  -0.836  -3.265   8.125
  228    H    CYS  33           H        CYS  33  -3.715   0.745   3.525
  229    HA   CYS  33           HA       CYS  33  -2.974  -0.679   1.046
  230   1HB   CYS  33          2HB       CYS  33  -2.039   1.734   2.494
  231   2HB   CYS  33          1HB       CYS  33  -0.785   0.814   1.661
  232    H    THR  34           H        THR  34  -2.394  -2.774   1.519
  233    HA   THR  34           HA       THR  34  -0.569  -3.287   3.802
  234    HB   THR  34           HB       THR  34  -2.001  -5.204   1.934
  235    HG1  THR  34           HG1      THR  34  -3.595  -4.749   3.209
  236   1HG2  THR  34          1HG2      THR  34  -0.320  -5.644   4.414
  237   2HG2  THR  34          2HG2      THR  34  -0.019  -6.271   2.794
  238   3HG2  THR  34          3HG2      THR  34  -1.385  -6.873   3.732
  239    H    CYS  35           H        CYS  35   1.568  -3.119   3.349
  240    HA   CYS  35           HA       CYS  35   2.517  -3.627   0.578
  241   1HB   CYS  35          2HB       CYS  35   4.267  -2.588   2.787
  242   2HB   CYS  35          1HB       CYS  35   4.363  -2.276   1.055
  243    H    TYR  36           H        TYR  36   4.051  -5.219   0.117
  244    HA   TYR  36           HA       TYR  36   4.502  -7.207   2.290
  245   1HB   TYR  36          2HB       TYR  36   5.334  -8.606   0.208
  246   2HB   TYR  36          1HB       TYR  36   3.614  -8.442   0.540
  247    HD1  TYR  36           HD1      TYR  36   6.408  -7.287  -1.598
  248    HD2  TYR  36           HD2      TYR  36   2.170  -7.135  -0.897
  249    HE1  TYR  36           HE1      TYR  36   6.071  -6.261  -3.831
  250    HE2  TYR  36           HE2      TYR  36   1.837  -6.108  -3.128
  251    HH   TYR  36           HH       TYR  36   3.541  -6.247  -5.488
  252    H    ARG  37           H        ARG  37   6.638  -8.203   2.475
  253    HA   ARG  37           HA       ARG  37   8.764  -6.237   2.440
  254   1HB   ARG  37          2HB       ARG  37   8.943  -9.230   2.898
  255   2HB   ARG  37          1HB       ARG  37  10.164  -8.036   3.331
  256   1HG   ARG  37          2HG       ARG  37   9.126  -7.650   5.287
  257   2HG   ARG  37          1HG       ARG  37   7.646  -7.208   4.435
  258   1HD   ARG  37          2HD       ARG  37   6.803  -9.404   4.502
  259   2HD   ARG  37          1HD       ARG  37   8.393 -10.104   4.801
  260    HE   ARG  37           HE       ARG  37   6.624  -8.901   6.824
  261   1HH1  ARG  37          2HH1      ARG  37   7.955 -11.506   7.271
  262   2HH1  ARG  37          1HH1      ARG  37   9.282 -11.090   8.302
  263   1HH2  ARG  37          1HH2      ARG  37   9.115  -7.693   7.580
  264   2HH2  ARG  37          2HH2      ARG  37   9.943  -8.920   8.478
  265    H    CYS  38           H        CYS  38  10.664  -6.234   1.175
  266    HA   CYS  38           HA       CYS  38  10.350  -7.453  -1.507
  267   1HB   CYS  38          2HB       CYS  38  11.060  -4.982  -0.978
  268   2HB   CYS  38          1HB       CYS  38  12.653  -5.691  -0.713
  269    H    GLY  39           HN       GLY  39  11.422  -9.283  -2.049
  270   1HA   GLY  39          2HA       GLY  39  13.432 -10.387  -0.187
  271   2HA   GLY  39          1HA       GLY  39  12.698 -11.244  -1.543
  Start of MODEL    7
    1   1H    GLY   1          1H        GLY   1  -7.302   3.502   2.275
    2   2H    GLY   1          2H        GLY   1  -8.217   4.639   1.404
    3   3H    GLY   1          3H        GLY   1  -8.377   4.529   3.093
    4   1HA   GLY   1          2HA       GLY   1  -7.003   6.447   2.208
    5   2HA   GLY   1          1HA       GLY   1  -6.289   5.468   3.488
    6    H    PHE   2           H        PHE   2  -4.486   6.791   2.067
    7    HA   PHE   2           HA       PHE   2  -2.549   6.566   0.772
    8   1HB   PHE   2          2HB       PHE   2  -3.124   3.594   0.771
    9   2HB   PHE   2          1HB       PHE   2  -1.556   4.391   0.646
   10    HD1  PHE   2           HD1      PHE   2  -3.768   2.766   2.849
   11    HD2  PHE   2           HD2      PHE   2  -1.009   6.054   2.672
   12    HE1  PHE   2           HE1      PHE   2  -3.553   2.719   5.319
   13    HE2  PHE   2           HE2      PHE   2  -0.795   6.008   5.143
   14    HZ   PHE   2           HZ       PHE   2  -2.068   4.340   6.467
   15    H    GLY   3           H        GLY   3  -5.235   6.808  -0.546
   16   1HA   GLY   3          2HA       GLY   3  -5.991   6.956  -2.751
   17   2HA   GLY   3          1HA       GLY   3  -4.376   6.489  -3.272
   18    H    CYS   4           H        CYS   4  -6.909   4.804  -1.376
   19    HA   CYS   4           HA       CYS   4  -6.528   2.444  -3.160
   20   1HB   CYS   4          2HB       CYS   4  -7.399   2.779  -0.306
   21   2HB   CYS   4          1HB       CYS   4  -7.941   1.364  -1.207
   22    HA   PRO   5           HA       PRO   5  -7.734   0.508  -3.019
   23   1HB   PRO   5          2HB       PRO   5  -9.031  -0.914  -4.975
   24   2HB   PRO   5          1HB       PRO   5  -9.616  -0.781  -3.308
   25   1HG   PRO   5          2HG       PRO   5 -10.666   0.519  -5.769
   26   2HG   PRO   5          1HG       PRO   5 -11.501   0.153  -4.251
   27   1HD   PRO   5          2HD       PRO   5 -10.489   2.692  -5.064
   28   2HD   PRO   5          1HD       PRO   5 -11.132   2.268  -3.463
   29    H    ASN   6           H        ASN   6  -7.269   2.924  -5.010
   30    HA   ASN   6           HA       ASN   6  -6.480   1.897  -7.540
   31   1HB   ASN   6          2HB       ASN   6  -6.673   4.354  -6.805
   32   2HB   ASN   6          1HB       ASN   6  -5.052   4.159  -6.137
   33   1HD2  ASN   6          1HD2      ASN   6  -6.830   3.569  -9.226
   34   2HD2  ASN   6          2HD2      ASN   6  -5.510   3.953 -10.222
   35    H    ASN   7           H        ASN   7  -4.612   0.936  -8.272
   36    HA   ASN   7           HA       ASN   7  -2.857  -0.295  -6.278
   37   1HB   ASN   7          2HB       ASN   7  -2.981  -0.429  -9.299
   38   2HB   ASN   7          1HB       ASN   7  -1.756  -1.275  -8.354
   39   1HD2  ASN   7          1HD2      ASN   7  -5.116  -1.326  -9.332
   40   2HD2  ASN   7          2HD2      ASN   7  -5.536  -2.748  -8.508
   41    H    TYR   8           H        TYR   8  -2.508   2.174  -8.837
   42    HA   TYR   8           HA       TYR   8   0.316   2.523  -8.576
   43   1HB   TYR   8          2HB       TYR   8  -0.760   3.482 -10.496
   44   2HB   TYR   8          1HB       TYR   8  -1.881   4.398  -9.490
   45    HD1  TYR   8           HD1      TYR   8  -1.395   6.630  -9.002
   46    HD2  TYR   8           HD2      TYR   8   1.807   3.962 -10.044
   47    HE1  TYR   8           HE1      TYR   8   0.207   8.520  -8.921
   48    HE2  TYR   8           HE2      TYR   8   3.408   5.854  -9.965
   49    HH   TYR   8           HH       TYR   8   2.866   8.735 -10.272
   50    H    GLN   9           H        GLN   9  -2.370   4.402  -7.116
   51    HA   GLN   9           HA       GLN   9  -0.743   6.078  -5.490
   52   1HB   GLN   9          2HB       GLN   9  -3.574   5.082  -5.078
   53   2HB   GLN   9          1HB       GLN   9  -2.820   6.339  -4.099
   54   1HG   GLN   9          2HG       GLN   9  -2.378   7.623  -6.218
   55   2HG   GLN   9          1HG       GLN   9  -3.342   6.424  -7.081
   56   1HE2  GLN   9          1HE2      GLN   9  -5.631   6.585  -6.935
   57   2HE2  GLN   9          2HE2      GLN   9  -6.427   7.766  -6.014
   58    H    CYS  10           H        CYS  10  -2.285   2.943  -4.758
   59    HA   CYS  10           HA       CYS  10  -1.404   2.743  -2.050
   60   1HB   CYS  10          2HB       CYS  10  -3.095   1.253  -3.295
   61   2HB   CYS  10          1HB       CYS  10  -1.694   0.382  -3.916
   62    H    HIS  11           H        HIS  11   0.089   1.721  -5.111
   63    HA   HIS  11           HA       HIS  11   2.388   0.441  -4.012
   64   1HB   HIS  11          2HB       HIS  11   1.650   0.323  -6.417
   65   2HB   HIS  11          1HB       HIS  11   2.233   1.974  -6.624
   66    HD1  HIS  11           HD1      HIS  11   3.578  -1.404  -5.460
   67    HD2  HIS  11           HD2      HIS  11   4.917   2.105  -7.268
   68    HE1  HIS  11           HE1      HIS  11   6.015  -1.780  -6.041
   69    H    ARG  12           H        ARG  12   1.778   3.840  -4.904
   70    HA   ARG  12           HA       ARG  12   4.394   4.856  -4.455
   71   1HB   ARG  12          2HB       ARG  12   2.385   6.090  -5.450
   72   2HB   ARG  12          1HB       ARG  12   1.840   6.343  -3.792
   73   1HG   ARG  12          2HG       ARG  12   4.676   7.034  -4.364
   74   2HG   ARG  12          1HG       ARG  12   3.456   8.087  -5.080
   75   1HD   ARG  12          2HD       ARG  12   3.246   7.313  -2.180
   76   2HD   ARG  12          1HD       ARG  12   4.336   8.610  -2.665
   77    HE   ARG  12           HE       ARG  12   1.443   8.701  -3.415
   78   1HH1  ARG  12          1HH2      ARG  12   3.390  10.885  -4.178
   79   2HH1  ARG  12          2HH2      ARG  12   3.099  12.062  -2.943
   80   1HH2  ARG  12          2HH1      ARG  12   1.442   9.838  -0.848
   81   2HH2  ARG  12          1HH1      ARG  12   1.989  11.468  -1.051
   82    H    HIS  13           H        HIS  13   1.647   4.483  -2.191
   83    HA   HIS  13           HA       HIS  13   2.967   5.547   0.108
   84   1HB   HIS  13          2HB       HIS  13   0.554   5.205   0.113
   85   2HB   HIS  13          1HB       HIS  13   0.765   3.467  -0.102
   86    HD1  HIS  13           HD1      HIS  13   2.256   6.001   2.353
   87    HD2  HIS  13           HD2      HIS  13   0.415   2.261   2.346
   88    HE1  HIS  13           HE1      HIS  13   2.208   5.221   4.763
   89    H    CYS  14           H        CYS  14   2.633   2.155  -1.014
   90    HA   CYS  14           HA       CYS  14   4.176   0.974   1.075
   91   1HB   CYS  14          2HB       CYS  14   3.705   0.103  -1.788
   92   2HB   CYS  14          1HB       CYS  14   4.523  -0.898  -0.588
   93    H    LYS  15           H        LYS  15   5.137   2.422  -2.021
   94    HA   LYS  15           HA       LYS  15   7.893   1.629  -1.933
   95   1HB   LYS  15          2HB       LYS  15   6.352   3.771  -3.370
   96   2HB   LYS  15          1HB       LYS  15   8.115   3.796  -3.410
   97   1HG   LYS  15          2HG       LYS  15   7.857   1.253  -4.031
   98   2HG   LYS  15          1HG       LYS  15   6.228   1.733  -4.511
   99   1HD   LYS  15          2HD       LYS  15   6.990   2.719  -6.390
  100   2HD   LYS  15          1HD       LYS  15   8.207   3.626  -5.491
  101   1HE   LYS  15          2HE       LYS  15   8.624   0.692  -5.994
  102   2HE   LYS  15          1HE       LYS  15   8.971   1.851  -7.276
  103   1HZ   LYS  15          1HZ       LYS  15  10.180   1.703  -4.577
  104   2HZ   LYS  15          2HZ       LYS  15  10.327   3.078  -5.563
  105   3HZ   LYS  15          3HZ       LYS  15  10.959   1.588  -6.078
  106    H    SER  16           H        SER  16   6.180   4.509  -0.693
  107    HA   SER  16           HA       SER  16   8.526   5.899   0.193
  108   1HB   SER  16          2HB       SER  16   7.032   7.300   1.460
  109   2HB   SER  16          1HB       SER  16   6.214   6.899  -0.045
  110    HG   SER  16           HG       SER  16   5.074   5.286   1.095
  111    H    ILE  17           H        ILE  17   6.697   3.236   1.554
  112    HA   ILE  17           HA       ILE  17   7.880   3.458   4.221
  113    HB   ILE  17           HB       ILE  17   6.433   1.117   2.933
  114   1HG1  ILE  17          2HG1      ILE  17   5.203   2.992   4.934
  115   2HG1  ILE  17          1HG1      ILE  17   5.265   3.474   3.239
  116   1HG2  ILE  17          1HG2      ILE  17   7.181   1.785   5.792
  117   2HG2  ILE  17          2HG2      ILE  17   7.664   0.369   4.858
  118   3HG2  ILE  17          3HG2      ILE  17   5.987   0.558   5.371
  119   1HD1  ILE  17          1HD1      ILE  17   3.542   2.118   2.746
  120   2HD1  ILE  17          2HD1      ILE  17   3.391   1.742   4.461
  121   3HD1  ILE  17          3HD1      ILE  17   4.397   0.733   3.423
  122    HA   PRO  18           HA       PRO  18  11.636   1.446   2.954
  123   1HB   PRO  18          2HB       PRO  18  12.767   1.388   5.460
  124   2HB   PRO  18          1HB       PRO  18  12.720   2.833   4.437
  125   1HG   PRO  18          2HG       PRO  18  11.096   2.192   6.854
  126   2HG   PRO  18          1HG       PRO  18  11.548   3.772   6.192
  127   1HD   PRO  18          2HD       PRO  18   9.028   2.513   5.909
  128   2HD   PRO  18          1HD       PRO  18   9.602   3.923   4.992
  129    H    GLY  19           H        GLY  19  11.949  -0.722   2.652
  130   1HA   GLY  19          2HA       GLY  19  12.390  -2.938   3.659
  131   2HA   GLY  19          1HA       GLY  19  11.086  -2.614   4.799
  132    H    ARG  20           H        ARG  20   9.350  -1.455   2.665
  133    HA   ARG  20           HA       ARG  20   8.397  -4.042   1.556
  134   1HB   ARG  20          2HB       ARG  20   6.950  -1.397   1.379
  135   2HB   ARG  20          1HB       ARG  20   6.271  -3.019   1.280
  136   1HG   ARG  20          2HG       ARG  20   7.688  -2.138   3.785
  137   2HG   ARG  20          1HG       ARG  20   6.011  -1.672   3.508
  138   1HD   ARG  20          2HD       ARG  20   5.925  -4.335   2.880
  139   2HD   ARG  20          1HD       ARG  20   7.145  -4.322   4.153
  140    HE   ARG  20           HE       ARG  20   4.323  -3.939   4.553
  141   1HH1  ARG  20          2HH1      ARG  20   6.254  -4.824   6.672
  142   2HH1  ARG  20          1HH1      ARG  20   6.266  -3.468   7.746
  143   1HH2  ARG  20          1HH2      ARG  20   4.840  -1.297   5.436
  144   2HH2  ARG  20          2HH2      ARG  20   5.458  -1.463   7.046
  145    H    CYS  21           H        CYS  21   8.020  -4.318  -0.681
  146    HA   CYS  21           HA       CYS  21   9.491  -2.396  -2.428
  147   1HB   CYS  21          2HB       CYS  21   9.419  -5.253  -2.304
  148   2HB   CYS  21          1HB       CYS  21   8.730  -4.758  -3.850
  149    H    GLY  22           H        GLY  22   6.543  -4.429  -2.458
  150   1HA   GLY  22          2HA       GLY  22   5.201  -2.282  -4.044
  151   2HA   GLY  22          1HA       GLY  22   4.989  -3.983  -4.456
  152    H    GLY  23           H        GLY  23   2.650  -2.929  -3.998
  153   1HA   GLY  23          2HA       GLY  23   1.744  -4.162  -1.532
  154   2HA   GLY  23          1HA       GLY  23   1.670  -2.406  -1.448
  155    H    TYR  24           H        TYR  24  -0.633  -3.897  -1.242
  156    HA   TYR  24           HA       TYR  24  -2.098  -3.063  -3.689
  157   1HB   TYR  24          2HB       TYR  24  -3.264  -5.171  -3.868
  158   2HB   TYR  24          1HB       TYR  24  -1.539  -5.531  -3.832
  159    HD1  TYR  24           HD1      TYR  24  -4.724  -5.852  -2.086
  160    HD2  TYR  24           HD2      TYR  24  -0.475  -6.383  -1.729
  161    HE1  TYR  24           HE1      TYR  24  -5.070  -7.264  -0.078
  162    HE2  TYR  24           HE2      TYR  24  -0.824  -7.797   0.280
  163    HH   TYR  24           HH       TYR  24  -3.462  -9.269   1.056
  164    H    CYS  25           H        CYS  25  -4.412  -2.762  -3.274
  165    HA   CYS  25           HA       CYS  25  -4.928  -1.871  -0.517
  166   1HB   CYS  25          2HB       CYS  25  -6.635  -1.774  -3.023
  167   2HB   CYS  25          1HB       CYS  25  -7.100  -1.078  -1.470
  168    H    GLY  26           H        GLY  26  -5.640  -3.336   0.950
  169   1HA   GLY  26          2HA       GLY  26  -7.979  -4.941   0.566
  170   2HA   GLY  26          1HA       GLY  26  -6.553  -5.954   0.358
  171    H    GLY  27           H        GLY  27  -8.687  -5.706   2.557
  172   1HA   GLY  27          2HA       GLY  27  -7.840  -6.693   4.785
  173   2HA   GLY  27          1HA       GLY  27  -6.852  -5.235   4.872
  174    H    TRP  28           H        TRP  28  -8.017  -3.152   4.922
  175    HA   TRP  28           HA       TRP  28 -10.523  -3.390   6.489
  176   1HB   TRP  28          2HB       TRP  28  -8.609  -2.000   7.344
  177   2HB   TRP  28          1HB       TRP  28  -8.833  -0.927   5.964
  178    HD1  TRP  28           HD1      TRP  28 -10.683  -2.180   9.095
  179    HE1  TRP  28           HE1      TRP  28 -12.450  -0.426   9.755
  180    HE3  TRP  28           HE3      TRP  28 -10.254   1.040   5.153
  181    HZ2  TRP  28           HZ2      TRP  28 -13.538   2.018   8.751
  182    HZ3  TRP  28           HZ3      TRP  28 -11.667   3.072   5.032
  183    HH2  TRP  28           HH2      TRP  28 -13.309   3.564   6.823
  184    H    HIS  29           H        HIS  29 -12.030  -3.798   4.824
  185    HA   HIS  29           HA       HIS  29 -13.537  -3.264   3.117
  186   1HB   HIS  29          2HB       HIS  29 -12.744  -0.410   3.778
  187   2HB   HIS  29          1HB       HIS  29 -14.231  -0.929   2.989
  188    HD1  HIS  29           HD1      HIS  29 -13.974   0.568   5.838
  189    HD2  HIS  29           HD2      HIS  29 -14.707  -3.490   5.232
  190    HE1  HIS  29           HE1      HIS  29 -15.064  -0.288   7.959
  191    H    ARG  30           H        ARG  30 -10.675  -3.673   2.453
  192    HA   ARG  30           HA       ARG  30  -9.250  -3.513   0.613
  193   1HB   ARG  30          2HB       ARG  30 -11.494  -4.114  -0.490
  194   2HB   ARG  30          1HB       ARG  30 -11.608  -2.406  -0.914
  195   1HG   ARG  30          2HG       ARG  30  -9.883  -2.521  -2.430
  196   2HG   ARG  30          1HG       ARG  30  -9.030  -3.766  -1.521
  197   1HD   ARG  30          2HD       ARG  30 -11.336  -5.076  -2.266
  198   2HD   ARG  30          1HD       ARG  30 -11.023  -4.047  -3.665
  199    HE   ARG  30           HE       ARG  30  -9.235  -6.197  -2.666
  200   1HH1  ARG  30          1HH2      ARG  30  -7.845  -3.658  -3.709
  201   2HH1  ARG  30          2HH2      ARG  30  -7.559  -4.098  -5.359
  202   1HH2  ARG  30          2HH1      ARG  30  -9.774  -6.779  -5.298
  203   2HH2  ARG  30          1HH1      ARG  30  -8.657  -5.873  -6.262
  204    H    LEU  31           H        LEU  31  -9.690  -1.154   2.423
  205    HA   LEU  31           HA       LEU  31  -8.896   1.033   0.553
  206   1HB   LEU  31          2HB       LEU  31 -10.167   1.118   3.299
  207   2HB   LEU  31          1HB       LEU  31  -9.525   2.545   2.487
  208    HG   LEU  31           HG       LEU  31 -11.546   0.733   1.158
  209   1HD1  LEU  31          1HD1      LEU  31 -12.161   3.259   2.716
  210   2HD1  LEU  31          2HD1      LEU  31 -12.404   1.634   3.359
  211   3HD1  LEU  31          3HD1      LEU  31 -13.315   2.169   1.947
  212   1HD2  LEU  31          1HD2      LEU  31 -11.963   2.750  -0.194
  213   2HD2  LEU  31          2HD2      LEU  31 -10.254   2.318  -0.253
  214   3HD2  LEU  31          3HD2      LEU  31 -10.792   3.650   0.769
  215    H    ARG  32           H        ARG  32  -7.743  -1.076   3.011
  216    HA   ARG  32           HA       ARG  32  -5.618   0.729   3.942
  217   1HB   ARG  32          2HB       ARG  32  -6.850  -1.262   5.213
  218   2HB   ARG  32          1HB       ARG  32  -5.572  -2.218   4.465
  219   1HG   ARG  32          2HG       ARG  32  -4.308  -1.588   6.239
  220   2HG   ARG  32          1HG       ARG  32  -4.187  -0.029   5.422
  221   1HD   ARG  32          2HD       ARG  32  -6.341   0.630   6.602
  222   2HD   ARG  32          1HD       ARG  32  -6.165  -0.837   7.567
  223    HE   ARG  32           HE       ARG  32  -4.184   1.408   7.575
  224   1HH1  ARG  32          1HH2      ARG  32  -6.145   1.061   9.843
  225   2HH1  ARG  32          2HH2      ARG  32  -5.201   0.178  10.995
  226   1HH2  ARG  32          2HH1      ARG  32  -2.780  -0.760   8.683
  227   2HH2  ARG  32          1HH1      ARG  32  -3.288  -0.857  10.337
  228    H    CYS  33           H        CYS  33  -3.431   0.547   3.354
  229    HA   CYS  33           HA       CYS  33  -2.937  -0.917   0.822
  230   1HB   CYS  33          2HB       CYS  33  -1.721   1.427   2.195
  231   2HB   CYS  33          1HB       CYS  33  -0.631   0.419   1.241
  232    H    THR  34           H        THR  34  -2.462  -3.034   1.291
  233    HA   THR  34           HA       THR  34  -0.670  -3.683   3.547
  234    HB   THR  34           HB       THR  34  -2.056  -5.472   1.523
  235    HG1  THR  34           HG1      THR  34  -3.689  -5.194   2.790
  236   1HG2  THR  34          1HG2      THR  34  -1.523  -7.231   3.289
  237   2HG2  THR  34          2HG2      THR  34  -0.416  -6.054   3.996
  238   3HG2  THR  34          3HG2      THR  34  -0.146  -6.644   2.356
  239    H    CYS  35           H        CYS  35   1.470  -3.418   3.153
  240    HA   CYS  35           HA       CYS  35   2.520  -3.931   0.416
  241   1HB   CYS  35          2HB       CYS  35   4.147  -2.749   2.651
  242   2HB   CYS  35          1HB       CYS  35   4.312  -2.506   0.913
  243    H    TYR  36           H        TYR  36   4.313  -5.334   0.104
  244    HA   TYR  36           HA       TYR  36   4.762  -7.257   2.349
  245   1HB   TYR  36          2HB       TYR  36   5.583  -8.744   0.327
  246   2HB   TYR  36          1HB       TYR  36   3.865  -8.608   0.687
  247    HD1  TYR  36           HD1      TYR  36   2.358  -7.416  -0.783
  248    HD2  TYR  36           HD2      TYR  36   6.582  -7.485  -1.566
  249    HE1  TYR  36           HE1      TYR  36   1.951  -6.506  -3.052
  250    HE2  TYR  36           HE2      TYR  36   6.173  -6.574  -3.836
  251    HH   TYR  36           HH       TYR  36   3.384  -6.656  -5.377
  252    H    ARG  37           H        ARG  37   6.941  -8.184   2.512
  253    HA   ARG  37           HA       ARG  37   9.004  -6.180   2.385
  254   1HB   ARG  37          2HB       ARG  37   8.922  -9.110   3.046
  255   2HB   ARG  37          1HB       ARG  37  10.481  -8.310   2.837
  256   1HG   ARG  37          2HG       ARG  37  10.099  -6.826   4.631
  257   2HG   ARG  37          1HG       ARG  37   8.360  -7.125   4.624
  258   1HD   ARG  37          2HD       ARG  37   9.939  -9.562   5.048
  259   2HD   ARG  37          1HD       ARG  37  10.186  -8.351   6.307
  260    HE   ARG  37           HE       ARG  37   7.481  -9.398   5.555
  261   1HH1  ARG  37          1HH2      ARG  37   7.545  -6.919   7.209
  262   2HH1  ARG  37          2HH2      ARG  37   7.484  -7.543   8.824
  263   1HH2  ARG  37          2HH1      ARG  37   8.387 -10.768   7.885
  264   2HH2  ARG  37          1HH1      ARG  37   7.964  -9.734   9.208
  265    H    CYS  38           H        CYS  38  10.987  -6.283   1.152
  266    HA   CYS  38           HA       CYS  38  10.547  -7.301  -1.606
  267   1HB   CYS  38          2HB       CYS  38  11.315  -4.868  -0.959
  268   2HB   CYS  38          1HB       CYS  38  12.902  -5.619  -0.800
  269    H    GLY  39           HN       GLY  39  11.617  -9.085  -2.306
  270   1HA   GLY  39          2HA       GLY  39  14.050  -9.963  -0.801
  271   2HA   GLY  39          1HA       GLY  39  12.819 -11.112  -1.326
  Start of MODEL    8
    1   1H    GLY   1          1H        GLY   1  -8.481   4.434   3.334
    2   2H    GLY   1          2H        GLY   1  -7.358   3.420   2.558
    3   3H    GLY   1          3H        GLY   1  -8.264   4.539   1.654
    4   1HA   GLY   1          2HA       GLY   1  -7.109   6.372   2.508
    5   2HA   GLY   1          1HA       GLY   1  -6.410   5.394   3.798
    6    H    PHE   2           H        PHE   2  -4.593   6.759   2.435
    7    HA   PHE   2           HA       PHE   2  -2.624   6.581   1.183
    8   1HB   PHE   2          2HB       PHE   2  -3.154   3.599   1.188
    9   2HB   PHE   2          1HB       PHE   2  -1.597   4.412   1.053
   10    HD1  PHE   2           HD1      PHE   2  -3.763   2.770   3.277
   11    HD2  PHE   2           HD2      PHE   2  -1.096   6.131   3.059
   12    HE1  PHE   2           HE1      PHE   2  -3.551   2.763   5.747
   13    HE2  PHE   2           HE2      PHE   2  -0.883   6.122   5.530
   14    HZ   PHE   2           HZ       PHE   2  -2.111   4.437   6.874
   15    H    GLY   3           H        GLY   3  -5.260   6.803  -0.208
   16   1HA   GLY   3          2HA       GLY   3  -5.931   6.977  -2.440
   17   2HA   GLY   3          1HA       GLY   3  -4.317   6.451  -2.911
   18    H    CYS   4           H        CYS   4  -6.902   4.824  -1.027
   19    HA   CYS   4           HA       CYS   4  -6.578   2.469  -2.826
   20   1HB   CYS   4          2HB       CYS   4  -7.505   2.813   0.013
   21   2HB   CYS   4          1HB       CYS   4  -8.028   1.403  -0.907
   22    HA   PRO   5           HA       PRO   5  -7.825   0.564  -2.768
   23   1HB   PRO   5          2HB       PRO   5  -9.084  -0.746  -4.827
   24   2HB   PRO   5          1HB       PRO   5  -9.718  -0.675  -3.175
   25   1HG   PRO   5          2HG       PRO   5 -10.665   0.756  -5.605
   26   2HG   PRO   5          1HG       PRO   5 -11.556   0.330  -4.134
   27   1HD   PRO   5          2HD       PRO   5 -10.494   2.889  -4.783
   28   2HD   PRO   5          1HD       PRO   5 -11.172   2.389  -3.219
   29    H    ASN   6           H        ASN   6  -7.445   3.058  -4.784
   30    HA   ASN   6           HA       ASN   6  -6.483   2.101  -7.260
   31   1HB   ASN   6          2HB       ASN   6  -6.784   4.539  -6.399
   32   2HB   ASN   6          1HB       ASN   6  -5.140   4.364  -5.789
   33   1HD2  ASN   6          1HD2      ASN   6  -6.980   5.116  -8.585
   34   2HD2  ASN   6          2HD2      ASN   6  -5.711   5.058  -9.711
   35    H    ASN   7           H        ASN   7  -4.815   0.759  -7.718
   36    HA   ASN   7           HA       ASN   7  -2.942  -0.096  -5.664
   37   1HB   ASN   7          2HB       ASN   7  -3.185  -0.681  -8.621
   38   2HB   ASN   7          1HB       ASN   7  -1.882  -1.340  -7.633
   39   1HD2  ASN   7          1HD2      ASN   7  -5.122  -1.867  -8.616
   40   2HD2  ASN   7          2HD2      ASN   7  -5.514  -3.067  -7.483
   41    H    TYR   8           H        TYR   8  -2.855   2.196  -8.344
   42    HA   TYR   8           HA       TYR   8  -0.003   2.562  -8.414
   43   1HB   TYR   8          2HB       TYR   8  -1.864   3.372 -10.083
   44   2HB   TYR   8          1HB       TYR   8  -1.947   4.780  -9.025
   45    HD1  TYR   8           HD1      TYR   8   0.299   2.773 -11.201
   46    HD2  TYR   8           HD2      TYR   8  -0.212   6.432  -9.007
   47    HE1  TYR   8           HE1      TYR   8   2.318   3.709 -12.293
   48    HE2  TYR   8           HE2      TYR   8   1.808   7.368 -10.100
   49    HH   TYR   8           HH       TYR   8   4.065   5.973 -11.291
   50    H    GLN   9           H        GLN   9  -2.619   4.339  -6.737
   51    HA   GLN   9           HA       GLN   9  -0.864   6.156  -5.354
   52   1HB   GLN   9          2HB       GLN   9  -3.642   5.205  -4.589
   53   2HB   GLN   9          1HB       GLN   9  -2.819   6.613  -3.921
   54   1HG   GLN   9          2HG       GLN   9  -2.732   7.634  -6.165
   55   2HG   GLN   9          1HG       GLN   9  -3.557   6.228  -6.838
   56   1HE2  GLN   9          1HE2      GLN   9  -4.004   9.027  -4.668
   57   2HE2  GLN   9          2HE2      GLN   9  -5.700   8.977  -4.690
   58    H    CYS  10           H        CYS  10  -2.379   3.060  -4.458
   59    HA   CYS  10           HA       CYS  10  -1.389   2.889  -1.791
   60   1HB   CYS  10          2HB       CYS  10  -3.107   1.370  -2.924
   61   2HB   CYS  10          1HB       CYS  10  -1.742   0.534  -3.661
   62    H    HIS  11           H        HIS  11   0.006   1.843  -4.896
   63    HA   HIS  11           HA       HIS  11   2.351   0.596  -3.878
   64   1HB   HIS  11          2HB       HIS  11   1.505   0.533  -6.275
   65   2HB   HIS  11          1HB       HIS  11   2.173   2.154  -6.471
   66    HD1  HIS  11           HD1      HIS  11   3.289  -1.365  -5.558
   67    HD2  HIS  11           HD2      HIS  11   4.913   2.204  -6.973
   68    HE1  HIS  11           HE1      HIS  11   5.706  -1.857  -6.137
   69    H    ARG  12           H        ARG  12   1.695   3.994  -4.735
   70    HA   ARG  12           HA       ARG  12   4.328   5.008  -4.329
   71   1HB   ARG  12          2HB       ARG  12   2.159   6.161  -5.270
   72   2HB   ARG  12          1HB       ARG  12   1.888   6.605  -3.585
   73   1HG   ARG  12          2HG       ARG  12   4.613   7.076  -4.719
   74   2HG   ARG  12          1HG       ARG  12   3.315   8.159  -5.225
   75   1HD   ARG  12          2HD       ARG  12   2.781   8.273  -2.655
   76   2HD   ARG  12          1HD       ARG  12   4.445   7.717  -2.474
   77    HE   ARG  12           HE       ARG  12   3.671  10.262  -3.844
   78   1HH1  ARG  12          1HH2      ARG  12   4.807  10.594  -1.175
   79   2HH1  ARG  12          2HH2      ARG  12   6.506  10.755  -1.471
   80   1HH2  ARG  12          2HH1      ARG  12   6.333   9.443  -4.687
   81   2HH2  ARG  12          1HH1      ARG  12   7.374  10.099  -3.468
   82    H    HIS  13           H        HIS  13   1.606   4.571  -2.066
   83    HA   HIS  13           HA       HIS  13   2.923   5.691   0.229
   84   1HB   HIS  13          2HB       HIS  13   0.510   5.413   0.238
   85   2HB   HIS  13          1HB       HIS  13   0.666   3.675  -0.010
   86    HD1  HIS  13           HD1      HIS  13   2.079   6.171   2.524
   87    HD2  HIS  13           HD2      HIS  13   0.369   2.373   2.394
   88    HE1  HIS  13           HE1      HIS  13   2.001   5.338   4.915
   89    H    CYS  14           H        CYS  14   2.596   2.322  -0.939
   90    HA   CYS  14           HA       CYS  14   4.105   1.149   1.209
   91   1HB   CYS  14          2HB       CYS  14   3.466   0.216  -1.596
   92   2HB   CYS  14          1HB       CYS  14   4.400  -0.764  -0.466
   93    H    LYS  15           H        LYS  15   5.026   2.518  -1.927
   94    HA   LYS  15           HA       LYS  15   7.750   1.613  -1.918
   95   1HB   LYS  15          2HB       LYS  15   6.231   3.766  -3.350
   96   2HB   LYS  15          1HB       LYS  15   7.993   3.776  -3.420
   97   1HG   LYS  15          2HG       LYS  15   7.423   1.124  -3.886
   98   2HG   LYS  15          1HG       LYS  15   6.077   1.935  -4.688
   99   1HD   LYS  15          2HD       LYS  15   7.409   2.575  -6.384
  100   2HD   LYS  15          1HD       LYS  15   8.529   3.344  -5.261
  101   1HE   LYS  15          2HE       LYS  15   8.974   0.599  -4.920
  102   2HE   LYS  15          1HE       LYS  15   8.785   0.804  -6.661
  103   1HZ   LYS  15          1HZ       LYS  15  11.090   1.112  -5.862
  104   2HZ   LYS  15          2HZ       LYS  15  10.579   2.465  -4.972
  105   3HZ   LYS  15          3HZ       LYS  15  10.476   2.472  -6.668
  106    H    SER  16           H        SER  16   6.201   4.573  -0.641
  107    HA   SER  16           HA       SER  16   8.635   5.894   0.098
  108   1HB   SER  16          2HB       SER  16   7.253   7.327   1.480
  109   2HB   SER  16          1HB       SER  16   6.382   6.997  -0.012
  110    HG   SER  16           HG       SER  16   5.872   6.181   2.595
  111    H    ILE  17           H        ILE  17   6.774   3.335   1.622
  112    HA   ILE  17           HA       ILE  17   8.161   3.536   4.190
  113    HB   ILE  17           HB       ILE  17   6.487   1.268   3.052
  114   1HG1  ILE  17          2HG1      ILE  17   5.510   3.180   5.143
  115   2HG1  ILE  17          1HG1      ILE  17   5.514   3.718   3.463
  116   1HG2  ILE  17          1HG2      ILE  17   7.875   0.505   4.892
  117   2HG2  ILE  17          2HG2      ILE  17   6.225   0.692   5.486
  118   3HG2  ILE  17          3HG2      ILE  17   7.440   1.915   5.859
  119   1HD1  ILE  17          1HD1      ILE  17   3.972   1.470   4.724
  120   2HD1  ILE  17          2HD1      ILE  17   4.377   1.393   3.009
  121   3HD1  ILE  17          3HD1      ILE  17   3.408   2.729   3.627
  122    HA   PRO  18           HA       PRO  18  11.696   1.287   2.717
  123   1HB   PRO  18          2HB       PRO  18  12.954   1.114   5.156
  124   2HB   PRO  18          1HB       PRO  18  12.951   2.573   4.151
  125   1HG   PRO  18          2HG       PRO  18  11.414   2.008   6.645
  126   2HG   PRO  18          1HG       PRO  18  11.947   3.563   5.982
  127   1HD   PRO  18          2HD       PRO  18   9.330   2.506   5.815
  128   2HD   PRO  18          1HD       PRO  18   9.964   3.872   4.874
  129    H    GLY  19           H        GLY  19  12.411  -0.883   2.733
  130   1HA   GLY  19          2HA       GLY  19  12.558  -3.135   3.530
  131   2HA   GLY  19          1HA       GLY  19  11.375  -2.748   4.778
  132    H    ARG  20           H        ARG  20   9.988  -1.470   2.097
  133    HA   ARG  20           HA       ARG  20   8.655  -4.047   1.367
  134   1HB   ARG  20          2HB       ARG  20   7.243  -1.401   1.154
  135   2HB   ARG  20          1HB       ARG  20   6.555  -3.012   1.330
  136   1HG   ARG  20          2HG       ARG  20   8.261  -1.963   3.557
  137   2HG   ARG  20          1HG       ARG  20   6.630  -1.319   3.382
  138   1HD   ARG  20          2HD       ARG  20   5.950  -3.848   3.177
  139   2HD   ARG  20          1HD       ARG  20   7.495  -4.134   3.976
  140    HE   ARG  20           HE       ARG  20   6.634  -2.610   5.818
  141   1HH1  ARG  20          1HH2      ARG  20   5.148  -5.290   5.610
  142   2HH1  ARG  20          2HH2      ARG  20   3.507  -4.767   5.781
  143   1HH2  ARG  20          2HH1      ARG  20   4.237  -1.418   5.186
  144   2HH2  ARG  20          1HH1      ARG  20   2.991  -2.562   5.553
  145    H    CYS  21           H        CYS  21   8.206  -4.359  -0.841
  146    HA   CYS  21           HA       CYS  21   9.640  -2.506  -2.677
  147   1HB   CYS  21          2HB       CYS  21   9.317  -5.362  -2.564
  148   2HB   CYS  21          1HB       CYS  21   8.659  -4.770  -4.089
  149    H    GLY  22           H        GLY  22   6.503  -4.191  -2.367
  150   1HA   GLY  22          2HA       GLY  22   5.241  -1.942  -3.837
  151   2HA   GLY  22          1HA       GLY  22   4.957  -3.579  -4.419
  152    H    GLY  23           H        GLY  23   2.656  -2.707  -3.866
  153   1HA   GLY  23          2HA       GLY  23   1.781  -4.048  -1.456
  154   2HA   GLY  23          1HA       GLY  23   1.692  -2.299  -1.275
  155    H    TYR  24           H        TYR  24  -0.619  -3.741  -1.123
  156    HA   TYR  24           HA       TYR  24  -2.083  -2.808  -3.530
  157   1HB   TYR  24          2HB       TYR  24  -3.274  -4.910  -3.788
  158   2HB   TYR  24          1HB       TYR  24  -1.543  -5.241  -3.856
  159    HD1  TYR  24           HD1      TYR  24  -0.374  -6.228  -1.880
  160    HD2  TYR  24           HD2      TYR  24  -4.639  -5.729  -1.981
  161    HE1  TYR  24           HE1      TYR  24  -0.603  -7.792   0.030
  162    HE2  TYR  24           HE2      TYR  24  -4.868  -7.293  -0.073
  163    HH   TYR  24           HH       TYR  24  -2.716  -8.022   1.973
  164    H    CYS  25           H        CYS  25  -4.455  -2.691  -3.105
  165    HA   CYS  25           HA       CYS  25  -4.963  -1.906  -0.300
  166   1HB   CYS  25          2HB       CYS  25  -6.656  -1.653  -2.806
  167   2HB   CYS  25          1HB       CYS  25  -7.127  -1.053  -1.216
  168    H    GLY  26           H        GLY  26  -5.913  -3.307   1.104
  169   1HA   GLY  26          2HA       GLY  26  -8.149  -4.974   0.463
  170   2HA   GLY  26          1HA       GLY  26  -6.686  -5.953   0.418
  171    H    GLY  27           H        GLY  27  -9.096  -5.648   2.366
  172   1HA   GLY  27          2HA       GLY  27  -8.512  -6.675   4.668
  173   2HA   GLY  27          1HA       GLY  27  -7.522  -5.231   4.873
  174    H    TRP  28           H        TRP  28  -8.541  -3.238   5.270
  175    HA   TRP  28           HA       TRP  28 -11.254  -3.428   6.371
  176   1HB   TRP  28          2HB       TRP  28  -9.413  -2.109   7.470
  177   2HB   TRP  28          1HB       TRP  28  -9.472  -0.986   6.113
  178    HD1  TRP  28           HD1      TRP  28 -11.685  -2.320   8.968
  179    HE1  TRP  28           HE1      TRP  28 -13.467  -0.541   9.513
  180    HE3  TRP  28           HE3      TRP  28 -10.729   1.057   5.258
  181    HZ2  TRP  28           HZ2      TRP  28 -14.367   1.980   8.513
  182    HZ3  TRP  28           HZ3      TRP  28 -12.061   3.138   5.081
  183    HH2  TRP  28           HH2      TRP  28 -13.880   3.603   6.700
  184    H    HIS  29           H        HIS  29 -12.609  -3.724   4.569
  185    HA   HIS  29           HA       HIS  29 -13.903  -3.106   2.720
  186   1HB   HIS  29          2HB       HIS  29 -13.096  -0.292   3.524
  187   2HB   HIS  29          1HB       HIS  29 -14.510  -0.751   2.582
  188    HD1  HIS  29           HD1      HIS  29 -14.492   0.691   5.468
  189    HD2  HIS  29           HD2      HIS  29 -15.292  -3.328   4.715
  190    HE1  HIS  29           HE1      HIS  29 -15.816  -0.160   7.453
  191    H    ARG  30           H        ARG  30 -11.014  -3.616   2.362
  192    HA   ARG  30           HA       ARG  30  -9.370  -3.454   0.718
  193   1HB   ARG  30          2HB       ARG  30 -11.369  -4.059  -0.696
  194   2HB   ARG  30          1HB       ARG  30 -11.601  -2.337  -1.004
  195   1HG   ARG  30          2HG       ARG  30  -9.751  -2.186  -2.352
  196   2HG   ARG  30          1HG       ARG  30  -8.863  -3.407  -1.447
  197   1HD   ARG  30          2HD       ARG  30 -10.788  -4.980  -2.449
  198   2HD   ARG  30          1HD       ARG  30 -10.781  -3.738  -3.702
  199    HE   ARG  30           HE       ARG  30  -8.130  -4.801  -2.967
  200   1HH1  ARG  30          1HH2      ARG  30  -9.125  -3.509  -5.605
  201   2HH1  ARG  30          2HH2      ARG  30  -9.077  -4.882  -6.660
  202   1HH2  ARG  30          2HH1      ARG  30  -8.826  -7.191  -4.071
  203   2HH2  ARG  30          1HH1      ARG  30  -8.904  -6.974  -5.788
  204    H    LEU  31           H        LEU  31  -9.801  -1.184   2.527
  205    HA   LEU  31           HA       LEU  31  -8.896   1.069   0.789
  206   1HB   LEU  31          2HB       LEU  31 -10.259   1.062   3.492
  207   2HB   LEU  31          1HB       LEU  31  -9.557   2.508   2.767
  208    HG   LEU  31           HG       LEU  31 -11.544   0.808   1.258
  209   1HD1  LEU  31          1HD1      LEU  31 -13.322   2.294   2.039
  210   2HD1  LEU  31          2HD1      LEU  31 -12.172   3.180   3.042
  211   3HD1  LEU  31          3HD1      LEU  31 -12.563   1.502   3.420
  212   1HD2  LEU  31          1HD2      LEU  31 -10.876   3.764   1.100
  213   2HD2  LEU  31          2HD2      LEU  31 -11.857   2.835  -0.033
  214   3HD2  LEU  31          3HD2      LEU  31 -10.125   2.532   0.084
  215    H    ARG  32           H        ARG  32  -7.924  -1.125   3.287
  216    HA   ARG  32           HA       ARG  32  -5.753   0.563   4.303
  217   1HB   ARG  32          2HB       ARG  32  -7.077  -1.467   5.445
  218   2HB   ARG  32          1HB       ARG  32  -5.766  -2.397   4.719
  219   1HG   ARG  32          2HG       ARG  32  -4.162  -0.719   5.780
  220   2HG   ARG  32          1HG       ARG  32  -5.544  -0.115   6.694
  221   1HD   ARG  32          2HD       ARG  32  -5.305  -1.787   8.176
  222   2HD   ARG  32          1HD       ARG  32  -5.536  -2.970   6.888
  223    HE   ARG  32           HE       ARG  32  -2.928  -2.024   7.926
  224   1HH1  ARG  32          1HH2      ARG  32  -3.743  -4.926   7.697
  225   2HH1  ARG  32          2HH2      ARG  32  -2.873  -5.424   6.284
  226   1HH2  ARG  32          2HH1      ARG  32  -2.226  -2.187   5.214
  227   2HH2  ARG  32          1HH1      ARG  32  -2.020  -3.874   4.878
  228    H    CYS  33           H        CYS  33  -3.616   0.480   3.631
  229    HA   CYS  33           HA       CYS  33  -3.088  -0.983   1.112
  230   1HB   CYS  33          2HB       CYS  33  -1.917   1.370   2.500
  231   2HB   CYS  33          1HB       CYS  33  -0.801   0.387   1.553
  232    H    THR  34           H        THR  34  -2.270  -2.994   1.274
  233    HA   THR  34           HA       THR  34  -0.577  -3.696   3.616
  234    HB   THR  34           HB       THR  34  -1.928  -5.456   1.544
  235    HG1  THR  34           HG1      THR  34  -3.559  -5.185   2.818
  236   1HG2  THR  34          1HG2      THR  34   0.018  -5.980   3.727
  237   2HG2  THR  34          2HG2      THR  34  -0.263  -6.872   2.233
  238   3HG2  THR  34          3HG2      THR  34  -1.340  -7.097   3.611
  239    H    CYS  35           H        CYS  35   1.557  -3.382   3.238
  240    HA   CYS  35           HA       CYS  35   2.620  -3.751   0.484
  241   1HB   CYS  35          2HB       CYS  35   4.261  -2.731   2.788
  242   2HB   CYS  35          1HB       CYS  35   4.407  -2.361   1.071
  243    H    TYR  36           H        TYR  36   4.231  -5.273   0.037
  244    HA   TYR  36           HA       TYR  36   4.682  -7.299   2.179
  245   1HB   TYR  36          2HB       TYR  36   5.569  -8.637   0.071
  246   2HB   TYR  36          1HB       TYR  36   3.845  -8.537   0.411
  247    HD1  TYR  36           HD1      TYR  36   2.358  -7.210  -0.977
  248    HD2  TYR  36           HD2      TYR  36   6.587  -7.290  -1.731
  249    HE1  TYR  36           HE1      TYR  36   1.985  -6.147  -3.186
  250    HE2  TYR  36           HE2      TYR  36   6.212  -6.227  -3.939
  251    HH   TYR  36           HH       TYR  36   3.457  -6.171  -5.511
  252    H    ARG  37           H        ARG  37   6.848  -8.293   2.296
  253    HA   ARG  37           HA       ARG  37   8.935  -6.261   2.295
  254   1HB   ARG  37          2HB       ARG  37   9.049  -9.242   2.857
  255   2HB   ARG  37          1HB       ARG  37  10.370  -8.110   3.147
  256   1HG   ARG  37          2HG       ARG  37   7.912  -7.122   4.328
  257   2HG   ARG  37          1HG       ARG  37   8.272  -8.746   4.916
  258   1HD   ARG  37          2HD       ARG  37  10.541  -8.039   5.537
  259   2HD   ARG  37          1HD       ARG  37  10.223  -6.423   4.907
  260    HE   ARG  37           HE       ARG  37   9.287  -7.486   7.464
  261   1HH1  ARG  37          1HH2      ARG  37  10.017  -4.639   6.090
  262   2HH1  ARG  37          2HH2      ARG  37   8.577  -3.787   6.533
  263   1HH2  ARG  37          2HH1      ARG  37   6.879  -6.644   7.547
  264   2HH2  ARG  37          1HH1      ARG  37   6.800  -4.922   7.374
  265    H    CYS  38           H        CYS  38  10.809  -6.212   0.996
  266    HA   CYS  38           HA       CYS  38  10.509  -7.517  -1.645
  267   1HB   CYS  38          2HB       CYS  38  11.152  -5.006  -1.174
  268   2HB   CYS  38          1HB       CYS  38  12.772  -5.668  -0.952
  269    H    GLY  39           HN       GLY  39  11.608  -9.343  -2.123
  270   1HA   GLY  39          2HA       GLY  39  13.727 -10.286  -0.286
  271   2HA   GLY  39          1HA       GLY  39  12.948 -11.246  -1.545
  Start of MODEL    9
    1   1H    GLY   1          1H        GLY   1  -8.363   4.752   1.555
    2   2H    GLY   1          2H        GLY   1  -8.588   4.445   3.211
    3   3H    GLY   1          3H        GLY   1  -7.512   3.488   2.307
    4   1HA   GLY   1          2HA       GLY   1  -7.107   6.405   2.564
    5   2HA   GLY   1          1HA       GLY   1  -6.524   5.294   3.801
    6    H    PHE   2           H        PHE   2  -4.592   6.675   2.583
    7    HA   PHE   2           HA       PHE   2  -2.590   6.479   1.381
    8   1HB   PHE   2          2HB       PHE   2  -3.154   3.525   1.127
    9   2HB   PHE   2          1HB       PHE   2  -1.599   4.335   1.300
   10    HD1  PHE   2           HD1      PHE   2  -1.366   5.795   3.535
   11    HD2  PHE   2           HD2      PHE   2  -4.077   2.505   3.004
   12    HE1  PHE   2           HE1      PHE   2  -1.502   5.509   5.994
   13    HE2  PHE   2           HE2      PHE   2  -4.211   2.218   5.463
   14    HZ   PHE   2           HZ       PHE   2  -2.925   3.720   6.958
   15    H    GLY   3           H        GLY   3  -5.189   6.830  -0.086
   16   1HA   GLY   3          2HA       GLY   3  -5.771   7.114  -2.335
   17   2HA   GLY   3          1HA       GLY   3  -4.161   6.543  -2.771
   18    H    CYS   4           H        CYS   4  -6.761   4.888  -0.946
   19    HA   CYS   4           HA       CYS   4  -6.519   2.618  -2.859
   20   1HB   CYS   4          2HB       CYS   4  -7.397   2.860   0.005
   21   2HB   CYS   4          1HB       CYS   4  -7.976   1.506  -0.964
   22    HA   PRO   5           HA       PRO   5  -7.831   0.716  -2.796
   23   1HB   PRO   5          2HB       PRO   5  -9.148  -0.524  -4.860
   24   2HB   PRO   5          1HB       PRO   5  -9.761  -0.463  -3.199
   25   1HG   PRO   5          2HG       PRO   5 -10.694   1.034  -5.596
   26   2HG   PRO   5          1HG       PRO   5 -11.581   0.608  -4.124
   27   1HD   PRO   5          2HD       PRO   5 -10.458   3.149  -4.739
   28   2HD   PRO   5          1HD       PRO   5 -11.129   2.639  -3.175
   29    H    ASN   6           H        ASN   6  -7.399   3.230  -4.787
   30    HA   ASN   6           HA       ASN   6  -6.464   2.206  -7.269
   31   1HB   ASN   6          2HB       ASN   6  -6.814   4.662  -6.547
   32   2HB   ASN   6          1HB       ASN   6  -5.197   4.555  -5.853
   33   1HD2  ASN   6          1HD2      ASN   6  -6.952   5.006  -8.804
   34   2HD2  ASN   6          2HD2      ASN   6  -5.616   4.976  -9.850
   35    H    ASN   7           H        ASN   7  -4.699   0.993  -7.755
   36    HA   ASN   7           HA       ASN   7  -2.853   0.187  -5.642
   37   1HB   ASN   7          2HB       ASN   7  -3.044  -0.483  -8.585
   38   2HB   ASN   7          1HB       ASN   7  -1.771  -1.118  -7.542
   39   1HD2  ASN   7          1HD2      ASN   7  -4.886  -1.790  -8.682
   40   2HD2  ASN   7          2HD2      ASN   7  -5.359  -2.898  -7.487
   41    H    TYR   8           H        TYR   8  -2.801   2.509  -8.280
   42    HA   TYR   8           HA       TYR   8   0.057   2.844  -8.414
   43   1HB   TYR   8          2HB       TYR   8  -1.970   3.761  -9.931
   44   2HB   TYR   8          1HB       TYR   8  -1.741   5.177  -8.908
   45    HD1  TYR   8           HD1      TYR   8  -0.487   3.287 -11.701
   46    HD2  TYR   8           HD2      TYR   8   0.620   6.167  -8.712
   47    HE1  TYR   8           HE1      TYR   8   1.490   3.927 -13.052
   48    HE2  TYR   8           HE2      TYR   8   2.599   6.808 -10.063
   49    HH   TYR   8           HH       TYR   8   3.756   4.965 -12.619
   50    H    GLN   9           H        GLN   9  -2.504   4.675  -6.708
   51    HA   GLN   9           HA       GLN   9  -0.683   6.369  -5.252
   52   1HB   GLN   9          2HB       GLN   9  -3.529   5.546  -4.580
   53   2HB   GLN   9          1HB       GLN   9  -2.649   6.878  -3.834
   54   1HG   GLN   9          2HG       GLN   9  -2.928   6.782  -6.826
   55   2HG   GLN   9          1HG       GLN   9  -4.271   7.368  -5.845
   56   1HE2  GLN   9          1HE2      GLN   9  -3.823   9.280  -4.419
   57   2HE2  GLN   9          2HE2      GLN   9  -2.566  10.347  -4.826
   58    H    CYS  10           H        CYS  10  -2.284   3.277  -4.546
   59    HA   CYS  10           HA       CYS  10  -1.433   2.973  -1.841
   60   1HB   CYS  10          2HB       CYS  10  -3.117   1.541  -3.137
   61   2HB   CYS  10          1HB       CYS  10  -1.726   0.713  -3.835
   62    H    HIS  11           H        HIS  11   0.089   2.044  -4.922
   63    HA   HIS  11           HA       HIS  11   2.365   0.709  -3.861
   64   1HB   HIS  11          2HB       HIS  11   1.644   0.757  -6.287
   65   2HB   HIS  11          1HB       HIS  11   2.302   2.391  -6.382
   66    HD1  HIS  11           HD1      HIS  11   3.431  -1.145  -5.545
   67    HD2  HIS  11           HD2      HIS  11   5.045   2.483  -6.807
   68    HE1  HIS  11           HE1      HIS  11   5.872  -1.587  -6.056
   69    H    ARG  12           H        ARG  12   1.785   4.154  -4.561
   70    HA   ARG  12           HA       ARG  12   4.411   5.107  -3.982
   71   1HB   ARG  12          2HB       ARG  12   2.115   6.287  -4.846
   72   2HB   ARG  12          1HB       ARG  12   2.132   6.827  -3.167
   73   1HG   ARG  12          2HG       ARG  12   4.279   7.848  -3.415
   74   2HG   ARG  12          1HG       ARG  12   4.552   7.059  -4.969
   75   1HD   ARG  12          2HD       ARG  12   2.170   8.858  -4.643
   76   2HD   ARG  12          1HD       ARG  12   3.760   9.575  -4.893
   77    HE   ARG  12           HE       ARG  12   2.179   8.256  -6.918
   78   1HH1  ARG  12          2HH1      ARG  12   4.357  10.346  -7.322
   79   2HH1  ARG  12          1HH1      ARG  12   5.556   9.428  -8.170
   80   1HH2  ARG  12          1HH2      ARG  12   4.159   6.353  -7.330
   81   2HH2  ARG  12          2HH2      ARG  12   5.444   7.152  -8.175
   82    H    HIS  13           H        HIS  13   1.559   4.640  -1.880
   83    HA   HIS  13           HA       HIS  13   2.768   5.604   0.529
   84   1HB   HIS  13          2HB       HIS  13   0.348   5.291   0.375
   85   2HB   HIS  13          1HB       HIS  13   0.559   3.560   0.117
   86    HD1  HIS  13           HD1      HIS  13   1.691   6.099   2.748
   87    HD2  HIS  13           HD2      HIS  13   0.289   2.184   2.486
   88    HE1  HIS  13           HE1      HIS  13   1.542   5.231   5.123
   89    H    CYS  14           H        CYS  14   2.531   2.317  -0.857
   90    HA   CYS  14           HA       CYS  14   3.929   1.005   1.279
   91   1HB   CYS  14          2HB       CYS  14   3.419   0.289  -1.610
   92   2HB   CYS  14          1HB       CYS  14   4.359  -0.761  -0.548
   93    H    LYS  15           H        LYS  15   5.024   2.495  -1.757
   94    HA   LYS  15           HA       LYS  15   7.765   1.665  -1.557
   95   1HB   LYS  15          2HB       LYS  15   6.301   3.807  -3.067
   96   2HB   LYS  15          1HB       LYS  15   8.064   3.841  -3.018
   97   1HG   LYS  15          2HG       LYS  15   7.648   1.212  -3.576
   98   2HG   LYS  15          1HG       LYS  15   6.247   1.928  -4.371
   99   1HD   LYS  15          2HD       LYS  15   7.512   2.886  -5.992
  100   2HD   LYS  15          1HD       LYS  15   8.744   3.408  -4.844
  101   1HE   LYS  15          2HE       LYS  15   8.477   0.502  -5.605
  102   2HE   LYS  15          1HE       LYS  15   9.403   1.617  -6.607
  103   1HZ   LYS  15          1HZ       LYS  15  10.842   0.562  -5.015
  104   2HZ   LYS  15          2HZ       LYS  15   9.849   1.049  -3.724
  105   3HZ   LYS  15          3HZ       LYS  15  10.703   2.209  -4.626
  106    H    SER  16           H        SER  16   6.020   4.540  -0.359
  107    HA   SER  16           HA       SER  16   8.295   5.987   0.567
  108   1HB   SER  16          2HB       SER  16   6.765   7.294   1.862
  109   2HB   SER  16          1HB       SER  16   5.893   6.831   0.406
  110    HG   SER  16           HG       SER  16   4.862   5.219   1.585
  111    H    ILE  17           H        ILE  17   6.573   3.233   1.913
  112    HA   ILE  17           HA       ILE  17   7.899   3.416   4.523
  113    HB   ILE  17           HB       ILE  17   6.300   1.146   3.290
  114   1HG1  ILE  17          2HG1      ILE  17   5.239   2.925   5.448
  115   2HG1  ILE  17          1HG1      ILE  17   5.278   3.569   3.807
  116   1HG2  ILE  17          1HG2      ILE  17   6.019   0.526   5.737
  117   2HG2  ILE  17          2HG2      ILE  17   7.278   1.704   6.102
  118   3HG2  ILE  17          3HG2      ILE  17   7.646   0.304   5.096
  119   1HD1  ILE  17          1HD1      ILE  17   3.182   2.534   3.871
  120   2HD1  ILE  17          2HD1      ILE  17   3.762   1.200   4.867
  121   3HD1  ILE  17          3HD1      ILE  17   4.190   1.276   3.159
  122    HA   PRO  18           HA       PRO  18  11.514   1.324   2.999
  123   1HB   PRO  18          2HB       PRO  18  12.782   1.166   5.435
  124   2HB   PRO  18          1HB       PRO  18  12.725   2.638   4.450
  125   1HG   PRO  18          2HG       PRO  18  11.215   1.985   6.938
  126   2HG   PRO  18          1HG       PRO  18  11.688   3.567   6.294
  127   1HD   PRO  18          2HD       PRO  18   9.112   2.412   6.118
  128   2HD   PRO  18          1HD       PRO  18   9.690   3.817   5.197
  129    H    GLY  19           H        GLY  19  12.121  -0.841   2.849
  130   1HA   GLY  19          2HA       GLY  19  12.413  -3.081   3.745
  131   2HA   GLY  19          1HA       GLY  19  11.132  -2.751   4.908
  132    H    ARG  20           H        ARG  20   9.648  -1.482   2.420
  133    HA   ARG  20           HA       ARG  20   8.584  -4.096   1.436
  134   1HB   ARG  20          2HB       ARG  20   7.044  -1.513   1.304
  135   2HB   ARG  20          1HB       ARG  20   6.430  -3.164   1.312
  136   1HG   ARG  20          2HG       ARG  20   7.941  -2.123   3.700
  137   2HG   ARG  20          1HG       ARG  20   6.241  -1.714   3.488
  138   1HD   ARG  20          2HD       ARG  20   6.440  -4.485   2.967
  139   2HD   ARG  20          1HD       ARG  20   7.404  -4.195   4.412
  140    HE   ARG  20           HE       ARG  20   4.629  -4.342   4.477
  141   1HH1  ARG  20          2HH1      ARG  20   6.118  -3.739   6.962
  142   2HH1  ARG  20          1HH1      ARG  20   5.566  -2.149   7.366
  143   1HH2  ARG  20          1HH2      ARG  20   4.297  -1.496   4.199
  144   2HH2  ARG  20          2HH2      ARG  20   4.538  -0.871   5.794
  145    H    CYS  21           H        CYS  21   8.182  -4.331  -0.792
  146    HA   CYS  21           HA       CYS  21   9.632  -2.390  -2.521
  147   1HB   CYS  21          2HB       CYS  21   9.381  -5.240  -2.507
  148   2HB   CYS  21          1HB       CYS  21   8.671  -4.639  -4.005
  149    H    GLY  22           H        GLY  22   6.555  -4.229  -2.530
  150   1HA   GLY  22          2HA       GLY  22   5.277  -1.904  -3.888
  151   2HA   GLY  22          1HA       GLY  22   5.026  -3.531  -4.515
  152    H    GLY  23           H        GLY  23   2.702  -2.689  -3.987
  153   1HA   GLY  23          2HA       GLY  23   1.780  -4.117  -1.652
  154   2HA   GLY  23          1HA       GLY  23   1.704  -2.378  -1.386
  155    H    TYR  24           H        TYR  24  -0.623  -3.814  -1.348
  156    HA   TYR  24           HA       TYR  24  -2.022  -2.761  -3.749
  157   1HB   TYR  24          2HB       TYR  24  -3.303  -4.834  -4.016
  158   2HB   TYR  24          1HB       TYR  24  -1.581  -5.179  -4.161
  159    HD1  TYR  24           HD1      TYR  24  -4.610  -5.704  -2.188
  160    HD2  TYR  24           HD2      TYR  24  -0.346  -6.235  -2.264
  161    HE1  TYR  24           HE1      TYR  24  -4.778  -7.332  -0.325
  162    HE2  TYR  24           HE2      TYR  24  -0.516  -7.862  -0.402
  163    HH   TYR  24           HH       TYR  24  -2.758  -8.121   1.617
  164    H    CYS  25           H        CYS  25  -4.387  -2.555  -3.361
  165    HA   CYS  25           HA       CYS  25  -4.911  -1.772  -0.568
  166   1HB   CYS  25          2HB       CYS  25  -6.541  -1.515  -3.110
  167   2HB   CYS  25          1HB       CYS  25  -7.105  -0.973  -1.529
  168    H    GLY  26           H        GLY  26  -5.631  -3.307   0.817
  169   1HA   GLY  26          2HA       GLY  26  -7.988  -4.862   0.342
  170   2HA   GLY  26          1HA       GLY  26  -6.571  -5.881   0.095
  171    H    GLY  27           H        GLY  27  -8.743  -5.605   2.305
  172   1HA   GLY  27          2HA       GLY  27  -7.868  -6.748   4.485
  173   2HA   GLY  27          1HA       GLY  27  -6.930  -5.264   4.650
  174    H    TRP  28           H        TRP  28  -8.048  -3.287   5.069
  175    HA   TRP  28           HA       TRP  28 -10.616  -3.669   6.463
  176   1HB   TRP  28          2HB       TRP  28  -8.768  -2.299   7.460
  177   2HB   TRP  28          1HB       TRP  28  -8.964  -1.144   6.143
  178    HD1  TRP  28           HD1      TRP  28 -10.897  -2.616   9.128
  179    HE1  TRP  28           HE1      TRP  28 -12.709  -0.928   9.838
  180    HE3  TRP  28           HE3      TRP  28 -10.382   0.849   5.412
  181    HZ2  TRP  28           HZ2      TRP  28 -13.795   1.563   8.952
  182    HZ3  TRP  28           HZ3      TRP  28 -11.818   2.869   5.371
  183    HH2  TRP  28           HH2      TRP  28 -13.523   3.228   7.133
  184    H    HIS  29           H        HIS  29 -12.118  -3.970   4.797
  185    HA   HIS  29           HA       HIS  29 -13.614  -3.362   3.109
  186   1HB   HIS  29          2HB       HIS  29 -12.855  -0.548   3.958
  187   2HB   HIS  29          1HB       HIS  29 -14.318  -1.019   3.099
  188    HD1  HIS  29           HD1      HIS  29 -14.182   0.290   6.031
  189    HD2  HIS  29           HD2      HIS  29 -14.792  -3.740   5.166
  190    HE1  HIS  29           HE1      HIS  29 -15.302  -0.719   8.067
  191    H    ARG  30           H        ARG  30 -10.756  -3.718   2.412
  192    HA   ARG  30           HA       ARG  30  -9.355  -3.455   0.554
  193   1HB   ARG  30          2HB       ARG  30 -11.613  -3.953  -0.555
  194   2HB   ARG  30          1HB       ARG  30 -11.747  -2.215  -0.820
  195   1HG   ARG  30          2HG       ARG  30  -9.800  -2.175  -2.204
  196   2HG   ARG  30          1HG       ARG  30  -9.333  -3.804  -1.715
  197   1HD   ARG  30          2HD       ARG  30 -11.391  -4.693  -2.790
  198   2HD   ARG  30          1HD       ARG  30 -11.791  -3.063  -3.330
  199    HE   ARG  30           HE       ARG  30  -9.335  -3.328  -4.411
  200   1HH1  ARG  30          2HH1      ARG  30  -9.457  -6.296  -4.092
  201   2HH1  ARG  30          1HH1      ARG  30 -10.167  -6.802  -5.587
  202   1HH2  ARG  30          1HH2      ARG  30 -11.354  -3.635  -6.394
  203   2HH2  ARG  30          2HH2      ARG  30 -11.247  -5.289  -6.897
  204    H    LEU  31           H        LEU  31  -9.729  -1.212   2.539
  205    HA   LEU  31           HA       LEU  31  -8.967   1.086   0.790
  206   1HB   LEU  31          2HB       LEU  31 -10.225   1.003   3.539
  207   2HB   LEU  31          1HB       LEU  31  -9.573   2.478   2.827
  208    HG   LEU  31           HG       LEU  31 -11.624   0.763   1.408
  209   1HD1  LEU  31          1HD1      LEU  31 -12.543   1.547   3.573
  210   2HD1  LEU  31          2HD1      LEU  31 -13.323   2.345   2.208
  211   3HD1  LEU  31          3HD1      LEU  31 -12.102   3.200   3.150
  212   1HD2  LEU  31          1HD2      LEU  31 -12.006   2.890   0.169
  213   2HD2  LEU  31          2HD2      LEU  31 -10.346   2.321   0.003
  214   3HD2  LEU  31          3HD2      LEU  31 -10.718   3.647   1.105
  215    H    ARG  32           H        ARG  32  -7.692  -1.172   3.016
  216    HA   ARG  32           HA       ARG  32  -5.595   0.661   4.009
  217   1HB   ARG  32          2HB       ARG  32  -6.700  -1.186   5.419
  218   2HB   ARG  32          1HB       ARG  32  -5.741  -2.323   4.470
  219   1HG   ARG  32          2HG       ARG  32  -3.996  -1.930   5.837
  220   2HG   ARG  32          1HG       ARG  32  -3.966  -0.264   5.261
  221   1HD   ARG  32          2HD       ARG  32  -4.170  -0.332   7.717
  222   2HD   ARG  32          1HD       ARG  32  -5.615   0.366   6.990
  223    HE   ARG  32           HE       ARG  32  -6.818  -1.670   7.521
  224   1HH1  ARG  32          2HH1      ARG  32  -4.336  -3.462   7.251
  225   2HH1  ARG  32          1HH1      ARG  32  -4.129  -3.980   8.890
  226   1HH2  ARG  32          1HH2      ARG  32  -6.225  -1.533  10.200
  227   2HH2  ARG  32          2HH2      ARG  32  -5.204  -2.883  10.570
  228    H    CYS  33           H        CYS  33  -3.401   0.465   3.425
  229    HA   CYS  33           HA       CYS  33  -2.929  -0.894   0.835
  230   1HB   CYS  33          2HB       CYS  33  -1.658   1.351   2.327
  231   2HB   CYS  33          1HB       CYS  33  -0.608   0.382   1.293
  232    H    THR  34           H        THR  34  -2.439  -3.030   1.166
  233    HA   THR  34           HA       THR  34  -0.698  -3.813   3.422
  234    HB   THR  34           HB       THR  34  -2.060  -5.474   1.275
  235    HG1  THR  34           HG1      THR  34  -3.699  -5.183   2.541
  236   1HG2  THR  34          1HG2      THR  34  -0.626  -7.088   1.937
  237   2HG2  THR  34          2HG2      THR  34  -1.477  -7.076   3.482
  238   3HG2  THR  34          3HG2      THR  34  -0.022  -6.102   3.268
  239    H    CYS  35           H        CYS  35   1.453  -3.541   3.088
  240    HA   CYS  35           HA       CYS  35   2.556  -3.907   0.346
  241   1HB   CYS  35          2HB       CYS  35   4.177  -2.877   2.651
  242   2HB   CYS  35          1HB       CYS  35   4.312  -2.493   0.937
  243    H    TYR  36           H        TYR  36   4.519  -5.181   0.082
  244    HA   TYR  36           HA       TYR  36   4.869  -7.253   2.213
  245   1HB   TYR  36          2HB       TYR  36   5.667  -8.669   0.128
  246   2HB   TYR  36          1HB       TYR  36   3.951  -8.531   0.504
  247    HD1  TYR  36           HD1      TYR  36   6.666  -7.359  -1.724
  248    HD2  TYR  36           HD2      TYR  36   2.449  -7.250  -0.903
  249    HE1  TYR  36           HE1      TYR  36   6.256  -6.350  -3.952
  250    HE2  TYR  36           HE2      TYR  36   2.042  -6.240  -3.130
  251    HH   TYR  36           HH       TYR  36   3.547  -6.351  -5.502
  252    H    ARG  37           H        ARG  37   7.031  -8.123   2.446
  253    HA   ARG  37           HA       ARG  37   9.104  -6.136   2.252
  254   1HB   ARG  37          2HB       ARG  37   9.048  -9.048   3.008
  255   2HB   ARG  37          1HB       ARG  37  10.579  -8.183   2.868
  256   1HG   ARG  37          2HG       ARG  37  10.264  -7.212   4.869
  257   2HG   ARG  37          1HG       ARG  37   8.707  -6.571   4.350
  258   1HD   ARG  37          2HD       ARG  37   7.750  -8.895   4.813
  259   2HD   ARG  37          1HD       ARG  37   9.276  -9.258   5.619
  260    HE   ARG  37           HE       ARG  37   7.185  -7.443   6.613
  261   1HH1  ARG  37          1HH2      ARG  37   8.717  -9.511   8.229
  262   2HH1  ARG  37          2HH2      ARG  37   9.758  -8.504   9.178
  263   1HH2  ARG  37          2HH1      ARG  37   9.280  -5.691   7.191
  264   2HH2  ARG  37          1HH1      ARG  37  10.078  -6.332   8.587
  265    H    CYS  38           H        CYS  38  10.966  -6.120   0.942
  266    HA   CYS  38           HA       CYS  38  10.602  -7.371  -1.718
  267   1HB   CYS  38          2HB       CYS  38  11.319  -4.878  -1.168
  268   2HB   CYS  38          1HB       CYS  38  12.924  -5.599  -1.044
  269    H    GLY  39           HN       GLY  39  11.803  -9.101  -2.383
  270   1HA   GLY  39          2HA       GLY  39  13.795 -10.224  -0.506
  271   2HA   GLY  39          1HA       GLY  39  13.106 -11.056  -1.901
  Start of MODEL   10
    1   1H    GLY   1          1H        GLY   1  -8.274   4.696   1.716
    2   2H    GLY   1          2H        GLY   1  -8.430   4.608   3.406
    3   3H    GLY   1          3H        GLY   1  -7.380   3.547   2.589
    4   1HA   GLY   1          2HA       GLY   1  -7.018   6.485   2.509
    5   2HA   GLY   1          1HA       GLY   1  -6.311   5.492   3.782
    6    H    PHE   2           H        PHE   2  -4.495   6.777   2.335
    7    HA   PHE   2           HA       PHE   2  -2.577   6.503   1.021
    8   1HB   PHE   2          2HB       PHE   2  -3.215   3.546   1.027
    9   2HB   PHE   2          1HB       PHE   2  -1.633   4.310   0.897
   10    HD1  PHE   2           HD1      PHE   2  -3.869   2.727   3.107
   11    HD2  PHE   2           HD2      PHE   2  -1.044   5.959   2.926
   12    HE1  PHE   2           HE1      PHE   2  -3.645   2.670   5.576
   13    HE2  PHE   2           HE2      PHE   2  -0.820   5.901   5.395
   14    HZ   PHE   2           HZ       PHE   2  -2.120   4.257   6.720
   15    H    GLY   3           H        GLY   3  -5.281   6.786  -0.274
   16   1HA   GLY   3          2HA       GLY   3  -6.037   6.957  -2.479
   17   2HA   GLY   3          1HA       GLY   3  -4.440   6.434  -3.007
   18    H    CYS   4           H        CYS   4  -7.080   4.877  -1.136
   19    HA   CYS   4           HA       CYS   4  -6.769   2.486  -2.898
   20   1HB   CYS   4          2HB       CYS   4  -7.680   2.844  -0.050
   21   2HB   CYS   4          1HB       CYS   4  -8.158   1.414  -0.963
   22    HA   PRO   5           HA       PRO   5  -8.019   0.601  -2.840
   23   1HB   PRO   5          2HB       PRO   5  -9.355  -0.705  -4.849
   24   2HB   PRO   5          1HB       PRO   5  -9.938  -0.618  -3.180
   25   1HG   PRO   5          2HG       PRO   5 -10.945   0.805  -5.589
   26   2HG   PRO   5          1HG       PRO   5 -11.794   0.402  -4.088
   27   1HD   PRO   5          2HD       PRO   5 -10.713   2.943  -4.797
   28   2HD   PRO   5          1HD       PRO   5 -11.367   2.470  -3.215
   29    H    ASN   6           H        ASN   6  -7.493   3.078  -4.733
   30    HA   ASN   6           HA       ASN   6  -6.735   2.189  -7.311
   31   1HB   ASN   6          2HB       ASN   6  -6.777   4.594  -6.268
   32   2HB   ASN   6          1HB       ASN   6  -5.105   4.240  -5.836
   33   1HD2  ASN   6          1HD2      ASN   6  -7.190   5.178  -8.442
   34   2HD2  ASN   6          2HD2      ASN   6  -6.019   5.140  -9.670
   35    H    ASN   7           H        ASN   7  -4.942   1.141  -8.104
   36    HA   ASN   7           HA       ASN   7  -3.204  -0.237  -6.184
   37   1HB   ASN   7          2HB       ASN   7  -3.554  -0.327  -9.178
   38   2HB   ASN   7          1HB       ASN   7  -2.178  -1.116  -8.410
   39   1HD2  ASN   7          1HD2      ASN   7  -2.701  -2.826  -6.749
   40   2HD2  ASN   7          2HD2      ASN   7  -4.175  -3.661  -6.863
   41    H    TYR   8           H        TYR   8  -2.830   2.268  -8.697
   42    HA   TYR   8           HA       TYR   8   0.018   2.497  -8.504
   43   1HB   TYR   8          2HB       TYR   8  -1.651   3.489 -10.265
   44   2HB   TYR   8          1HB       TYR   8  -1.748   4.847  -9.146
   45    HD1  TYR   8           HD1      TYR   8   0.417   2.973 -11.450
   46    HD2  TYR   8           HD2      TYR   8   0.214   6.249  -8.679
   47    HE1  TYR   8           HE1      TYR   8   2.570   3.842 -12.320
   48    HE2  TYR   8           HE2      TYR   8   2.367   7.118  -9.550
   49    HH   TYR   8           HH       TYR   8   3.628   6.483 -12.299
   50    H    GLN   9           H        GLN   9  -2.577   4.474  -7.008
   51    HA   GLN   9           HA       GLN   9  -0.842   6.099  -5.429
   52   1HB   GLN   9          2HB       GLN   9  -3.738   5.295  -5.109
   53   2HB   GLN   9          1HB       GLN   9  -2.936   6.378  -3.971
   54   1HG   GLN   9          2HG       GLN   9  -2.568   7.035  -6.841
   55   2HG   GLN   9          1HG       GLN   9  -4.201   7.248  -6.211
   56   1HE2  GLN   9          1HE2      GLN   9  -1.468   9.010  -6.720
   57   2HE2  GLN   9          2HE2      GLN   9  -1.572  10.103  -5.426
   58    H    CYS  10           H        CYS  10  -2.468   3.007  -4.687
   59    HA   CYS  10           HA       CYS  10  -1.595   2.821  -1.966
   60   1HB   CYS  10          2HB       CYS  10  -3.353   1.378  -3.104
   61   2HB   CYS  10          1HB       CYS  10  -2.026   0.489  -3.849
   62    H    HIS  11           H        HIS  11  -0.153   1.726  -5.027
   63    HA   HIS  11           HA       HIS  11   2.114   0.407  -3.875
   64   1HB   HIS  11          2HB       HIS  11   1.389   0.111  -6.244
   65   2HB   HIS  11          1HB       HIS  11   1.906   1.762  -6.582
   66    HD1  HIS  11           HD1      HIS  11   3.323  -1.584  -5.485
   67    HD2  HIS  11           HD2      HIS  11   4.652   2.053  -7.026
   68    HE1  HIS  11           HE1      HIS  11   5.779  -1.888  -6.019
   69    H    ARG  12           H        ARG  12   1.598   3.752  -4.996
   70    HA   ARG  12           HA       ARG  12   4.243   4.721  -4.631
   71   1HB   ARG  12          2HB       ARG  12   2.057   5.868  -5.597
   72   2HB   ARG  12          1HB       ARG  12   1.900   6.464  -3.943
   73   1HG   ARG  12          2HG       ARG  12   4.184   7.397  -4.059
   74   2HG   ARG  12          1HG       ARG  12   4.343   6.802  -5.711
   75   1HD   ARG  12          2HD       ARG  12   3.396   8.704  -6.449
   76   2HD   ARG  12          1HD       ARG  12   1.909   8.249  -5.620
   77    HE   ARG  12           HE       ARG  12   3.570  10.398  -4.835
   78   1HH1  ARG  12          2HH1      ARG  12   0.850   9.201  -3.712
   79   2HH1  ARG  12          1HH1      ARG  12   1.253   9.148  -2.030
   80   1HH2  ARG  12          1HH2      ARG  12   4.654   9.629  -2.558
   81   2HH2  ARG  12          2HH2      ARG  12   3.415   9.382  -1.374
   82    H    HIS  13           H        HIS  13   1.563   4.382  -2.310
   83    HA   HIS  13           HA       HIS  13   2.864   5.680  -0.105
   84   1HB   HIS  13          2HB       HIS  13   0.472   5.306  -0.023
   85   2HB   HIS  13          1HB       HIS  13   0.688   3.566  -0.210
   86    HD1  HIS  13           HD1      HIS  13   2.041   6.205   2.213
   87    HD2  HIS  13           HD2      HIS  13   0.474   2.344   2.244
   88    HE1  HIS  13           HE1      HIS  13   2.028   5.458   4.632
   89    H    CYS  14           H        CYS  14   2.683   2.249  -1.092
   90    HA   CYS  14           HA       CYS  14   4.288   1.252   1.080
   91   1HB   CYS  14          2HB       CYS  14   3.758   0.119  -1.682
   92   2HB   CYS  14          1HB       CYS  14   4.565  -0.761  -0.387
   93    H    LYS  15           H        LYS  15   5.054   2.622  -2.075
   94    HA   LYS  15           HA       LYS  15   7.791   1.791  -2.216
   95   1HB   LYS  15          2HB       LYS  15   6.128   3.908  -3.520
   96   2HB   LYS  15          1HB       LYS  15   7.884   4.044  -3.638
   97   1HG   LYS  15          2HG       LYS  15   6.803   1.336  -4.146
   98   2HG   LYS  15          1HG       LYS  15   6.364   2.552  -5.345
   99   1HD   LYS  15          2HD       LYS  15   8.515   2.794  -6.087
  100   2HD   LYS  15          1HD       LYS  15   9.204   2.566  -4.479
  101   1HE   LYS  15          2HE       LYS  15   7.883   0.160  -5.529
  102   2HE   LYS  15          1HE       LYS  15   9.249   0.689  -6.507
  103   1HZ   LYS  15          1HZ       LYS  15  10.643   0.682  -4.561
  104   2HZ   LYS  15          2HZ       LYS  15   9.893  -0.835  -4.712
  105   3HZ   LYS  15          3HZ       LYS  15   9.329   0.282  -3.564
  106    H    SER  16           H        SER  16   6.252   4.706  -0.811
  107    HA   SER  16           HA       SER  16   8.752   5.946  -0.072
  108   1HB   SER  16          2HB       SER  16   7.290   7.309   1.491
  109   2HB   SER  16          1HB       SER  16   6.825   7.365  -0.204
  110    HG   SER  16           HG       SER  16   5.640   5.957   1.940
  111    H    ILE  17           H        ILE  17   6.788   3.441   1.378
  112    HA   ILE  17           HA       ILE  17   7.984   3.665   4.033
  113    HB   ILE  17           HB       ILE  17   6.396   1.419   2.745
  114   1HG1  ILE  17          2HG1      ILE  17   5.385   3.243   4.904
  115   2HG1  ILE  17          1HG1      ILE  17   5.410   3.830   3.241
  116   1HG2  ILE  17          1HG2      ILE  17   7.242   1.897   5.621
  117   2HG2  ILE  17          2HG2      ILE  17   7.738   0.556   4.587
  118   3HG2  ILE  17          3HG2      ILE  17   6.062   0.686   5.119
  119   1HD1  ILE  17          1HD1      ILE  17   3.622   1.889   4.490
  120   2HD1  ILE  17          2HD1      ILE  17   4.358   1.262   3.016
  121   3HD1  ILE  17          3HD1      ILE  17   3.438   2.765   2.971
  122    HA   PRO  18           HA       PRO  18  11.675   1.489   2.849
  123   1HB   PRO  18          2HB       PRO  18  12.797   1.495   5.360
  124   2HB   PRO  18          1HB       PRO  18  12.796   2.900   4.280
  125   1HG   PRO  18          2HG       PRO  18  11.154   2.407   6.718
  126   2HG   PRO  18          1HG       PRO  18  11.646   3.944   5.988
  127   1HD   PRO  18          2HD       PRO  18   9.096   2.728   5.756
  128   2HD   PRO  18          1HD       PRO  18   9.695   4.097   4.796
  129    H    GLY  19           H        GLY  19  12.215  -0.682   2.813
  130   1HA   GLY  19          2HA       GLY  19  12.492  -2.865   3.857
  131   2HA   GLY  19          1HA       GLY  19  11.181  -2.465   4.965
  132    H    ARG  20           H        ARG  20   9.578  -1.347   2.643
  133    HA   ARG  20           HA       ARG  20   8.616  -3.979   1.619
  134   1HB   ARG  20          2HB       ARG  20   7.097  -1.365   1.609
  135   2HB   ARG  20          1HB       ARG  20   6.450  -2.985   1.368
  136   1HG   ARG  20          2HG       ARG  20   7.742  -2.019   3.939
  137   2HG   ARG  20          1HG       ARG  20   6.002  -2.106   3.664
  138   1HD   ARG  20          2HD       ARG  20   6.718  -4.619   2.935
  139   2HD   ARG  20          1HD       ARG  20   7.953  -4.289   4.148
  140    HE   ARG  20           HE       ARG  20   5.054  -4.540   4.647
  141   1HH1  ARG  20          1HH2      ARG  20   7.587  -5.659   6.129
  142   2HH1  ARG  20          2HH2      ARG  20   7.446  -4.808   7.631
  143   1HH2  ARG  20          2HH1      ARG  20   5.118  -2.528   6.424
  144   2HH2  ARG  20          1HH1      ARG  20   6.045  -3.030   7.798
  145    H    CYS  21           H        CYS  21   8.147  -4.221  -0.601
  146    HA   CYS  21           HA       CYS  21   9.591  -2.317  -2.375
  147   1HB   CYS  21          2HB       CYS  21   9.309  -5.175  -2.312
  148   2HB   CYS  21          1HB       CYS  21   8.630  -4.577  -3.825
  149    H    GLY  22           H        GLY  22   6.534  -4.187  -2.338
  150   1HA   GLY  22          2HA       GLY  22   5.189  -1.864  -3.622
  151   2HA   GLY  22          1HA       GLY  22   4.995  -3.466  -4.333
  152    H    GLY  23           H        GLY  23   2.649  -2.489  -3.654
  153   1HA   GLY  23          2HA       GLY  23   1.821  -4.136  -1.377
  154   2HA   GLY  23          1HA       GLY  23   1.613  -2.408  -1.115
  155    H    TYR  24           H        TYR  24  -0.688  -3.415  -0.948
  156    HA   TYR  24           HA       TYR  24  -2.120  -2.712  -3.406
  157   1HB   TYR  24          2HB       TYR  24  -3.230  -4.856  -3.705
  158   2HB   TYR  24          1HB       TYR  24  -1.488  -5.127  -3.739
  159    HD1  TYR  24           HD1      TYR  24  -0.319  -6.047  -1.718
  160    HD2  TYR  24           HD2      TYR  24  -4.599  -5.751  -1.955
  161    HE1  TYR  24           HE1      TYR  24  -0.535  -7.606   0.199
  162    HE2  TYR  24           HE2      TYR  24  -4.814  -7.311  -0.042
  163    HH   TYR  24           HH       TYR  24  -3.287  -9.201   0.970
  164    H    CYS  25           H        CYS  25  -4.447  -2.513  -3.009
  165    HA   CYS  25           HA       CYS  25  -5.042  -1.831  -0.209
  166   1HB   CYS  25          2HB       CYS  25  -6.769  -1.673  -2.700
  167   2HB   CYS  25          1HB       CYS  25  -7.200  -1.024  -1.119
  168    H    GLY  26           H        GLY  26  -5.947  -3.271   1.184
  169   1HA   GLY  26          2HA       GLY  26  -8.109  -5.025   0.511
  170   2HA   GLY  26          1HA       GLY  26  -6.604  -5.944   0.513
  171    H    GLY  27           H        GLY  27  -9.092  -5.627   2.401
  172   1HA   GLY  27          2HA       GLY  27  -8.568  -6.625   4.728
  173   2HA   GLY  27          1HA       GLY  27  -7.564  -5.191   4.935
  174    H    TRP  28           H        TRP  28  -8.558  -3.198   5.346
  175    HA   TRP  28           HA       TRP  28 -11.296  -3.344   6.374
  176   1HB   TRP  28          2HB       TRP  28  -9.462  -2.024   7.487
  177   2HB   TRP  28          1HB       TRP  28  -9.502  -0.914   6.119
  178    HD1  TRP  28           HD1      TRP  28 -11.752  -2.214   8.960
  179    HE1  TRP  28           HE1      TRP  28 -13.543  -0.432   9.458
  180    HE3  TRP  28           HE3      TRP  28 -10.751   1.117   5.221
  181    HZ2  TRP  28           HZ2      TRP  28 -14.433   2.076   8.415
  182    HZ3  TRP  28           HZ3      TRP  28 -12.084   3.193   5.000
  183    HH2  TRP  28           HH2      TRP  28 -13.924   3.676   6.589
  184    H    HIS  29           H        HIS  29 -12.632  -3.647   4.561
  185    HA   HIS  29           HA       HIS  29 -13.889  -3.044   2.681
  186   1HB   HIS  29          2HB       HIS  29 -13.112  -0.231   3.516
  187   2HB   HIS  29          1HB       HIS  29 -14.503  -0.688   2.536
  188    HD1  HIS  29           HD1      HIS  29 -14.546   0.721   5.447
  189    HD2  HIS  29           HD2      HIS  29 -15.335  -3.284   4.615
  190    HE1  HIS  29           HE1      HIS  29 -15.916  -0.156   7.388
  191    H    ARG  30           H        ARG  30 -11.013  -3.559   2.339
  192    HA   ARG  30           HA       ARG  30  -9.331  -3.361   0.734
  193   1HB   ARG  30          2HB       ARG  30 -11.289  -4.014  -0.714
  194   2HB   ARG  30          1HB       ARG  30 -11.554  -2.300  -1.036
  195   1HG   ARG  30          2HG       ARG  30  -9.664  -2.106  -2.334
  196   2HG   ARG  30          1HG       ARG  30  -8.787  -3.334  -1.425
  197   1HD   ARG  30          2HD       ARG  30 -10.493  -5.000  -2.458
  198   2HD   ARG  30          1HD       ARG  30 -10.820  -3.707  -3.615
  199    HE   ARG  30           HE       ARG  30  -8.179  -5.063  -3.276
  200   1HH1  ARG  30          2HH1      ARG  30  -9.644  -5.516  -5.795
  201   2HH1  ARG  30          1HH1      ARG  30  -8.993  -4.310  -6.853
  202   1HH2  ARG  30          1HH2      ARG  30  -7.635  -2.411  -4.283
  203   2HH2  ARG  30          2HH2      ARG  30  -7.854  -2.545  -5.994
  204    H    LEU  31           H        LEU  31  -9.865  -1.063   2.511
  205    HA   LEU  31           HA       LEU  31  -8.975   1.184   0.762
  206   1HB   LEU  31          2HB       LEU  31 -10.451   1.096   3.384
  207   2HB   LEU  31          1HB       LEU  31  -9.570   2.545   2.903
  208    HG   LEU  31           HG       LEU  31 -11.682   1.175   1.210
  209   1HD1  LEU  31          1HD1      LEU  31 -11.812   3.675   2.924
  210   2HD1  LEU  31          2HD1      LEU  31 -12.701   2.173   3.189
  211   3HD1  LEU  31          3HD1      LEU  31 -13.061   3.174   1.783
  212   1HD2  LEU  31          1HD2      LEU  31 -11.504   3.610   0.163
  213   2HD2  LEU  31          2HD2      LEU  31 -10.376   2.344  -0.322
  214   3HD2  LEU  31          3HD2      LEU  31  -9.885   3.555   0.863
  215    H    ARG  32           H        ARG  32  -7.974  -0.991   3.257
  216    HA   ARG  32           HA       ARG  32  -5.777   0.711   4.213
  217   1HB   ARG  32          2HB       ARG  32  -7.031  -1.071   5.598
  218   2HB   ARG  32          1HB       ARG  32  -6.088  -2.258   4.699
  219   1HG   ARG  32          2HG       ARG  32  -4.077  -1.587   5.649
  220   2HG   ARG  32          1HG       ARG  32  -4.655   0.047   5.973
  221   1HD   ARG  32          2HD       ARG  32  -4.714  -0.827   8.117
  222   2HD   ARG  32          1HD       ARG  32  -6.343  -1.231   7.577
  223    HE   ARG  32           HE       ARG  32  -4.850  -3.443   6.837
  224   1HH1  ARG  32          1HH2      ARG  32  -3.018  -2.829   9.095
  225   2HH1  ARG  32          2HH2      ARG  32  -3.769  -3.647  10.426
  226   1HH2  ARG  32          2HH1      ARG  32  -6.833  -3.994   8.820
  227   2HH2  ARG  32          1HH1      ARG  32  -5.938  -4.309  10.268
  228    H    CYS  33           H        CYS  33  -3.672   0.604   3.474
  229    HA   CYS  33           HA       CYS  33  -3.191  -1.019   1.045
  230   1HB   CYS  33          2HB       CYS  33  -1.944   1.399   2.273
  231   2HB   CYS  33          1HB       CYS  33  -0.917   0.370   1.275
  232    H    THR  34           H        THR  34  -2.293  -2.991   1.283
  233    HA   THR  34           HA       THR  34  -0.612  -3.535   3.679
  234    HB   THR  34           HB       THR  34  -1.836  -5.467   1.684
  235    HG1  THR  34           HG1      THR  34  -3.562  -5.283   2.839
  236   1HG2  THR  34          1HG2      THR  34   0.284  -5.939   3.308
  237   2HG2  THR  34          2HG2      THR  34  -0.903  -7.172   2.886
  238   3HG2  THR  34          3HG2      THR  34  -1.039  -6.306   4.415
  239    H    CYS  35           H        CYS  35   1.526  -3.213   3.290
  240    HA   CYS  35           HA       CYS  35   2.599  -3.704   0.560
  241   1HB   CYS  35          2HB       CYS  35   4.198  -2.541   2.830
  242   2HB   CYS  35          1HB       CYS  35   4.389  -2.284   1.098
  243    H    TYR  36           H        TYR  36   4.214  -5.237   0.186
  244    HA   TYR  36           HA       TYR  36   4.726  -7.122   2.445
  245   1HB   TYR  36          2HB       TYR  36   5.490  -8.652   0.472
  246   2HB   TYR  36          1HB       TYR  36   3.769  -8.413   0.745
  247    HD1  TYR  36           HD1      TYR  36   2.398  -7.221  -0.839
  248    HD2  TYR  36           HD2      TYR  36   6.657  -7.423  -1.360
  249    HE1  TYR  36           HE1      TYR  36   2.156  -6.332  -3.140
  250    HE2  TYR  36           HE2      TYR  36   6.415  -6.535  -3.662
  251    HH   TYR  36           HH       TYR  36   4.923  -5.373  -5.043
  252    H    ARG  37           H        ARG  37   6.891  -8.019   2.660
  253    HA   ARG  37           HA       ARG  37   8.961  -6.023   2.434
  254   1HB   ARG  37          2HB       ARG  37   8.836  -8.872   3.341
  255   2HB   ARG  37          1HB       ARG  37  10.415  -8.158   3.020
  256   1HG   ARG  37          2HG       ARG  37   8.936  -6.233   4.493
  257   2HG   ARG  37          1HG       ARG  37   8.709  -7.779   5.308
  258   1HD   ARG  37          2HD       ARG  37  11.473  -7.119   4.408
  259   2HD   ARG  37          1HD       ARG  37  10.842  -6.215   5.783
  260    HE   ARG  37           HE       ARG  37  11.072  -8.172   7.072
  261   1HH1  ARG  37          2HH1      ARG  37  12.734  -8.971   4.452
  262   2HH1  ARG  37          1HH1      ARG  37  12.239 -10.625   4.325
  263   1HH2  ARG  37          1HH2      ARG  37   9.639 -10.295   6.612
  264   2HH2  ARG  37          2HH2      ARG  37  10.483 -11.379   5.559
  265    H    CYS  38           H        CYS  38  10.851  -6.072   1.144
  266    HA   CYS  38           HA       CYS  38  10.464  -7.322  -1.511
  267   1HB   CYS  38          2HB       CYS  38  11.277  -4.857  -0.954
  268   2HB   CYS  38          1HB       CYS  38  12.850  -5.642  -0.832
  269    H    GLY  39           HN       GLY  39  11.942  -8.815  -2.404
  270   1HA   GLY  39          2HA       GLY  39  13.420 -10.437  -0.469
  271   2HA   GLY  39          1HA       GLY  39  13.263 -10.768  -2.194
  Start of MODEL   11
    1   1H    GLY   1          1H        GLY   1  -7.743   3.373   2.279
    2   2H    GLY   1          2H        GLY   1  -8.731   4.591   1.625
    3   3H    GLY   1          3H        GLY   1  -8.840   4.200   3.275
    4   1HA   GLY   1          2HA       GLY   1  -7.555   6.300   2.614
    5   2HA   GLY   1          1HA       GLY   1  -6.843   5.213   3.804
    6    H    PHE   2           H        PHE   2  -5.088   6.785   2.535
    7    HA   PHE   2           HA       PHE   2  -3.150   6.814   1.221
    8   1HB   PHE   2          2HB       PHE   2  -3.577   3.838   1.578
    9   2HB   PHE   2          1HB       PHE   2  -2.146   4.512   0.799
   10    HD1  PHE   2           HD1      PHE   2  -0.772   6.256   2.107
   11    HD2  PHE   2           HD2      PHE   2  -3.718   3.717   3.931
   12    HE1  PHE   2           HE1      PHE   2   0.235   6.686   4.331
   13    HE2  PHE   2           HE2      PHE   2  -2.710   4.147   6.155
   14    HZ   PHE   2           HZ       PHE   2  -0.734   5.631   6.356
   15    H    GLY   3           H        GLY   3  -5.761   6.901  -0.177
   16   1HA   GLY   3          2HA       GLY   3  -6.480   6.977  -2.401
   17   2HA   GLY   3          1HA       GLY   3  -4.820   6.625  -2.879
   18    H    CYS   4           H        CYS   4  -7.489   4.880  -1.231
   19    HA   CYS   4           HA       CYS   4  -6.802   2.496  -2.898
   20   1HB   CYS   4          2HB       CYS   4  -7.835   2.796  -0.094
   21   2HB   CYS   4          1HB       CYS   4  -8.223   1.338  -1.004
   22    HA   PRO   5           HA       PRO   5  -7.839   0.501  -2.888
   23   1HB   PRO   5          2HB       PRO   5  -8.879  -0.935  -4.982
   24   2HB   PRO   5          1HB       PRO   5  -9.580  -0.928  -3.356
   25   1HG   PRO   5          2HG       PRO   5 -10.574   0.396  -5.828
   26   2HG   PRO   5          1HG       PRO   5 -11.474  -0.120  -4.393
   27   1HD   PRO   5          2HD       PRO   5 -10.658   2.536  -5.009
   28   2HD   PRO   5          1HD       PRO   5 -11.342   1.968  -3.472
   29    H    ASN   6           H        ASN   6  -7.536   3.034  -4.785
   30    HA   ASN   6           HA       ASN   6  -6.523   2.314  -7.296
   31   1HB   ASN   6          2HB       ASN   6  -6.784   4.663  -6.112
   32   2HB   ASN   6          1HB       ASN   6  -5.090   4.407  -5.694
   33   1HD2  ASN   6          1HD2      ASN   6  -7.305   5.057  -8.350
   34   2HD2  ASN   6          2HD2      ASN   6  -6.110   5.272  -9.536
   35    H    ASN   7           H        ASN   7  -5.004   0.834  -7.758
   36    HA   ASN   7           HA       ASN   7  -3.092  -0.166  -5.842
   37   1HB   ASN   7          2HB       ASN   7  -3.457  -0.517  -8.819
   38   2HB   ASN   7          1HB       ASN   7  -2.079  -1.225  -7.977
   39   1HD2  ASN   7          1HD2      ASN   7  -5.663  -1.222  -8.057
   40   2HD2  ASN   7          2HD2      ASN   7  -5.836  -2.731  -7.299
   41    H    TYR   8           H        TYR   8  -2.947   2.281  -8.393
   42    HA   TYR   8           HA       TYR   8  -0.089   2.592  -8.422
   43   1HB   TYR   8          2HB       TYR   8  -1.492   3.463 -10.236
   44   2HB   TYR   8          1HB       TYR   8  -2.304   4.550  -9.114
   45    HD1  TYR   8           HD1      TYR   8   1.035   3.734 -10.579
   46    HD2  TYR   8           HD2      TYR   8  -1.402   6.675  -8.613
   47    HE1  TYR   8           HE1      TYR   8   2.786   5.445 -10.965
   48    HE2  TYR   8           HE2      TYR   8   0.349   8.385  -8.998
   49    HH   TYR   8           HH       TYR   8   2.969   8.283  -9.368
   50    H    GLN   9           H        GLN   9  -2.681   4.350  -6.686
   51    HA   GLN   9           HA       GLN   9  -0.914   6.101  -5.247
   52   1HB   GLN   9          2HB       GLN   9  -3.678   5.127  -4.456
   53   2HB   GLN   9          1HB       GLN   9  -2.848   6.531  -3.790
   54   1HG   GLN   9          2HG       GLN   9  -3.285   6.322  -6.761
   55   2HG   GLN   9          1HG       GLN   9  -4.593   6.875  -5.718
   56   1HE2  GLN   9          1HE2      GLN   9  -4.565   9.115  -6.303
   57   2HE2  GLN   9          2HE2      GLN   9  -3.229  10.125  -6.025
   58    H    CYS  10           H        CYS  10  -2.502   3.030  -4.327
   59    HA   CYS  10           HA       CYS  10  -1.367   2.808  -1.724
   60   1HB   CYS  10          2HB       CYS  10  -3.209   1.368  -2.882
   61   2HB   CYS  10          1HB       CYS  10  -1.857   0.408  -3.479
   62    H    HIS  11           H        HIS  11  -0.170   1.754  -4.908
   63    HA   HIS  11           HA       HIS  11   2.158   0.378  -3.999
   64   1HB   HIS  11          2HB       HIS  11   1.341   0.188  -6.310
   65   2HB   HIS  11          1HB       HIS  11   1.690   1.894  -6.587
   66    HD1  HIS  11           HD1      HIS  11   3.933  -0.601  -4.804
   67    HD2  HIS  11           HD2      HIS  11   3.879   1.667  -8.298
   68    HE1  HIS  11           HE1      HIS  11   6.207  -0.891  -5.877
   69    H    ARG  12           H        ARG  12   1.600   3.797  -4.809
   70    HA   ARG  12           HA       ARG  12   4.279   4.722  -4.557
   71   1HB   ARG  12          2HB       ARG  12   2.582   6.169  -5.504
   72   2HB   ARG  12          1HB       ARG  12   1.625   6.097  -4.026
   73   1HG   ARG  12          2HG       ARG  12   2.771   8.201  -3.989
   74   2HG   ARG  12          1HG       ARG  12   3.602   7.166  -2.830
   75   1HD   ARG  12          2HD       ARG  12   5.408   6.762  -4.329
   76   2HD   ARG  12          1HD       ARG  12   4.508   7.404  -5.705
   77    HE   ARG  12           HE       ARG  12   4.922   9.639  -4.886
   78   1HH1  ARG  12          2HH1      ARG  12   7.670   8.476  -4.591
   79   2HH1  ARG  12          1HH1      ARG  12   8.081   8.914  -2.966
   80   1HH2  ARG  12          1HH2      ARG  12   4.805   9.641  -2.060
   81   2HH2  ARG  12          2HH2      ARG  12   6.451   9.586  -1.530
   82    H    HIS  13           H        HIS  13   1.701   4.346  -2.123
   83    HA   HIS  13           HA       HIS  13   3.178   5.401   0.097
   84   1HB   HIS  13          2HB       HIS  13   0.781   5.155   0.284
   85   2HB   HIS  13          1HB       HIS  13   0.881   3.427  -0.045
   86    HD1  HIS  13           HD1      HIS  13   2.550   5.766   2.491
   87    HD2  HIS  13           HD2      HIS  13   0.682   2.043   2.319
   88    HE1  HIS  13           HE1      HIS  13   2.595   4.832   4.845
   89    H    CYS  14           H        CYS  14   2.777   2.054  -1.112
   90    HA   CYS  14           HA       CYS  14   4.302   0.759   0.919
   91   1HB   CYS  14          2HB       CYS  14   3.927   0.005  -1.996
   92   2HB   CYS  14          1HB       CYS  14   4.586  -1.063  -0.757
   93    H    LYS  15           H        LYS  15   5.296   2.326  -2.110
   94    HA   LYS  15           HA       LYS  15   8.053   1.502  -1.994
   95   1HB   LYS  15          2HB       LYS  15   6.551   3.669  -3.445
   96   2HB   LYS  15          1HB       LYS  15   8.314   3.631  -3.492
   97   1HG   LYS  15          2HG       LYS  15   8.122   1.193  -4.210
   98   2HG   LYS  15          1HG       LYS  15   6.395   1.481  -4.424
   99   1HD   LYS  15          2HD       LYS  15   8.503   3.204  -5.744
  100   2HD   LYS  15          1HD       LYS  15   7.840   1.762  -6.513
  101   1HE   LYS  15          2HE       LYS  15   5.927   2.826  -7.065
  102   2HE   LYS  15          1HE       LYS  15   5.735   3.467  -5.434
  103   1HZ   LYS  15          1HZ       LYS  15   7.576   5.080  -6.098
  104   2HZ   LYS  15          2HZ       LYS  15   6.031   5.337  -6.758
  105   3HZ   LYS  15          3HZ       LYS  15   7.249   4.613  -7.699
  106    H    SER  16           H        SER  16   6.271   4.259  -0.647
  107    HA   SER  16           HA       SER  16   8.602   5.730   0.199
  108   1HB   SER  16          2HB       SER  16   7.086   7.130   1.406
  109   2HB   SER  16          1HB       SER  16   6.240   6.650  -0.058
  110    HG   SER  16           HG       SER  16   5.352   4.897   1.306
  111    H    ILE  17           H        ILE  17   6.851   3.015   1.544
  112    HA   ILE  17           HA       ILE  17   7.894   3.289   4.248
  113    HB   ILE  17           HB       ILE  17   6.746   0.853   2.837
  114   1HG1  ILE  17          2HG1      ILE  17   5.304   2.589   4.833
  115   2HG1  ILE  17          1HG1      ILE  17   5.330   3.037   3.129
  116   1HG2  ILE  17          1HG2      ILE  17   6.370  -0.005   5.105
  117   2HG2  ILE  17          2HG2      ILE  17   7.086   1.452   5.793
  118   3HG2  ILE  17          3HG2      ILE  17   8.085   0.330   4.868
  119   1HD1  ILE  17          1HD1      ILE  17   4.736   0.229   3.368
  120   2HD1  ILE  17          2HD1      ILE  17   3.750   1.508   2.661
  121   3HD1  ILE  17          3HD1      ILE  17   3.630   1.153   4.383
  122    HA   PRO  18           HA       PRO  18  11.903   1.636   3.334
  123   1HB   PRO  18          2HB       PRO  18  12.717   1.346   5.945
  124   2HB   PRO  18          1HB       PRO  18  12.679   2.900   5.094
  125   1HG   PRO  18          2HG       PRO  18  10.818   1.856   7.180
  126   2HG   PRO  18          1HG       PRO  18  11.230   3.532   6.779
  127   1HD   PRO  18          2HD       PRO  18   8.867   2.187   6.013
  128   2HD   PRO  18          1HD       PRO  18   9.460   3.718   5.333
  129    H    GLY  19           H        GLY  19  12.692  -0.432   3.042
  130   1HA   GLY  19          2HA       GLY  19  12.983  -2.755   3.347
  131   2HA   GLY  19          1HA       GLY  19  12.057  -2.637   4.845
  132    H    ARG  20           H        ARG  20  10.927  -1.531   1.672
  133    HA   ARG  20           HA       ARG  20   9.058  -3.840   1.534
  134   1HB   ARG  20          2HB       ARG  20   8.346  -1.110   2.183
  135   2HB   ARG  20          1HB       ARG  20   7.576  -1.603   0.679
  136   1HG   ARG  20          2HG       ARG  20   6.017  -2.442   2.144
  137   2HG   ARG  20          1HG       ARG  20   7.110  -3.824   2.106
  138   1HD   ARG  20          2HD       ARG  20   8.310  -2.815   4.091
  139   2HD   ARG  20          1HD       ARG  20   7.012  -1.626   4.186
  140    HE   ARG  20           HE       ARG  20   6.386  -4.544   4.338
  141   1HH1  ARG  20          1HH2      ARG  20   7.364  -2.850   6.791
  142   2HH1  ARG  20          2HH2      ARG  20   5.843  -2.545   7.558
  143   1HH2  ARG  20          2HH1      ARG  20   3.962  -3.511   4.794
  144   2HH2  ARG  20          1HH1      ARG  20   3.905  -2.920   6.422
  145    H    CYS  21           H        CYS  21   7.737  -3.540  -0.656
  146    HA   CYS  21           HA       CYS  21   9.474  -2.420  -2.790
  147   1HB   CYS  21          2HB       CYS  21   9.215  -5.233  -2.204
  148   2HB   CYS  21          1HB       CYS  21   8.518  -4.894  -3.788
  149    H    GLY  22           H        GLY  22   6.471  -4.338  -2.324
  150   1HA   GLY  22          2HA       GLY  22   5.002  -2.239  -3.824
  151   2HA   GLY  22          1HA       GLY  22   4.883  -3.902  -4.389
  152    H    GLY  23           H        GLY  23   2.510  -3.052  -3.815
  153   1HA   GLY  23          2HA       GLY  23   1.673  -4.565  -1.497
  154   2HA   GLY  23          1HA       GLY  23   1.545  -2.834  -1.200
  155    H    TYR  24           H        TYR  24  -0.798  -3.502  -1.011
  156    HA   TYR  24           HA       TYR  24  -2.219  -2.782  -3.447
  157   1HB   TYR  24          2HB       TYR  24  -3.527  -4.867  -3.641
  158   2HB   TYR  24          1HB       TYR  24  -1.810  -5.185  -3.888
  159    HD1  TYR  24           HD1      TYR  24  -4.713  -5.789  -1.776
  160    HD2  TYR  24           HD2      TYR  24  -0.443  -6.188  -2.032
  161    HE1  TYR  24           HE1      TYR  24  -4.754  -7.410   0.099
  162    HE2  TYR  24           HE2      TYR  24  -0.485  -7.809  -0.157
  163    HH   TYR  24           HH       TYR  24  -2.606  -8.122   1.958
  164    H    CYS  25           H        CYS  25  -4.598  -2.637  -3.018
  165    HA   CYS  25           HA       CYS  25  -5.075  -1.821  -0.222
  166   1HB   CYS  25          2HB       CYS  25  -6.812  -1.618  -2.699
  167   2HB   CYS  25          1HB       CYS  25  -7.246  -0.979  -1.114
  168    H    GLY  26           H        GLY  26  -5.680  -3.419   1.159
  169   1HA   GLY  26          2HA       GLY  26  -8.059  -4.998   0.667
  170   2HA   GLY  26          1HA       GLY  26  -6.601  -5.985   0.546
  171    H    GLY  27           H        GLY  27  -8.851  -5.835   2.605
  172   1HA   GLY  27          2HA       GLY  27  -8.072  -6.788   4.883
  173   2HA   GLY  27          1HA       GLY  27  -7.212  -5.257   5.037
  174    H    TRP  28           H        TRP  28  -8.640  -3.271   4.762
  175    HA   TRP  28           HA       TRP  28 -11.219  -3.724   6.190
  176   1HB   TRP  28          2HB       TRP  28  -9.509  -2.308   7.342
  177   2HB   TRP  28          1HB       TRP  28  -9.575  -1.181   5.989
  178    HD1  TRP  28           HD1      TRP  28 -11.798  -2.608   8.789
  179    HE1  TRP  28           HE1      TRP  28 -13.677  -0.916   9.279
  180    HE3  TRP  28           HE3      TRP  28 -10.920   0.792   5.078
  181    HZ2  TRP  28           HZ2      TRP  28 -14.677   1.551   8.240
  182    HZ3  TRP  28           HZ3      TRP  28 -12.351   2.803   4.854
  183    HH2  TRP  28           HH2      TRP  28 -14.228   3.185   6.428
  184    H    HIS  29           H        HIS  29 -12.598  -4.046   4.431
  185    HA   HIS  29           HA       HIS  29 -13.948  -3.483   2.611
  186   1HB   HIS  29          2HB       HIS  29 -13.273  -0.661   3.500
  187   2HB   HIS  29          1HB       HIS  29 -14.637  -1.127   2.487
  188    HD1  HIS  29           HD1      HIS  29 -14.796   0.177   5.428
  189    HD2  HIS  29           HD2      HIS  29 -15.364  -3.839   4.478
  190    HE1  HIS  29           HE1      HIS  29 -16.132  -0.827   7.331
  191    H    ARG  30           H        ARG  30 -11.079  -3.874   2.117
  192    HA   ARG  30           HA       ARG  30  -9.533  -3.639   0.378
  193   1HB   ARG  30          2HB       ARG  30 -11.789  -4.065  -0.855
  194   2HB   ARG  30          1HB       ARG  30 -11.712  -2.351  -1.251
  195   1HG   ARG  30          2HG       ARG  30  -9.888  -2.607  -2.638
  196   2HG   ARG  30          1HG       ARG  30  -9.253  -3.972  -1.721
  197   1HD   ARG  30          2HD       ARG  30 -10.329  -5.469  -3.023
  198   2HD   ARG  30          1HD       ARG  30 -11.847  -4.578  -2.912
  199    HE   ARG  30           HE       ARG  30 -10.872  -3.082  -4.748
  200   1HH1  ARG  30          1HH2      ARG  30 -11.456  -6.207  -5.223
  201   2HH1  ARG  30          2HH2      ARG  30 -10.226  -6.517  -6.401
  202   1HH2  ARG  30          2HH1      ARG  30  -8.563  -3.516  -5.841
  203   2HH2  ARG  30          1HH1      ARG  30  -8.584  -4.988  -6.755
  204    H    LEU  31           H        LEU  31 -10.001  -1.385   2.304
  205    HA   LEU  31           HA       LEU  31  -9.040   0.879   0.609
  206   1HB   LEU  31          2HB       LEU  31 -10.580   0.871   3.213
  207   2HB   LEU  31          1HB       LEU  31  -9.815   2.318   2.557
  208    HG   LEU  31           HG       LEU  31 -11.787   0.635   0.988
  209   1HD1  LEU  31          1HD1      LEU  31 -12.291   3.183   2.558
  210   2HD1  LEU  31          2HD1      LEU  31 -12.861   1.577   3.014
  211   3HD1  LEU  31          3HD1      LEU  31 -13.463   2.341   1.544
  212   1HD2  LEU  31          1HD2      LEU  31 -10.259   2.073  -0.326
  213   2HD2  LEU  31          2HD2      LEU  31 -10.743   3.467   0.639
  214   3HD2  LEU  31          3HD2      LEU  31 -11.915   2.672  -0.409
  215    H    ARG  32           H        ARG  32  -8.096  -1.385   2.972
  216    HA   ARG  32           HA       ARG  32  -6.108   0.312   4.301
  217   1HB   ARG  32          2HB       ARG  32  -7.112  -1.491   5.589
  218   2HB   ARG  32          1HB       ARG  32  -6.646  -2.675   4.371
  219   1HG   ARG  32          2HG       ARG  32  -4.919  -2.975   5.876
  220   2HG   ARG  32          1HG       ARG  32  -4.213  -1.709   4.872
  221   1HD   ARG  32          2HD       ARG  32  -5.190  -0.019   6.487
  222   2HD   ARG  32          1HD       ARG  32  -5.608  -1.374   7.537
  223    HE   ARG  32           HE       ARG  32  -3.220  -1.815   7.825
  224   1HH1  ARG  32          1HH2      ARG  32  -2.085  -0.764   5.320
  225   2HH1  ARG  32          2HH2      ARG  32  -1.399   0.751   5.804
  226   1HH2  ARG  32          2HH1      ARG  32  -3.196   0.914   8.776
  227   2HH2  ARG  32          1HH1      ARG  32  -2.032   1.707   7.768
  228    H    CYS  33           H        CYS  33  -4.013   0.570   3.613
  229    HA   CYS  33           HA       CYS  33  -3.209  -0.748   1.099
  230   1HB   CYS  33          2HB       CYS  33  -2.365   1.636   2.630
  231   2HB   CYS  33          1HB       CYS  33  -1.051   0.763   1.842
  232    H    THR  34           H        THR  34  -2.549  -2.829   1.446
  233    HA   THR  34           HA       THR  34  -0.765  -3.410   3.749
  234    HB   THR  34           HB       THR  34  -2.159  -5.284   1.811
  235    HG1  THR  34           HG1      THR  34  -3.786  -4.980   3.080
  236   1HG2  THR  34          1HG2      THR  34  -0.136  -6.290   2.745
  237   2HG2  THR  34          2HG2      THR  34  -1.554  -7.013   3.505
  238   3HG2  THR  34          3HG2      THR  34  -0.614  -5.796   4.370
  239    H    CYS  35           H        CYS  35   1.364  -3.193   3.316
  240    HA   CYS  35           HA       CYS  35   2.362  -3.795   0.566
  241   1HB   CYS  35          2HB       CYS  35   3.870  -2.352   2.754
  242   2HB   CYS  35          1HB       CYS  35   4.210  -2.356   1.025
  243    H    TYR  36           H        TYR  36   4.101  -5.270   0.307
  244    HA   TYR  36           HA       TYR  36   4.649  -6.950   2.718
  245   1HB   TYR  36          2HB       TYR  36   5.383  -8.667   0.908
  246   2HB   TYR  36          1HB       TYR  36   3.662  -8.394   1.157
  247    HD1  TYR  36           HD1      TYR  36   2.302  -7.287  -0.516
  248    HD2  TYR  36           HD2      TYR  36   6.542  -7.718  -1.062
  249    HE1  TYR  36           HE1      TYR  36   2.059  -6.642  -2.898
  250    HE2  TYR  36           HE2      TYR  36   6.297  -7.072  -3.444
  251    HH   TYR  36           HH       TYR  36   4.742  -5.855  -4.872
  252    H    ARG  37           H        ARG  37   6.809  -7.741   3.040
  253    HA   ARG  37           HA       ARG  37   8.862  -5.786   2.544
  254   1HB   ARG  37          2HB       ARG  37   8.934  -8.607   3.623
  255   2HB   ARG  37          1HB       ARG  37  10.381  -7.612   3.477
  256   1HG   ARG  37          2HG       ARG  37   9.338  -5.881   4.897
  257   2HG   ARG  37          1HG       ARG  37   7.892  -6.880   5.049
  258   1HD   ARG  37          2HD       ARG  37   9.124  -7.362   7.011
  259   2HD   ARG  37          1HD       ARG  37   9.489  -8.713   5.937
  260    HE   ARG  37           HE       ARG  37  11.339  -6.392   6.344
  261   1HH1  ARG  37          2HH1      ARG  37  11.754  -9.017   7.815
  262   2HH1  ARG  37          1HH1      ARG  37  12.914  -9.803   6.798
  263   1HH2  ARG  37          1HH2      ARG  37  12.362  -7.688   4.093
  264   2HH2  ARG  37          2HH2      ARG  37  13.258  -9.049   4.681
  265    H    CYS  38           H        CYS  38  10.569  -5.821   1.083
  266    HA   CYS  38           HA       CYS  38  10.177  -7.340  -1.376
  267   1HB   CYS  38          2HB       CYS  38  11.216  -4.931  -0.984
  268   2HB   CYS  38          1HB       CYS  38  12.712  -5.846  -0.805
  269    H    GLY  39           HN       GLY  39  11.467  -9.037  -2.158
  270   1HA   GLY  39          2HA       GLY  39  12.997 -10.513  -0.100
  271   2HA   GLY  39          1HA       GLY  39  12.489 -11.150  -1.664
  Start of MODEL   12
    1   1H    GLY   1          1H        GLY   1  -7.586   3.585   2.041
    2   2H    GLY   1          2H        GLY   1  -8.415   4.881   1.317
    3   3H    GLY   1          3H        GLY   1  -8.655   4.528   2.962
    4   1HA   GLY   1          2HA       GLY   1  -7.144   6.487   2.369
    5   2HA   GLY   1          1HA       GLY   1  -6.593   5.346   3.594
    6    H    PHE   2           H        PHE   2  -4.663   6.776   2.358
    7    HA   PHE   2           HA       PHE   2  -2.664   6.600   1.145
    8   1HB   PHE   2          2HB       PHE   2  -3.242   3.625   1.165
    9   2HB   PHE   2          1HB       PHE   2  -1.669   4.403   1.016
   10    HD1  PHE   2           HD1      PHE   2  -4.002   2.963   3.276
   11    HD2  PHE   2           HD2      PHE   2  -0.987   6.010   2.987
   12    HE1  PHE   2           HE1      PHE   2  -3.778   2.976   5.746
   13    HE2  PHE   2           HE2      PHE   2  -0.764   6.022   5.457
   14    HZ   PHE   2           HZ       PHE   2  -2.159   4.505   6.836
   15    H    GLY   3           H        GLY   3  -5.260   6.824  -0.341
   16   1HA   GLY   3          2HA       GLY   3  -5.854   6.973  -2.599
   17   2HA   GLY   3          1HA       GLY   3  -4.222   6.446  -3.008
   18    H    CYS   4           H        CYS   4  -6.955   4.896  -1.265
   19    HA   CYS   4           HA       CYS   4  -6.549   2.507  -3.012
   20   1HB   CYS   4          2HB       CYS   4  -7.390   2.845  -0.156
   21   2HB   CYS   4          1HB       CYS   4  -8.011   1.462  -1.056
   22    HA   PRO   5           HA       PRO   5  -7.720   0.611  -3.046
   23   1HB   PRO   5          2HB       PRO   5  -8.931  -0.657  -5.157
   24   2HB   PRO   5          1HB       PRO   5  -9.566  -0.677  -3.503
   25   1HG   PRO   5          2HG       PRO   5 -10.562   0.823  -5.873
   26   2HG   PRO   5          1HG       PRO   5 -11.439   0.301  -4.426
   27   1HD   PRO   5          2HD       PRO   5 -10.471   2.924  -4.959
   28   2HD   PRO   5          1HD       PRO   5 -11.126   2.331  -3.417
   29    H    ASN   6           H        ASN   6  -7.372   3.198  -4.931
   30    HA   ASN   6           HA       ASN   6  -6.444   2.441  -7.469
   31   1HB   ASN   6          2HB       ASN   6  -6.611   4.801  -6.379
   32   2HB   ASN   6          1HB       ASN   6  -4.967   4.493  -5.827
   33   1HD2  ASN   6          1HD2      ASN   6  -6.596   5.968  -8.307
   34   2HD2  ASN   6          2HD2      ASN   6  -5.450   5.794  -9.546
   35    H    ASN   7           H        ASN   7  -4.990   0.887  -7.957
   36    HA   ASN   7           HA       ASN   7  -3.111  -0.208  -6.076
   37   1HB   ASN   7          2HB       ASN   7  -3.121  -0.441  -9.102
   38   2HB   ASN   7          1HB       ASN   7  -2.243  -1.486  -7.988
   39   1HD2  ASN   7          1HD2      ASN   7  -4.540  -1.513  -6.000
   40   2HD2  ASN   7          2HD2      ASN   7  -5.714  -2.517  -6.701
   41    H    TYR   8           H        TYR   8  -2.812   2.245  -8.624
   42    HA   TYR   8           HA       TYR   8   0.057   2.425  -8.556
   43   1HB   TYR   8          2HB       TYR   8  -0.967   3.411 -10.449
   44   2HB   TYR   8          1HB       TYR   8  -2.144   4.281  -9.469
   45    HD1  TYR   8           HD1      TYR   8  -1.784   6.546  -9.073
   46    HD2  TYR   8           HD2      TYR   8   1.582   4.007  -9.891
   47    HE1  TYR   8           HE1      TYR   8  -0.281   8.516  -8.998
   48    HE2  TYR   8           HE2      TYR   8   3.086   5.976  -9.816
   49    HH   TYR   8           HH       TYR   8   2.658   8.633 -10.249
   50    H    GLN   9           H        GLN   9  -2.486   4.393  -6.969
   51    HA   GLN   9           HA       GLN   9  -0.684   6.032  -5.466
   52   1HB   GLN   9          2HB       GLN   9  -3.549   5.240  -4.862
   53   2HB   GLN   9          1HB       GLN   9  -2.668   6.537  -4.055
   54   1HG   GLN   9          2HG       GLN   9  -2.905   6.492  -7.060
   55   2HG   GLN   9          1HG       GLN   9  -4.204   7.153  -6.069
   56   1HE2  GLN   9          1HE2      GLN   9  -3.719   9.084  -4.761
   57   2HE2  GLN   9          2HE2      GLN   9  -2.363  10.048  -5.105
   58    H    CYS  10           H        CYS  10  -2.311   2.958  -4.685
   59    HA   CYS  10           HA       CYS  10  -1.395   2.782  -1.976
   60   1HB   CYS  10          2HB       CYS  10  -3.181   1.351  -3.164
   61   2HB   CYS  10          1HB       CYS  10  -1.831   0.397  -3.774
   62    H    HIS  11           H        HIS  11  -0.005   1.693  -5.061
   63    HA   HIS  11           HA       HIS  11   2.251   0.317  -3.961
   64   1HB   HIS  11          2HB       HIS  11   1.587   0.022  -6.304
   65   2HB   HIS  11          1HB       HIS  11   1.942   1.717  -6.637
   66    HD1  HIS  11           HD1      HIS  11   3.757  -1.395  -5.376
   67    HD2  HIS  11           HD2      HIS  11   4.567   2.154  -7.404
   68    HE1  HIS  11           HE1      HIS  11   6.199  -1.490  -6.040
   69    H    ARG  12           H        ARG  12   1.852   3.704  -5.064
   70    HA   ARG  12           HA       ARG  12   4.529   4.550  -4.606
   71   1HB   ARG  12          2HB       ARG  12   2.246   5.770  -5.525
   72   2HB   ARG  12          1HB       ARG  12   2.452   6.543  -3.952
   73   1HG   ARG  12          2HG       ARG  12   5.019   6.352  -5.234
   74   2HG   ARG  12          1HG       ARG  12   3.875   7.087  -6.356
   75   1HD   ARG  12          2HD       ARG  12   3.578   8.119  -3.634
   76   2HD   ARG  12          1HD       ARG  12   5.192   8.397  -4.285
   77    HE   ARG  12           HE       ARG  12   4.247   9.855  -5.913
   78   1HH1  ARG  12          1HH2      ARG  12   1.981   8.218  -6.867
   79   2HH1  ARG  12          2HH2      ARG  12   0.599   9.082  -6.282
   80   1HH2  ARG  12          2HH1      ARG  12   2.424  10.937  -3.969
   81   2HH2  ARG  12          1HH1      ARG  12   0.853  10.627  -4.626
   82    H    HIS  13           H        HIS  13   1.766   4.285  -2.390
   83    HA   HIS  13           HA       HIS  13   2.996   5.573  -0.139
   84   1HB   HIS  13          2HB       HIS  13   0.598   5.184  -0.143
   85   2HB   HIS  13          1HB       HIS  13   0.837   3.444  -0.299
   86    HD1  HIS  13           HD1      HIS  13   1.999   6.165   2.130
   87    HD2  HIS  13           HD2      HIS  13   0.684   2.211   2.153
   88    HE1  HIS  13           HE1      HIS  13   1.958   5.440   4.556
   89    H    CYS  14           H        CYS  14   2.915   2.181  -1.234
   90    HA   CYS  14           HA       CYS  14   4.399   1.113   0.990
   91   1HB   CYS  14          2HB       CYS  14   4.063   0.107  -1.852
   92   2HB   CYS  14          1HB       CYS  14   4.811  -0.821  -0.553
   93    H    LYS  15           H        LYS  15   5.327   2.599  -2.077
   94    HA   LYS  15           HA       LYS  15   8.086   1.868  -2.097
   95   1HB   LYS  15          2HB       LYS  15   6.557   4.203  -3.256
   96   2HB   LYS  15          1HB       LYS  15   8.306   4.069  -3.441
   97   1HG   LYS  15          2HG       LYS  15   7.650   1.584  -4.193
   98   2HG   LYS  15          1HG       LYS  15   6.139   2.386  -4.621
   99   1HD   LYS  15          2HD       LYS  15   7.077   3.371  -6.420
  100   2HD   LYS  15          1HD       LYS  15   8.441   3.955  -5.466
  101   1HE   LYS  15          2HE       LYS  15   8.252   1.061  -6.300
  102   2HE   LYS  15          1HE       LYS  15   8.939   2.275  -7.377
  103   1HZ   LYS  15          1HZ       LYS  15  10.761   1.498  -6.204
  104   2HZ   LYS  15          2HZ       LYS  15   9.909   1.381  -4.738
  105   3HZ   LYS  15          3HZ       LYS  15  10.352   2.905  -5.347
  106    H    SER  16           H        SER  16   6.379   4.613  -0.574
  107    HA   SER  16           HA       SER  16   8.816   5.829   0.431
  108   1HB   SER  16          2HB       SER  16   7.185   7.106   1.924
  109   2HB   SER  16          1HB       SER  16   6.949   7.294   0.190
  110    HG   SER  16           HG       SER  16   5.489   5.714   2.032
  111    H    ILE  17           H        ILE  17   6.660   3.307   1.574
  112    HA   ILE  17           HA       ILE  17   7.522   3.383   4.344
  113    HB   ILE  17           HB       ILE  17   6.214   1.175   2.720
  114   1HG1  ILE  17          2HG1      ILE  17   5.021   3.003   4.825
  115   2HG1  ILE  17          1HG1      ILE  17   4.938   3.343   3.097
  116   1HG2  ILE  17          1HG2      ILE  17   5.728   0.111   4.866
  117   2HG2  ILE  17          2HG2      ILE  17   6.533   1.420   5.730
  118   3HG2  ILE  17          3HG2      ILE  17   7.471   0.329   4.709
  119   1HD1  ILE  17          1HD1      ILE  17   3.378   1.722   2.722
  120   2HD1  ILE  17          2HD1      ILE  17   3.059   1.897   4.447
  121   3HD1  ILE  17          3HD1      ILE  17   4.117   0.608   3.873
  122    HA   PRO  18           HA       PRO  18  11.437   1.417   3.635
  123   1HB   PRO  18          2HB       PRO  18  12.116   1.192   6.291
  124   2HB   PRO  18          1HB       PRO  18  12.238   2.699   5.369
  125   1HG   PRO  18          2HG       PRO  18  10.222   1.912   7.420
  126   2HG   PRO  18          1HG       PRO  18  10.774   3.529   6.952
  127   1HD   PRO  18          2HD       PRO  18   8.349   2.311   6.152
  128   2HD   PRO  18          1HD       PRO  18   9.070   3.771   5.440
  129    H    GLY  19           H        GLY  19  12.152  -0.713   3.564
  130   1HA   GLY  19          2HA       GLY  19  12.288  -3.013   4.127
  131   2HA   GLY  19          1HA       GLY  19  11.086  -2.751   5.387
  132    H    ARG  20           H        ARG  20  10.082  -1.437   2.391
  133    HA   ARG  20           HA       ARG  20   8.615  -3.940   1.688
  134   1HB   ARG  20          2HB       ARG  20   7.350  -1.195   1.587
  135   2HB   ARG  20          1HB       ARG  20   6.555  -2.755   1.400
  136   1HG   ARG  20          2HG       ARG  20   8.006  -2.085   3.958
  137   2HG   ARG  20          1HG       ARG  20   6.357  -1.522   3.692
  138   1HD   ARG  20          2HD       ARG  20   6.099  -4.125   2.952
  139   2HD   ARG  20          1HD       ARG  20   7.360  -4.269   4.174
  140    HE   ARG  20           HE       ARG  20   4.575  -3.391   4.655
  141   1HH1  ARG  20          2HH1      ARG  20   6.668  -1.710   6.146
  142   2HH1  ARG  20          1HH1      ARG  20   6.750  -2.555   7.656
  143   1HH2  ARG  20          1HH2      ARG  20   5.161  -5.402   6.454
  144   2HH2  ARG  20          2HH2      ARG  20   5.893  -4.647   7.832
  145    H    CYS  21           H        CYS  21   8.150  -4.167  -0.547
  146    HA   CYS  21           HA       CYS  21   9.705  -2.327  -2.314
  147   1HB   CYS  21          2HB       CYS  21   9.569  -5.172  -2.157
  148   2HB   CYS  21          1HB       CYS  21   8.842  -4.693  -3.690
  149    H    GLY  22           H        GLY  22   6.700  -4.272  -2.318
  150   1HA   GLY  22          2HA       GLY  22   5.359  -2.049  -3.780
  151   2HA   GLY  22          1HA       GLY  22   5.200  -3.702  -4.375
  152    H    GLY  23           H        GLY  23   2.822  -2.792  -3.860
  153   1HA   GLY  23          2HA       GLY  23   1.929  -4.283  -1.530
  154   2HA   GLY  23          1HA       GLY  23   1.766  -2.547  -1.301
  155    H    TYR  24           H        TYR  24  -0.560  -3.488  -1.146
  156    HA   TYR  24           HA       TYR  24  -1.936  -2.818  -3.653
  157   1HB   TYR  24          2HB       TYR  24  -3.140  -4.917  -3.857
  158   2HB   TYR  24          1HB       TYR  24  -1.415  -5.280  -3.836
  159    HD1  TYR  24           HD1      TYR  24  -0.338  -6.098  -1.704
  160    HD2  TYR  24           HD2      TYR  24  -4.595  -5.694  -2.126
  161    HE1  TYR  24           HE1      TYR  24  -0.675  -7.544   0.281
  162    HE2  TYR  24           HE2      TYR  24  -4.929  -7.141  -0.143
  163    HH   TYR  24           HH       TYR  24  -3.276  -9.110   0.996
  164    H    CYS  25           H        CYS  25  -4.344  -2.729  -3.280
  165    HA   CYS  25           HA       CYS  25  -4.899  -1.730  -0.558
  166   1HB   CYS  25          2HB       CYS  25  -6.519  -1.728  -3.118
  167   2HB   CYS  25          1HB       CYS  25  -7.126  -1.104  -1.584
  168    H    GLY  26           H        GLY  26  -5.569  -3.174   0.941
  169   1HA   GLY  26          2HA       GLY  26  -7.851  -4.869   0.588
  170   2HA   GLY  26          1HA       GLY  26  -6.386  -5.838   0.434
  171    H    GLY  27           H        GLY  27  -8.497  -5.751   2.586
  172   1HA   GLY  27          2HA       GLY  27  -7.609  -6.563   4.858
  173   2HA   GLY  27          1HA       GLY  27  -6.766  -5.015   4.912
  174    H    TRP  28           H        TRP  28  -8.095  -3.055   4.947
  175    HA   TRP  28           HA       TRP  28 -10.652  -3.510   6.383
  176   1HB   TRP  28          2HB       TRP  28  -8.892  -2.027   7.393
  177   2HB   TRP  28          1HB       TRP  28  -9.101  -0.927   6.032
  178    HD1  TRP  28           HD1      TRP  28 -11.064  -2.402   8.998
  179    HE1  TRP  28           HE1      TRP  28 -12.973  -0.781   9.597
  180    HE3  TRP  28           HE3      TRP  28 -10.582   0.979   5.199
  181    HZ2  TRP  28           HZ2      TRP  28 -14.142   1.630   8.603
  182    HZ3  TRP  28           HZ3      TRP  28 -12.107   2.926   5.052
  183    HH2  TRP  28           HH2      TRP  28 -13.885   3.254   6.746
  184    H    HIS  29           H        HIS  29 -12.056  -3.944   4.654
  185    HA   HIS  29           HA       HIS  29 -13.505  -3.459   2.887
  186   1HB   HIS  29          2HB       HIS  29 -12.921  -0.588   3.681
  187   2HB   HIS  29          1HB       HIS  29 -14.324  -1.157   2.780
  188    HD1  HIS  29           HD1      HIS  29 -14.345   0.233   5.688
  189    HD2  HIS  29           HD2      HIS  29 -14.771  -3.835   4.896
  190    HE1  HIS  29           HE1      HIS  29 -15.505  -0.771   7.703
  191    H    ARG  30           H        ARG  30 -10.630  -3.719   2.296
  192    HA   ARG  30           HA       ARG  30  -9.158  -3.427   0.501
  193   1HB   ARG  30          2HB       ARG  30 -11.275  -4.087  -0.729
  194   2HB   ARG  30          1HB       ARG  30 -11.580  -2.370  -0.982
  195   1HG   ARG  30          2HG       ARG  30  -9.846  -2.136  -2.479
  196   2HG   ARG  30          1HG       ARG  30  -8.874  -3.390  -1.710
  197   1HD   ARG  30          2HD       ARG  30 -11.424  -4.257  -2.982
  198   2HD   ARG  30          1HD       ARG  30 -10.112  -3.782  -4.062
  199    HE   ARG  30           HE       ARG  30  -9.175  -5.596  -2.008
  200   1HH1  ARG  30          1HH2      ARG  30  -8.149  -5.809  -4.737
  201   2HH1  ARG  30          2HH2      ARG  30  -8.960  -7.204  -5.368
  202   1HH2  ARG  30          2HH1      ARG  30 -11.424  -7.203  -2.915
  203   2HH2  ARG  30          1HH1      ARG  30 -10.820  -7.997  -4.331
  204    H    LEU  31           H        LEU  31  -9.697  -1.174   2.410
  205    HA   LEU  31           HA       LEU  31  -8.957   1.123   0.652
  206   1HB   LEU  31          2HB       LEU  31 -10.291   1.035   3.367
  207   2HB   LEU  31          1HB       LEU  31  -9.664   2.521   2.654
  208    HG   LEU  31           HG       LEU  31 -11.625   0.724   1.211
  209   1HD1  LEU  31          1HD1      LEU  31 -12.197   3.178   2.898
  210   2HD1  LEU  31          2HD1      LEU  31 -12.646   1.522   3.310
  211   3HD1  LEU  31          3HD1      LEU  31 -13.375   2.312   1.913
  212   1HD2  LEU  31          1HD2      LEU  31 -10.337   2.278  -0.194
  213   2HD2  LEU  31          2HD2      LEU  31 -10.786   3.621   0.857
  214   3HD2  LEU  31          3HD2      LEU  31 -12.019   2.801  -0.099
  215    H    ARG  32           H        ARG  32  -7.752  -1.045   3.034
  216    HA   ARG  32           HA       ARG  32  -5.686   0.814   4.020
  217   1HB   ARG  32          2HB       ARG  32  -6.744  -0.954   5.488
  218   2HB   ARG  32          1HB       ARG  32  -5.926  -2.170   4.506
  219   1HG   ARG  32          2HG       ARG  32  -3.774  -1.430   5.175
  220   2HG   ARG  32          1HG       ARG  32  -4.402   0.098   5.794
  221   1HD   ARG  32          2HD       ARG  32  -5.307  -2.522   6.976
  222   2HD   ARG  32          1HD       ARG  32  -3.804  -1.768   7.507
  223    HE   ARG  32           HE       ARG  32  -6.389  -0.267   7.621
  224   1HH1  ARG  32          1HH2      ARG  32  -3.584   0.747   8.477
  225   2HH1  ARG  32          2HH2      ARG  32  -3.721   0.614  10.199
  226   1HH2  ARG  32          2HH1      ARG  32  -6.541  -1.414  10.080
  227   2HH2  ARG  32          1HH1      ARG  32  -5.401  -0.615  11.108
  228    H    CYS  33           H        CYS  33  -3.487   0.664   3.464
  229    HA   CYS  33           HA       CYS  33  -2.938  -0.775   0.929
  230   1HB   CYS  33          2HB       CYS  33  -1.788   1.588   2.322
  231   2HB   CYS  33          1HB       CYS  33  -0.662   0.603   1.386
  232    H    THR  34           H        THR  34  -2.294  -2.852   1.279
  233    HA   THR  34           HA       THR  34  -0.546  -3.460   3.600
  234    HB   THR  34           HB       THR  34  -1.981  -5.278   1.638
  235    HG1  THR  34           HG1      THR  34  -2.440  -4.705   4.383
  236   1HG2  THR  34          1HG2      THR  34  -1.366  -7.039   3.368
  237   2HG2  THR  34          2HG2      THR  34  -0.245  -5.858   4.047
  238   3HG2  THR  34          3HG2      THR  34  -0.024  -6.436   2.395
  239    H    CYS  35           H        CYS  35   1.593  -3.244   3.198
  240    HA   CYS  35           HA       CYS  35   2.620  -3.761   0.452
  241   1HB   CYS  35          2HB       CYS  35   4.207  -2.575   2.728
  242   2HB   CYS  35          1HB       CYS  35   4.484  -2.408   0.995
  243    H    TYR  36           H        TYR  36   4.393  -5.184   0.119
  244    HA   TYR  36           HA       TYR  36   4.841  -7.125   2.352
  245   1HB   TYR  36          2HB       TYR  36   5.566  -8.644   0.334
  246   2HB   TYR  36          1HB       TYR  36   3.855  -8.426   0.686
  247    HD1  TYR  36           HD1      TYR  36   6.638  -7.375  -1.535
  248    HD2  TYR  36           HD2      TYR  36   2.403  -7.233  -0.817
  249    HE1  TYR  36           HE1      TYR  36   6.280  -6.451  -3.809
  250    HE2  TYR  36           HE2      TYR  36   2.048  -6.308  -3.088
  251    HH   TYR  36           HH       TYR  36   3.389  -6.416  -5.350
  252    H    ARG  37           H        ARG  37   6.998  -8.097   2.469
  253    HA   ARG  37           HA       ARG  37   9.113  -6.148   2.270
  254   1HB   ARG  37          2HB       ARG  37   8.927  -9.039   3.030
  255   2HB   ARG  37          1HB       ARG  37  10.520  -8.359   2.688
  256   1HG   ARG  37          2HG       ARG  37  10.266  -6.686   4.389
  257   2HG   ARG  37          1HG       ARG  37   8.558  -7.071   4.600
  258   1HD   ARG  37          2HD       ARG  37  10.354  -9.379   4.950
  259   2HD   ARG  37          1HD       ARG  37  10.594  -8.098   6.138
  260    HE   ARG  37           HE       ARG  37   7.785  -8.652   5.851
  261   1HH1  ARG  37          2HH1      ARG  37   9.700  -8.421   8.332
  262   2HH1  ARG  37          1HH1      ARG  37   9.405  -9.961   9.067
  263   1HH2  ARG  37          1HH2      ARG  37   7.841 -11.295   6.264
  264   2HH2  ARG  37          2HH2      ARG  37   8.348 -11.594   7.892
  265    H    CYS  38           H        CYS  38  11.084  -6.372   0.995
  266    HA   CYS  38           HA       CYS  38  10.495  -7.262  -1.763
  267   1HB   CYS  38          2HB       CYS  38  11.666  -5.018  -0.963
  268   2HB   CYS  38          1HB       CYS  38  13.110  -6.028  -0.987
  269    H    GLY  39           HN       GLY  39  11.184  -9.196  -2.500
  270   1HA   GLY  39          2HA       GLY  39  13.102 -10.769  -0.886
  271   2HA   GLY  39          1HA       GLY  39  12.123 -11.386  -2.218
  Start of MODEL   13
    1   1H    GLY   1          1H        GLY   1  -7.439   3.280   2.329
    2   2H    GLY   1          2H        GLY   1  -8.480   4.413   1.607
    3   3H    GLY   1          3H        GLY   1  -8.582   4.104   3.275
    4   1HA   GLY   1          2HA       GLY   1  -7.375   6.222   2.459
    5   2HA   GLY   1          1HA       GLY   1  -6.680   5.274   3.772
    6    H    PHE   2           H        PHE   2  -4.922   6.791   2.452
    7    HA   PHE   2           HA       PHE   2  -2.900   6.761   1.277
    8   1HB   PHE   2          2HB       PHE   2  -3.262   3.757   1.532
    9   2HB   PHE   2          1HB       PHE   2  -1.760   4.574   1.100
   10    HD1  PHE   2           HD1      PHE   2  -3.395   3.067   3.745
   11    HD2  PHE   2           HD2      PHE   2  -1.263   6.678   2.816
   12    HE1  PHE   2           HE1      PHE   2  -2.879   3.383   6.149
   13    HE2  PHE   2           HE2      PHE   2  -0.746   6.993   5.220
   14    HZ   PHE   2           HZ       PHE   2  -1.555   5.345   6.887
   15    H    GLY   3           H        GLY   3  -5.322   6.949  -0.269
   16   1HA   GLY   3          2HA       GLY   3  -5.891   7.010  -2.537
   17   2HA   GLY   3          1HA       GLY   3  -4.273   6.415  -2.897
   18    H    CYS   4           H        CYS   4  -7.107   5.048  -1.171
   19    HA   CYS   4           HA       CYS   4  -6.792   2.593  -2.849
   20   1HB   CYS   4          2HB       CYS   4  -7.542   2.992   0.031
   21   2HB   CYS   4          1HB       CYS   4  -8.151   1.582  -0.834
   22    HA   PRO   5           HA       PRO   5  -8.042   0.712  -2.757
   23   1HB   PRO   5          2HB       PRO   5  -9.379  -0.558  -4.790
   24   2HB   PRO   5          1HB       PRO   5  -9.952  -0.512  -3.113
   25   1HG   PRO   5          2HG       PRO   5 -10.977   0.969  -5.485
   26   2HG   PRO   5          1HG       PRO   5 -11.820   0.515  -3.996
   27   1HD   PRO   5          2HD       PRO   5 -10.780   3.086  -4.623
   28   2HD   PRO   5          1HD       PRO   5 -11.394   2.550  -3.044
   29    H    ASN   6           H        ASN   6  -7.602   3.234  -4.674
   30    HA   ASN   6           HA       ASN   6  -6.806   2.384  -7.240
   31   1HB   ASN   6          2HB       ASN   6  -6.868   4.770  -6.279
   32   2HB   ASN   6          1HB       ASN   6  -5.261   4.429  -5.638
   33   1HD2  ASN   6          1HD2      ASN   6  -7.095   4.955  -8.620
   34   2HD2  ASN   6          2HD2      ASN   6  -5.742   5.068  -9.638
   35    H    ASN   7           H        ASN   7  -5.064   1.261  -8.020
   36    HA   ASN   7           HA       ASN   7  -3.353  -0.142  -6.111
   37   1HB   ASN   7          2HB       ASN   7  -3.671  -0.200  -9.108
   38   2HB   ASN   7          1HB       ASN   7  -2.326  -1.032  -8.327
   39   1HD2  ASN   7          1HD2      ASN   7  -5.747  -1.195  -8.985
   40   2HD2  ASN   7          2HD2      ASN   7  -6.046  -2.632  -8.135
   41    H    TYR   8           H        TYR   8  -2.811   2.289  -8.691
   42    HA   TYR   8           HA       TYR   8   0.024   2.430  -8.376
   43   1HB   TYR   8          2HB       TYR   8  -0.915   3.439 -10.334
   44   2HB   TYR   8          1HB       TYR   8  -2.005   4.444  -9.377
   45    HD1  TYR   8           HD1      TYR   8   1.675   3.736  -9.696
   46    HD2  TYR   8           HD2      TYR   8  -1.397   6.659  -9.005
   47    HE1  TYR   8           HE1      TYR   8   3.395   5.517  -9.576
   48    HE2  TYR   8           HE2      TYR   8   0.323   8.440  -8.890
   49    HH   TYR   8           HH       TYR   8   3.585   7.822  -8.509
   50    H    GLN   9           H        GLN   9  -2.546   4.497  -6.967
   51    HA   GLN   9           HA       GLN   9  -0.816   6.107  -5.377
   52   1HB   GLN   9          2HB       GLN   9  -3.708   5.307  -4.942
   53   2HB   GLN   9          1HB       GLN   9  -2.873   6.537  -3.995
   54   1HG   GLN   9          2HG       GLN   9  -3.109   6.628  -7.015
   55   2HG   GLN   9          1HG       GLN   9  -4.218   7.456  -5.925
   56   1HE2  GLN   9          1HE2      GLN   9  -1.936   8.404  -7.884
   57   2HE2  GLN   9          2HE2      GLN   9  -1.069   9.513  -6.936
   58    H    CYS  10           H        CYS  10  -2.559   3.093  -4.557
   59    HA   CYS  10           HA       CYS  10  -1.637   2.927  -1.852
   60   1HB   CYS  10          2HB       CYS  10  -3.491   1.553  -2.928
   61   2HB   CYS  10          1HB       CYS  10  -2.225   0.575  -3.667
   62    H    HIS  11           H        HIS  11  -0.328   1.671  -4.907
   63    HA   HIS  11           HA       HIS  11   1.877   0.221  -3.822
   64   1HB   HIS  11          2HB       HIS  11   0.958   0.276  -6.254
   65   2HB   HIS  11          1HB       HIS  11   1.996   1.685  -6.461
   66    HD1  HIS  11           HD1      HIS  11   2.051  -1.973  -6.449
   67    HD2  HIS  11           HD2      HIS  11   4.841   1.073  -5.897
   68    HE1  HIS  11           HE1      HIS  11   4.336  -3.037  -6.704
   69    H    ARG  12           H        ARG  12   1.646   3.610  -4.965
   70    HA   ARG  12           HA       ARG  12   4.357   4.336  -4.506
   71   1HB   ARG  12          2HB       ARG  12   2.270   5.643  -5.569
   72   2HB   ARG  12          1HB       ARG  12   2.226   6.352  -3.953
   73   1HG   ARG  12          2HG       ARG  12   4.781   6.705  -4.275
   74   2HG   ARG  12          1HG       ARG  12   4.447   6.450  -5.989
   75   1HD   ARG  12          2HD       ARG  12   3.455   8.477  -6.213
   76   2HD   ARG  12          1HD       ARG  12   2.571   8.309  -4.696
   77    HE   ARG  12           HE       ARG  12   4.766   8.970  -3.566
   78   1HH1  ARG  12          1HH2      ARG  12   3.395  11.285  -4.958
   79   2HH1  ARG  12          2HH2      ARG  12   4.710  11.995  -5.833
   80   1HH2  ARG  12          2HH1      ARG  12   6.767   9.212  -5.515
   81   2HH2  ARG  12          1HH1      ARG  12   6.625  10.816  -6.150
   82    H    HIS  13           H        HIS  13   1.551   4.360  -2.306
   83    HA   HIS  13           HA       HIS  13   2.834   5.619  -0.085
   84   1HB   HIS  13          2HB       HIS  13   0.440   5.369  -0.044
   85   2HB   HIS  13          1HB       HIS  13   0.556   3.622  -0.244
   86    HD1  HIS  13           HD1      HIS  13   1.952   6.167   2.256
   87    HD2  HIS  13           HD2      HIS  13   0.232   2.371   2.183
   88    HE1  HIS  13           HE1      HIS  13   1.820   5.395   4.665
   89    H    CYS  14           H        CYS  14   2.616   2.195  -1.049
   90    HA   CYS  14           HA       CYS  14   4.066   1.192   1.236
   91   1HB   CYS  14          2HB       CYS  14   3.477   0.041  -1.499
   92   2HB   CYS  14          1HB       CYS  14   4.357  -0.851  -0.259
   93    H    LYS  15           H        LYS  15   4.999   2.416  -1.935
   94    HA   LYS  15           HA       LYS  15   7.717   1.505  -1.930
   95   1HB   LYS  15          2HB       LYS  15   6.333   3.817  -3.305
   96   2HB   LYS  15          1HB       LYS  15   8.044   3.458  -3.547
   97   1HG   LYS  15          2HG       LYS  15   7.104   1.002  -3.971
   98   2HG   LYS  15          1HG       LYS  15   5.640   1.891  -4.388
   99   1HD   LYS  15          2HD       LYS  15   6.544   2.743  -6.295
  100   2HD   LYS  15          1HD       LYS  15   8.121   2.998  -5.545
  101   1HE   LYS  15          2HE       LYS  15   7.732   0.192  -5.652
  102   2HE   LYS  15          1HE       LYS  15   7.262   0.821  -7.231
  103   1HZ   LYS  15          1HZ       LYS  15   9.575   0.418  -7.309
  104   2HZ   LYS  15          2HZ       LYS  15   9.846   1.197  -5.822
  105   3HZ   LYS  15          3HZ       LYS  15   9.400   2.102  -7.191
  106    H    SER  16           H        SER  16   6.223   4.566  -0.796
  107    HA   SER  16           HA       SER  16   8.676   5.818  -0.013
  108   1HB   SER  16          2HB       SER  16   7.213   7.218   1.478
  109   2HB   SER  16          1HB       SER  16   6.666   7.155  -0.193
  110    HG   SER  16           HG       SER  16   5.608   5.927   2.105
  111    H    ILE  17           H        ILE  17   6.676   3.381   1.538
  112    HA   ILE  17           HA       ILE  17   7.875   3.636   4.171
  113    HB   ILE  17           HB       ILE  17   6.330   1.371   2.866
  114   1HG1  ILE  17          2HG1      ILE  17   5.346   3.133   5.093
  115   2HG1  ILE  17          1HG1      ILE  17   5.308   3.739   3.437
  116   1HG2  ILE  17          1HG2      ILE  17   7.812   0.582   4.712
  117   2HG2  ILE  17          2HG2      ILE  17   6.102   0.441   5.117
  118   3HG2  ILE  17          3HG2      ILE  17   7.060   1.761   5.787
  119   1HD1  ILE  17          1HD1      ILE  17   4.234   1.334   2.984
  120   2HD1  ILE  17          2HD1      ILE  17   3.249   2.707   3.487
  121   3HD1  ILE  17          3HD1      ILE  17   3.762   1.507   4.674
  122    HA   PRO  18           HA       PRO  18  11.641   1.566   3.074
  123   1HB   PRO  18          2HB       PRO  18  12.671   1.489   5.623
  124   2HB   PRO  18          1HB       PRO  18  12.678   2.937   4.601
  125   1HG   PRO  18          2HG       PRO  18  10.953   2.307   6.950
  126   2HG   PRO  18          1HG       PRO  18  11.448   3.884   6.312
  127   1HD   PRO  18          2HD       PRO  18   8.928   2.656   5.924
  128   2HD   PRO  18          1HD       PRO  18   9.555   4.058   5.032
  129    H    GLY  19           H        GLY  19  12.363  -0.567   3.068
  130   1HA   GLY  19          2HA       GLY  19  12.588  -2.816   3.823
  131   2HA   GLY  19          1HA       GLY  19  11.435  -2.478   5.112
  132    H    ARG  20           H        ARG  20  10.742  -1.664   1.750
  133    HA   ARG  20           HA       ARG  20   9.116  -4.093   1.372
  134   1HB   ARG  20          2HB       ARG  20   7.986  -1.435   2.028
  135   2HB   ARG  20          1HB       ARG  20   7.222  -2.276   0.681
  136   1HG   ARG  20          2HG       ARG  20   6.049  -3.417   2.240
  137   2HG   ARG  20          1HG       ARG  20   7.550  -4.280   2.572
  138   1HD   ARG  20          2HD       ARG  20   8.113  -2.310   4.146
  139   2HD   ARG  20          1HD       ARG  20   6.404  -1.901   4.022
  140    HE   ARG  20           HE       ARG  20   6.396  -4.598   4.683
  141   1HH1  ARG  20          1HH2      ARG  20   9.047  -3.583   5.986
  142   2HH1  ARG  20          2HH2      ARG  20   8.497  -3.306   7.604
  143   1HH2  ARG  20          2HH1      ARG  20   5.125  -3.441   6.759
  144   2HH2  ARG  20          1HH1      ARG  20   6.264  -3.231   8.045
  145    H    CYS  21           H        CYS  21   7.907  -3.876  -0.826
  146    HA   CYS  21           HA       CYS  21   9.620  -2.383  -2.767
  147   1HB   CYS  21          2HB       CYS  21   9.234  -5.248  -2.523
  148   2HB   CYS  21          1HB       CYS  21   8.691  -4.675  -4.101
  149    H    GLY  22           H        GLY  22   6.476  -4.042  -2.309
  150   1HA   GLY  22          2HA       GLY  22   5.205  -1.876  -3.896
  151   2HA   GLY  22          1HA       GLY  22   4.912  -3.543  -4.383
  152    H    GLY  23           H        GLY  23   2.624  -2.583  -3.864
  153   1HA   GLY  23          2HA       GLY  23   1.726  -3.806  -1.398
  154   2HA   GLY  23          1HA       GLY  23   1.684  -2.050  -1.286
  155    H    TYR  24           H        TYR  24  -0.678  -3.395  -1.070
  156    HA   TYR  24           HA       TYR  24  -2.140  -2.434  -3.447
  157   1HB   TYR  24          2HB       TYR  24  -3.325  -4.560  -3.790
  158   2HB   TYR  24          1HB       TYR  24  -1.591  -4.788  -4.005
  159    HD1  TYR  24           HD1      TYR  24  -4.518  -5.660  -2.026
  160    HD2  TYR  24           HD2      TYR  24  -0.227  -5.812  -2.154
  161    HE1  TYR  24           HE1      TYR  24  -4.526  -7.393  -0.252
  162    HE2  TYR  24           HE2      TYR  24  -0.235  -7.543  -0.381
  163    HH   TYR  24           HH       TYR  24  -2.475  -8.104   1.632
  164    H    CYS  25           H        CYS  25  -4.512  -2.397  -3.050
  165    HA   CYS  25           HA       CYS  25  -5.086  -1.749  -0.235
  166   1HB   CYS  25          2HB       CYS  25  -6.883  -1.626  -2.679
  167   2HB   CYS  25          1HB       CYS  25  -7.253  -0.957  -1.090
  168    H    GLY  26           H        GLY  26  -5.611  -3.431   1.086
  169   1HA   GLY  26          2HA       GLY  26  -7.860  -5.157   0.480
  170   2HA   GLY  26          1HA       GLY  26  -6.333  -6.031   0.361
  171    H    GLY  27           H        GLY  27  -8.709  -5.893   2.393
  172   1HA   GLY  27          2HA       GLY  27  -8.044  -6.948   4.648
  173   2HA   GLY  27          1HA       GLY  27  -7.052  -5.506   4.853
  174    H    TRP  28           H        TRP  28  -8.170  -3.424   4.961
  175    HA   TRP  28           HA       TRP  28 -10.740  -3.661   6.381
  176   1HB   TRP  28          2HB       TRP  28  -8.828  -2.180   7.169
  177   2HB   TRP  28          1HB       TRP  28  -9.175  -1.134   5.794
  178    HD1  TRP  28           HD1      TRP  28 -10.822  -2.485   8.997
  179    HE1  TRP  28           HE1      TRP  28 -12.678  -0.849   9.713
  180    HE3  TRP  28           HE3      TRP  28 -10.749   0.726   5.028
  181    HZ2  TRP  28           HZ2      TRP  28 -13.962   1.510   8.734
  182    HZ3  TRP  28           HZ3      TRP  28 -12.296   2.659   4.947
  183    HH2  TRP  28           HH2      TRP  28 -13.903   3.054   6.792
  184    H    HIS  29           H        HIS  29 -12.137  -4.221   4.639
  185    HA   HIS  29           HA       HIS  29 -13.624  -3.796   2.886
  186   1HB   HIS  29          2HB       HIS  29 -13.067  -0.881   3.509
  187   2HB   HIS  29          1HB       HIS  29 -14.512  -1.549   2.758
  188    HD1  HIS  29           HD1      HIS  29 -14.258   0.033   5.597
  189    HD2  HIS  29           HD2      HIS  29 -14.832  -4.056   5.038
  190    HE1  HIS  29           HE1      HIS  29 -15.273  -0.848   7.745
  191    H    ARG  30           H        ARG  30 -10.742  -4.035   2.286
  192    HA   ARG  30           HA       ARG  30  -9.301  -3.793   0.455
  193   1HB   ARG  30          2HB       ARG  30 -11.447  -4.454  -0.739
  194   2HB   ARG  30          1HB       ARG  30 -11.735  -2.737  -1.012
  195   1HG   ARG  30          2HG       ARG  30  -9.902  -2.521  -2.450
  196   2HG   ARG  30          1HG       ARG  30  -9.094  -3.945  -1.796
  197   1HD   ARG  30          2HD       ARG  30 -10.358  -5.414  -3.057
  198   2HD   ARG  30          1HD       ARG  30 -11.749  -4.332  -3.115
  199    HE   ARG  30           HE       ARG  30 -10.044  -2.935  -4.647
  200   1HH1  ARG  30          2HH1      ARG  30  -8.194  -5.192  -5.041
  201   2HH1  ARG  30          1HH1      ARG  30  -8.838  -5.994  -6.436
  202   1HH2  ARG  30          1HH2      ARG  30 -11.945  -4.450  -6.212
  203   2HH2  ARG  30          2HH2      ARG  30 -10.970  -5.569  -7.104
  204    H    LEU  31           H        LEU  31  -9.782  -1.533   2.355
  205    HA   LEU  31           HA       LEU  31  -9.053   0.751   0.571
  206   1HB   LEU  31          2HB       LEU  31 -10.348   0.777   3.311
  207   2HB   LEU  31          1HB       LEU  31  -9.863   2.216   2.417
  208    HG   LEU  31           HG       LEU  31 -11.714   0.165   1.202
  209   1HD1  LEU  31          1HD1      LEU  31 -13.609   1.506   1.963
  210   2HD1  LEU  31          2HD1      LEU  31 -12.519   2.621   2.788
  211   3HD1  LEU  31          3HD1      LEU  31 -12.679   0.960   3.358
  212   1HD2  LEU  31          1HD2      LEU  31 -11.113   3.096   0.709
  213   2HD2  LEU  31          2HD2      LEU  31 -12.432   2.227  -0.076
  214   3HD2  LEU  31          3HD2      LEU  31 -10.761   1.741  -0.364
  215    H    ARG  32           H        ARG  32  -7.906  -1.338   3.074
  216    HA   ARG  32           HA       ARG  32  -5.900   0.559   4.083
  217   1HB   ARG  32          2HB       ARG  32  -7.039  -1.424   5.373
  218   2HB   ARG  32          1HB       ARG  32  -5.812  -2.410   4.577
  219   1HG   ARG  32          2HG       ARG  32  -4.692   0.040   5.717
  220   2HG   ARG  32          1HG       ARG  32  -5.468  -0.969   6.936
  221   1HD   ARG  32          2HD       ARG  32  -4.149  -2.910   6.187
  222   2HD   ARG  32          1HD       ARG  32  -3.380  -1.917   4.948
  223    HE   ARG  32           HE       ARG  32  -2.985  -1.561   7.890
  224   1HH1  ARG  32          2HH1      ARG  32  -2.489   0.909   6.271
  225   2HH1  ARG  32          1HH1      ARG  32  -0.802   0.775   5.900
  226   1HH2  ARG  32          1HH2      ARG  32  -0.632  -2.609   6.703
  227   2HH2  ARG  32          2HH2      ARG  32   0.256  -1.230   6.146
  228    H    CYS  33           H        CYS  33  -3.732   0.583   3.485
  229    HA   CYS  33           HA       CYS  33  -3.070  -0.827   0.977
  230   1HB   CYS  33          2HB       CYS  33  -1.953   1.486   2.492
  231   2HB   CYS  33          1HB       CYS  33  -0.834   0.563   1.491
  232    H    THR  34           H        THR  34  -2.444  -2.914   1.293
  233    HA   THR  34           HA       THR  34  -0.751  -3.617   3.621
  234    HB   THR  34           HB       THR  34  -1.986  -5.354   1.456
  235    HG1  THR  34           HG1      THR  34  -3.679  -5.275   2.672
  236   1HG2  THR  34          1HG2      THR  34  -0.092  -5.882   3.658
  237   2HG2  THR  34          2HG2      THR  34  -0.416  -6.822   2.200
  238   3HG2  THR  34          3HG2      THR  34  -1.475  -6.973   3.602
  239    H    CYS  35           H        CYS  35   1.410  -3.350   3.343
  240    HA   CYS  35           HA       CYS  35   2.576  -3.633   0.614
  241   1HB   CYS  35          2HB       CYS  35   4.089  -2.665   3.034
  242   2HB   CYS  35          1HB       CYS  35   4.365  -2.286   1.335
  243    H    TYR  36           H        TYR  36   4.397  -5.036   0.278
  244    HA   TYR  36           HA       TYR  36   4.733  -7.107   2.410
  245   1HB   TYR  36          2HB       TYR  36   5.578  -8.483   0.300
  246   2HB   TYR  36          1HB       TYR  36   3.865  -8.385   0.693
  247    HD1  TYR  36           HD1      TYR  36   6.532  -7.169  -1.561
  248    HD2  TYR  36           HD2      TYR  36   2.331  -7.074  -0.662
  249    HE1  TYR  36           HE1      TYR  36   6.079  -6.147  -3.775
  250    HE2  TYR  36           HE2      TYR  36   1.880  -6.051  -2.874
  251    HH   TYR  36           HH       TYR  36   3.412  -6.157  -5.296
  252    H    ARG  37           H        ARG  37   6.814  -7.753   2.962
  253    HA   ARG  37           HA       ARG  37   8.935  -5.872   2.683
  254   1HB   ARG  37          2HB       ARG  37   8.893  -8.775   3.520
  255   2HB   ARG  37          1HB       ARG  37  10.375  -7.821   3.518
  256   1HG   ARG  37          2HG       ARG  37   9.559  -6.329   5.163
  257   2HG   ARG  37          1HG       ARG  37   7.889  -6.842   4.921
  258   1HD   ARG  37          2HD       ARG  37   9.322  -9.178   5.606
  259   2HD   ARG  37          1HD       ARG  37   9.872  -7.928   6.721
  260    HE   ARG  37           HE       ARG  37   7.358  -7.542   7.162
  261   1HH1  ARG  37          2HH1      ARG  37   6.593  -9.729   5.159
  262   2HH1  ARG  37          1HH1      ARG  37   6.259 -11.052   6.226
  263   1HH2  ARG  37          1HH2      ARG  37   7.844  -9.594   8.955
  264   2HH2  ARG  37          2HH2      ARG  37   6.972 -10.976   8.383
  265    H    CYS  38           H        CYS  38  10.728  -5.815   1.319
  266    HA   CYS  38           HA       CYS  38  10.467  -7.337  -1.204
  267   1HB   CYS  38          2HB       CYS  38  10.982  -4.789  -0.988
  268   2HB   CYS  38          1HB       CYS  38  12.629  -5.318  -0.647
  269    H    GLY  39           HN       GLY  39  11.594  -9.181  -1.507
  270   1HA   GLY  39          2HA       GLY  39  13.806  -9.868   0.332
  271   2HA   GLY  39          1HA       GLY  39  13.025 -10.971  -0.802
  Start of MODEL   14
    1   1H    GLY   1          1H        GLY   1  -7.400   3.344   2.273
    2   2H    GLY   1          2H        GLY   1  -8.347   4.443   1.388
    3   3H    GLY   1          3H        GLY   1  -8.544   4.312   3.070
    4   1HA   GLY   1          2HA       GLY   1  -7.246   6.301   2.250
    5   2HA   GLY   1          1HA       GLY   1  -6.502   5.333   3.522
    6    H    PHE   2           H        PHE   2  -4.760   6.783   2.130
    7    HA   PHE   2           HA       PHE   2  -2.796   6.678   0.862
    8   1HB   PHE   2          2HB       PHE   2  -3.218   3.678   0.837
    9   2HB   PHE   2          1HB       PHE   2  -1.694   4.551   0.699
   10    HD1  PHE   2           HD1      PHE   2  -3.743   2.771   2.914
   11    HD2  PHE   2           HD2      PHE   2  -1.266   6.277   2.732
   12    HE1  PHE   2           HE1      PHE   2  -3.498   2.728   5.380
   13    HE2  PHE   2           HE2      PHE   2  -1.022   6.232   5.199
   14    HZ   PHE   2           HZ       PHE   2  -2.137   4.456   6.523
   15    H    GLY   3           H        GLY   3  -5.466   6.803  -0.500
   16   1HA   GLY   3          2HA       GLY   3  -6.190   6.937  -2.719
   17   2HA   GLY   3          1HA       GLY   3  -4.546   6.550  -3.214
   18    H    CYS   4           H        CYS   4  -6.993   4.707  -1.350
   19    HA   CYS   4           HA       CYS   4  -6.469   2.385  -3.141
   20   1HB   CYS   4          2HB       CYS   4  -7.435   2.688  -0.318
   21   2HB   CYS   4          1HB       CYS   4  -7.898   1.249  -1.229
   22    HA   PRO   5           HA       PRO   5  -7.590   0.387  -3.002
   23   1HB   PRO   5          2HB       PRO   5  -8.749  -1.122  -4.977
   24   2HB   PRO   5          1HB       PRO   5  -9.400  -0.992  -3.334
   25   1HG   PRO   5          2HG       PRO   5 -10.420   0.221  -5.852
   26   2HG   PRO   5          1HG       PRO   5 -11.291  -0.160  -4.358
   27   1HD   PRO   5          2HD       PRO   5 -10.367   2.410  -5.180
   28   2HD   PRO   5          1HD       PRO   5 -11.049   1.981  -3.596
   29    H    ASN   6           H        ASN   6  -7.356   2.781  -5.164
   30    HA   ASN   6           HA       ASN   6  -6.303   1.645  -7.554
   31   1HB   ASN   6          2HB       ASN   6  -6.909   4.131  -6.942
   32   2HB   ASN   6          1HB       ASN   6  -5.221   4.219  -6.444
   33   1HD2  ASN   6          1HD2      ASN   6  -4.298   5.406  -8.178
   34   2HD2  ASN   6          2HD2      ASN   6  -4.378   4.915  -9.801
   35    H    ASN   7           H        ASN   7  -4.468   0.515  -7.878
   36    HA   ASN   7           HA       ASN   7  -2.556   0.054  -5.756
   37   1HB   ASN   7          2HB       ASN   7  -2.898  -0.838  -8.573
   38   2HB   ASN   7          1HB       ASN   7  -1.266  -0.921  -7.909
   39   1HD2  ASN   7          1HD2      ASN   7  -0.978  -2.233  -5.892
   40   2HD2  ASN   7          2HD2      ASN   7  -2.079  -3.477  -5.543
   41    H    TYR   8           H        TYR   8  -2.709   2.364  -8.396
   42    HA   TYR   8           HA       TYR   8   0.085   2.975  -8.556
   43   1HB   TYR   8          2HB       TYR   8  -1.465   3.754 -10.280
   44   2HB   TYR   8          1HB       TYR   8  -2.341   4.720  -9.094
   45    HD1  TYR   8           HD1      TYR   8   0.922   4.336 -10.841
   46    HD2  TYR   8           HD2      TYR   8  -1.556   6.870  -8.412
   47    HE1  TYR   8           HE1      TYR   8   2.485   6.224 -11.212
   48    HE2  TYR   8           HE2      TYR   8   0.007   8.755  -8.783
   49    HH   TYR   8           HH       TYR   8   1.935   9.128 -11.019
   50    H    GLN   9           H        GLN   9  -2.546   4.531  -6.688
   51    HA   GLN   9           HA       GLN   9  -0.702   6.257  -5.248
   52   1HB   GLN   9          2HB       GLN   9  -3.595   5.511  -4.718
   53   2HB   GLN   9          1HB       GLN   9  -2.701   6.735  -3.815
   54   1HG   GLN   9          2HG       GLN   9  -2.189   7.613  -6.301
   55   2HG   GLN   9          1HG       GLN   9  -3.734   6.820  -6.611
   56   1HE2  GLN   9          1HE2      GLN   9  -5.642   7.846  -5.822
   57   2HE2  GLN   9          2HE2      GLN   9  -5.622   9.298  -4.946
   58    H    CYS  10           H        CYS  10  -2.304   3.152  -4.635
   59    HA   CYS  10           HA       CYS  10  -1.527   2.859  -1.898
   60   1HB   CYS  10          2HB       CYS  10  -3.193   1.430  -3.235
   61   2HB   CYS  10          1HB       CYS  10  -1.786   0.577  -3.865
   62    H    HIS  11           H        HIS  11   0.057   1.893  -4.949
   63    HA   HIS  11           HA       HIS  11   2.320   0.611  -3.750
   64   1HB   HIS  11          2HB       HIS  11   1.704   0.369  -6.151
   65   2HB   HIS  11          1HB       HIS  11   2.162   2.051  -6.418
   66    HD1  HIS  11           HD1      HIS  11   3.894  -0.852  -4.622
   67    HD2  HIS  11           HD2      HIS  11   4.689   2.048  -7.509
   68    HE1  HIS  11           HE1      HIS  11   6.323  -1.141  -5.281
   69    H    ARG  12           H        ARG  12   1.655   3.985  -4.628
   70    HA   ARG  12           HA       ARG  12   4.261   5.055  -4.200
   71   1HB   ARG  12          2HB       ARG  12   1.732   6.079  -4.828
   72   2HB   ARG  12          1HB       ARG  12   2.135   6.835  -3.287
   73   1HG   ARG  12          2HG       ARG  12   3.616   8.199  -4.289
   74   2HG   ARG  12          1HG       ARG  12   4.462   6.821  -4.992
   75   1HD   ARG  12          2HD       ARG  12   2.117   6.998  -6.493
   76   2HD   ARG  12          1HD       ARG  12   2.593   8.679  -6.248
   77    HE   ARG  12           HE       ARG  12   4.182   6.622  -7.681
   78   1HH1  ARG  12          2HH1      ARG  12   6.052   8.342  -6.156
   79   2HH1  ARG  12          1HH1      ARG  12   6.330   9.665  -7.238
   80   1HH2  ARG  12          1HH2      ARG  12   3.557   8.969  -9.220
   81   2HH2  ARG  12          2HH2      ARG  12   4.913  10.020  -8.980
   82    H    HIS  13           H        HIS  13   1.540   4.542  -1.947
   83    HA   HIS  13           HA       HIS  13   2.799   5.661   0.367
   84   1HB   HIS  13          2HB       HIS  13   0.394   5.235   0.323
   85   2HB   HIS  13          1HB       HIS  13   0.673   3.506   0.126
   86    HD1  HIS  13           HD1      HIS  13   1.944   6.140   2.599
   87    HD2  HIS  13           HD2      HIS  13   0.375   2.279   2.567
   88    HE1  HIS  13           HE1      HIS  13   1.876   5.375   5.013
   89    H    CYS  14           H        CYS  14   2.624   2.279  -0.805
   90    HA   CYS  14           HA       CYS  14   4.210   1.168   1.313
   91   1HB   CYS  14          2HB       CYS  14   3.663   0.238  -1.516
   92   2HB   CYS  14          1HB       CYS  14   4.595  -0.712  -0.359
   93    H    LYS  15           H        LYS  15   5.043   2.678  -1.776
   94    HA   LYS  15           HA       LYS  15   7.788   1.918  -1.896
   95   1HB   LYS  15          2HB       LYS  15   6.142   4.130  -3.061
   96   2HB   LYS  15          1HB       LYS  15   7.898   4.283  -3.126
   97   1HG   LYS  15          2HG       LYS  15   7.609   1.700  -3.929
   98   2HG   LYS  15          1HG       LYS  15   6.111   2.393  -4.551
   99   1HD   LYS  15          2HD       LYS  15   7.192   3.580  -6.148
  100   2HD   LYS  15          1HD       LYS  15   8.458   4.093  -5.031
  101   1HE   LYS  15          2HE       LYS  15   8.416   1.231  -5.916
  102   2HE   LYS  15          1HE       LYS  15   9.007   2.449  -7.045
  103   1HZ   LYS  15          1HZ       LYS  15  10.886   1.807  -5.864
  104   2HZ   LYS  15          2HZ       LYS  15  10.063   1.737  -4.379
  105   3HZ   LYS  15          3HZ       LYS  15  10.419   3.241  -5.087
  106    H    SER  16           H        SER  16   6.210   4.750  -0.360
  107    HA   SER  16           HA       SER  16   8.693   5.895   0.575
  108   1HB   SER  16          2HB       SER  16   7.224   7.270   2.054
  109   2HB   SER  16          1HB       SER  16   6.716   7.300   0.369
  110    HG   SER  16           HG       SER  16   5.554   6.036   2.591
  111    H    ILE  17           H        ILE  17   6.545   3.412   1.824
  112    HA   ILE  17           HA       ILE  17   7.579   3.463   4.539
  113    HB   ILE  17           HB       ILE  17   6.057   1.335   2.999
  114   1HG1  ILE  17          2HG1      ILE  17   5.113   3.130   5.249
  115   2HG1  ILE  17          1HG1      ILE  17   4.958   3.583   3.552
  116   1HG2  ILE  17          1HG2      ILE  17   6.640   1.494   5.976
  117   2HG2  ILE  17          2HG2      ILE  17   7.436   0.384   4.859
  118   3HG2  ILE  17          3HG2      ILE  17   5.703   0.242   5.157
  119   1HD1  ILE  17          1HD1      ILE  17   3.054   2.196   4.897
  120   2HD1  ILE  17          2HD1      ILE  17   4.007   0.861   4.250
  121   3HD1  ILE  17          3HD1      ILE  17   3.305   2.054   3.158
  122    HA   PRO  18           HA       PRO  18  11.353   1.343   3.525
  123   1HB   PRO  18          2HB       PRO  18  12.301   1.265   6.104
  124   2HB   PRO  18          1HB       PRO  18  12.366   2.708   5.078
  125   1HG   PRO  18          2HG       PRO  18  10.572   2.127   7.383
  126   2HG   PRO  18          1HG       PRO  18  11.094   3.690   6.734
  127   1HD   PRO  18          2HD       PRO  18   8.577   2.449   6.297
  128   2HD   PRO  18          1HD       PRO  18   9.214   3.865   5.437
  129    H    GLY  19           H        GLY  19  11.901  -0.828   3.453
  130   1HA   GLY  19          2HA       GLY  19  12.115  -3.044   4.430
  131   2HA   GLY  19          1HA       GLY  19  10.751  -2.678   5.485
  132    H    ARG  20           H        ARG  20   9.315  -1.485   3.044
  133    HA   ARG  20           HA       ARG  20   8.432  -4.104   1.906
  134   1HB   ARG  20          2HB       ARG  20   6.694  -1.695   1.648
  135   2HB   ARG  20          1HB       ARG  20   6.247  -3.378   1.916
  136   1HG   ARG  20          2HG       ARG  20   7.588  -1.683   4.039
  137   2HG   ARG  20          1HG       ARG  20   5.839  -1.801   3.877
  138   1HD   ARG  20          2HD       ARG  20   7.269  -4.394   3.900
  139   2HD   ARG  20          1HD       ARG  20   7.340  -3.489   5.411
  140    HE   ARG  20           HE       ARG  20   5.080  -4.941   4.539
  141   1HH1  ARG  20          2HH1      ARG  20   6.015  -2.189   6.353
  142   2HH1  ARG  20          1HH1      ARG  20   4.396  -1.691   6.705
  143   1HH2  ARG  20          1HH2      ARG  20   2.922  -4.116   4.702
  144   2HH2  ARG  20          2HH2      ARG  20   2.641  -2.782   5.770
  145    H    CYS  21           H        CYS  21   8.130  -4.258  -0.354
  146    HA   CYS  21           HA       CYS  21   9.537  -2.158  -1.927
  147   1HB   CYS  21          2HB       CYS  21   9.510  -5.012  -2.026
  148   2HB   CYS  21          1HB       CYS  21   8.816  -4.418  -3.534
  149    H    GLY  22           H        GLY  22   6.643  -4.251  -2.255
  150   1HA   GLY  22          2HA       GLY  22   5.285  -1.975  -3.636
  151   2HA   GLY  22          1HA       GLY  22   5.113  -3.633  -4.209
  152    H    GLY  23           H        GLY  23   2.744  -2.633  -3.694
  153   1HA   GLY  23          2HA       GLY  23   1.834  -4.103  -1.351
  154   2HA   GLY  23          1HA       GLY  23   1.697  -2.362  -1.145
  155    H    TYR  24           H        TYR  24  -0.556  -3.899  -1.067
  156    HA   TYR  24           HA       TYR  24  -2.007  -2.984  -3.493
  157   1HB   TYR  24          2HB       TYR  24  -3.208  -5.120  -3.667
  158   2HB   TYR  24          1HB       TYR  24  -1.474  -5.389  -3.835
  159    HD1  TYR  24           HD1      TYR  24  -4.440  -6.018  -1.814
  160    HD2  TYR  24           HD2      TYR  24  -0.152  -6.287  -1.900
  161    HE1  TYR  24           HE1      TYR  24  -4.499  -7.584   0.107
  162    HE2  TYR  24           HE2      TYR  24  -0.212  -7.851   0.020
  163    HH   TYR  24           HH       TYR  24  -2.420  -8.172   2.063
  164    H    CYS  25           H        CYS  25  -4.333  -2.752  -3.101
  165    HA   CYS  25           HA       CYS  25  -4.885  -1.930  -0.336
  166   1HB   CYS  25          2HB       CYS  25  -6.638  -1.867  -2.811
  167   2HB   CYS  25          1HB       CYS  25  -7.028  -1.117  -1.263
  168    H    GLY  26           H        GLY  26  -5.444  -3.503   1.086
  169   1HA   GLY  26          2HA       GLY  26  -7.785  -5.153   0.647
  170   2HA   GLY  26          1HA       GLY  26  -6.305  -6.106   0.545
  171    H    GLY  27           H        GLY  27  -8.587  -5.836   2.622
  172   1HA   GLY  27          2HA       GLY  27  -7.857  -6.748   4.918
  173   2HA   GLY  27          1HA       GLY  27  -6.878  -5.285   5.014
  174    H    TRP  28           H        TRP  28  -8.057  -3.203   4.922
  175    HA   TRP  28           HA       TRP  28 -10.617  -3.401   6.402
  176   1HB   TRP  28          2HB       TRP  28  -8.732  -1.950   7.245
  177   2HB   TRP  28          1HB       TRP  28  -8.952  -0.933   5.822
  178    HD1  TRP  28           HD1      TRP  28 -10.839  -2.110   8.962
  179    HE1  TRP  28           HE1      TRP  28 -12.654  -0.373   9.521
  180    HE3  TRP  28           HE3      TRP  28 -10.394   0.972   4.913
  181    HZ2  TRP  28           HZ2      TRP  28 -13.771   2.010   8.406
  182    HZ3  TRP  28           HZ3      TRP  28 -11.845   2.967   4.690
  183    HH2  TRP  28           HH2      TRP  28 -13.533   3.489   6.427
  184    H    HIS  29           H        HIS  29 -12.059  -3.901   4.702
  185    HA   HIS  29           HA       HIS  29 -13.506  -3.458   2.919
  186   1HB   HIS  29          2HB       HIS  29 -12.806  -0.566   3.514
  187   2HB   HIS  29          1HB       HIS  29 -14.255  -1.152   2.704
  188    HD1  HIS  29           HD1      HIS  29 -14.093   0.440   5.518
  189    HD2  HIS  29           HD2      HIS  29 -14.753  -3.642   5.006
  190    HE1  HIS  29           HE1      HIS  29 -15.226  -0.372   7.633
  191    H    ARG  30           H        ARG  30 -10.646  -3.862   2.338
  192    HA   ARG  30           HA       ARG  30  -9.166  -3.720   0.534
  193   1HB   ARG  30          2HB       ARG  30 -11.384  -4.330  -0.621
  194   2HB   ARG  30          1HB       ARG  30 -11.490  -2.626  -1.058
  195   1HG   ARG  30          2HG       ARG  30  -9.705  -2.741  -2.517
  196   2HG   ARG  30          1HG       ARG  30  -8.912  -4.025  -1.606
  197   1HD   ARG  30          2HD       ARG  30  -9.661  -5.135  -3.538
  198   2HD   ARG  30          1HD       ARG  30 -10.921  -5.496  -2.358
  199    HE   ARG  30           HE       ARG  30 -11.171  -3.454  -4.527
  200   1HH1  ARG  30          1HH2      ARG  30 -12.674  -6.075  -4.600
  201   2HH1  ARG  30          2HH2      ARG  30 -14.224  -5.609  -3.984
  202   1HH2  ARG  30          2HH1      ARG  30 -13.084  -2.606  -2.652
  203   2HH2  ARG  30          1HH1      ARG  30 -14.457  -3.636  -2.878
  204    H    LEU  31           H        LEU  31  -9.555  -1.373   2.321
  205    HA   LEU  31           HA       LEU  31  -8.752   0.798   0.433
  206   1HB   LEU  31          2HB       LEU  31 -10.215   0.899   3.072
  207   2HB   LEU  31          1HB       LEU  31  -9.451   2.325   2.374
  208    HG   LEU  31           HG       LEU  31 -11.549   0.616   1.002
  209   1HD1  LEU  31          1HD1      LEU  31 -12.362   2.015   2.929
  210   2HD1  LEU  31          2HD1      LEU  31 -13.056   2.474   1.374
  211   3HD1  LEU  31          3HD1      LEU  31 -11.761   3.441   2.082
  212   1HD2  LEU  31          1HD2      LEU  31 -11.396   3.035  -0.313
  213   2HD2  LEU  31          2HD2      LEU  31 -10.611   1.550  -0.851
  214   3HD2  LEU  31          3HD2      LEU  31  -9.707   2.733   0.093
  215    H    ARG  32           H        ARG  32  -7.638  -1.256   2.938
  216    HA   ARG  32           HA       ARG  32  -5.594   0.627   3.914
  217   1HB   ARG  32          2HB       ARG  32  -6.718  -1.131   5.382
  218   2HB   ARG  32          1HB       ARG  32  -5.793  -2.341   4.491
  219   1HG   ARG  32          2HG       ARG  32  -3.935  -1.891   5.683
  220   2HG   ARG  32          1HG       ARG  32  -4.067  -0.168   5.329
  221   1HD   ARG  32          2HD       ARG  32  -6.036  -0.342   7.135
  222   2HD   ARG  32          1HD       ARG  32  -5.061  -1.704   7.689
  223    HE   ARG  32           HE       ARG  32  -4.202   1.140   7.669
  224   1HH1  ARG  32          2HH1      ARG  32  -4.216  -0.324  10.217
  225   2HH1  ARG  32          1HH1      ARG  32  -2.577  -0.857  10.381
  226   1HH2  ARG  32          1HH2      ARG  32  -1.805  -0.355   7.028
  227   2HH2  ARG  32          2HH2      ARG  32  -1.204  -0.872   8.568
  228    H    CYS  33           H        CYS  33  -3.442   0.587   3.280
  229    HA   CYS  33           HA       CYS  33  -2.832  -0.961   0.842
  230   1HB   CYS  33          2HB       CYS  33  -1.613   1.384   2.248
  231   2HB   CYS  33          1HB       CYS  33  -0.584   0.415   1.192
  232    H    THR  34           H        THR  34  -2.252  -3.046   1.280
  233    HA   THR  34           HA       THR  34  -0.522  -3.630   3.614
  234    HB   THR  34           HB       THR  34  -1.866  -5.465   1.602
  235    HG1  THR  34           HG1      THR  34  -3.492  -5.131   2.871
  236   1HG2  THR  34          1HG2      THR  34  -1.288  -7.060   3.684
  237   2HG2  THR  34          2HG2      THR  34   0.055  -5.926   3.834
  238   3HG2  THR  34          3HG2      THR  34  -0.170  -6.833   2.338
  239    H    CYS  35           H        CYS  35   1.616  -3.329   3.247
  240    HA   CYS  35           HA       CYS  35   2.729  -3.801   0.538
  241   1HB   CYS  35          2HB       CYS  35   4.354  -2.790   2.849
  242   2HB   CYS  35          1HB       CYS  35   4.522  -2.432   1.132
  243    H    TYR  36           H        TYR  36   4.490  -5.237   0.193
  244    HA   TYR  36           HA       TYR  36   4.863  -7.265   2.361
  245   1HB   TYR  36          2HB       TYR  36   5.616  -8.707   0.280
  246   2HB   TYR  36          1HB       TYR  36   3.906  -8.519   0.656
  247    HD1  TYR  36           HD1      TYR  36   6.664  -7.328  -1.533
  248    HD2  TYR  36           HD2      TYR  36   2.429  -7.307  -0.799
  249    HE1  TYR  36           HE1      TYR  36   6.280  -6.317  -3.764
  250    HE2  TYR  36           HE2      TYR  36   2.048  -6.294  -3.029
  251    HH   TYR  36           HH       TYR  36   3.298  -4.958  -4.683
  252    H    ARG  37           H        ARG  37   7.003  -8.261   2.496
  253    HA   ARG  37           HA       ARG  37   9.152  -6.375   2.481
  254   1HB   ARG  37          2HB       ARG  37   9.040  -9.383   2.741
  255   2HB   ARG  37          1HB       ARG  37  10.577  -8.518   2.745
  256   1HG   ARG  37          2HG       ARG  37   9.731  -7.103   4.625
  257   2HG   ARG  37          1HG       ARG  37   8.268  -8.088   4.664
  258   1HD   ARG  37          2HD       ARG  37  11.082  -9.163   5.037
  259   2HD   ARG  37          1HD       ARG  37   9.952  -8.827   6.348
  260    HE   ARG  37           HE       ARG  37   9.726 -11.044   4.393
  261   1HH1  ARG  37          1HH2      ARG  37   7.019  -9.873   4.943
  262   2HH1  ARG  37          2HH2      ARG  37   6.502 -10.786   6.323
  263   1HH2  ARG  37          2HH1      ARG  37   9.690 -11.946   7.080
  264   2HH2  ARG  37          1HH1      ARG  37   8.021 -11.962   7.538
  265    H    CYS  38           H        CYS  38  11.096  -6.403   1.184
  266    HA   CYS  38           HA       CYS  38  10.546  -7.064  -1.653
  267   1HB   CYS  38          2HB       CYS  38  11.538  -4.810  -0.707
  268   2HB   CYS  38          1HB       CYS  38  13.057  -5.706  -0.724
  269    H    GLY  39           HN       GLY  39  11.423  -8.833  -2.593
  270   1HA   GLY  39          2HA       GLY  39  13.381 -10.447  -1.071
  271   2HA   GLY  39          1HA       GLY  39  12.499 -10.974  -2.504
  Start of MODEL   15
    1   1H    GLY   1          1H        GLY   1  -7.607   3.580   2.377
    2   2H    GLY   1          2H        GLY   1  -8.345   4.817   1.473
    3   3H    GLY   1          3H        GLY   1  -8.698   4.643   3.127
    4   1HA   GLY   1          2HA       GLY   1  -7.143   6.504   2.581
    5   2HA   GLY   1          1HA       GLY   1  -6.550   5.349   3.772
    6    H    PHE   2           H        PHE   2  -4.661   6.794   2.515
    7    HA   PHE   2           HA       PHE   2  -2.703   6.662   1.240
    8   1HB   PHE   2          2HB       PHE   2  -3.348   3.710   1.486
    9   2HB   PHE   2          1HB       PHE   2  -1.818   4.342   0.882
   10    HD1  PHE   2           HD1      PHE   2  -3.503   3.216   3.757
   11    HD2  PHE   2           HD2      PHE   2  -0.709   6.208   2.454
   12    HE1  PHE   2           HE1      PHE   2  -2.693   3.475   6.086
   13    HE2  PHE   2           HE2      PHE   2   0.099   6.467   4.784
   14    HZ   PHE   2           HZ       PHE   2  -0.892   5.101   6.599
   15    H    GLY   3           H        GLY   3  -5.298   6.927  -0.191
   16   1HA   GLY   3          2HA       GLY   3  -5.911   7.140  -2.439
   17   2HA   GLY   3          1HA       GLY   3  -4.313   6.547  -2.880
   18    H    CYS   4           H        CYS   4  -6.850   4.939  -0.944
   19    HA   CYS   4           HA       CYS   4  -6.677   2.620  -2.801
   20   1HB   CYS   4          2HB       CYS   4  -7.565   2.965   0.052
   21   2HB   CYS   4          1HB       CYS   4  -8.137   1.582  -0.880
   22    HA   PRO   5           HA       PRO   5  -8.085   0.742  -2.575
   23   1HB   PRO   5          2HB       PRO   5  -9.451  -0.579  -4.555
   24   2HB   PRO   5          1HB       PRO   5 -10.066  -0.376  -2.907
   25   1HG   PRO   5          2HG       PRO   5 -10.919   0.999  -5.407
   26   2HG   PRO   5          1HG       PRO   5 -11.835   0.701  -3.921
   27   1HD   PRO   5          2HD       PRO   5 -10.610   3.151  -4.679
   28   2HD   PRO   5          1HD       PRO   5 -11.301   2.764  -3.089
   29    H    ASN   6           H        ASN   6  -7.623   3.103  -4.775
   30    HA   ASN   6           HA       ASN   6  -6.687   1.840  -7.144
   31   1HB   ASN   6          2HB       ASN   6  -7.028   4.375  -6.587
   32   2HB   ASN   6          1HB       ASN   6  -5.354   4.298  -6.035
   33   1HD2  ASN   6          1HD2      ASN   6  -7.290   4.738  -8.806
   34   2HD2  ASN   6          2HD2      ASN   6  -6.089   4.485  -9.979
   35    H    ASN   7           H        ASN   7  -4.915   0.622  -7.531
   36    HA   ASN   7           HA       ASN   7  -3.061   0.001  -5.368
   37   1HB   ASN   7          2HB       ASN   7  -3.269  -0.882  -8.249
   38   2HB   ASN   7          1HB       ASN   7  -1.956  -1.406  -7.194
   39   1HD2  ASN   7          1HD2      ASN   7  -2.387  -3.280  -6.012
   40   2HD2  ASN   7          2HD2      ASN   7  -3.938  -3.874  -5.664
   41    H    TYR   8           H        TYR   8  -3.076   2.220  -8.062
   42    HA   TYR   8           HA       TYR   8  -0.232   2.542  -8.333
   43   1HB   TYR   8          2HB       TYR   8  -2.003   3.386  -9.955
   44   2HB   TYR   8          1HB       TYR   8  -2.332   4.678  -8.802
   45    HD1  TYR   8           HD1      TYR   8   0.251   3.202 -11.021
   46    HD2  TYR   8           HD2      TYR   8  -0.825   6.529  -8.524
   47    HE1  TYR   8           HE1      TYR   8   2.169   4.493 -11.914
   48    HE2  TYR   8           HE2      TYR   8   1.094   7.819  -9.418
   49    HH   TYR   8           HH       TYR   8   3.550   6.880 -10.600
   50    H    GLN   9           H        GLN   9  -2.668   4.474  -6.541
   51    HA   GLN   9           HA       GLN   9  -0.748   6.143  -5.205
   52   1HB   GLN   9          2HB       GLN   9  -3.547   5.349  -4.336
   53   2HB   GLN   9          1HB       GLN   9  -2.609   6.684  -3.667
   54   1HG   GLN   9          2HG       GLN   9  -2.584   7.811  -5.823
   55   2HG   GLN   9          1HG       GLN   9  -3.394   6.443  -6.586
   56   1HE2  GLN   9          1HE2      GLN   9  -3.884   9.225  -4.448
   57   2HE2  GLN   9          2HE2      GLN   9  -5.579   9.125  -4.418
   58    H    CYS  10           H        CYS  10  -2.428   3.150  -4.240
   59    HA   CYS  10           HA       CYS  10  -1.301   2.894  -1.636
   60   1HB   CYS  10          2HB       CYS  10  -3.185   1.510  -2.739
   61   2HB   CYS  10          1HB       CYS  10  -1.888   0.543  -3.437
   62    H    HIS  11           H        HIS  11  -0.150   1.787  -4.816
   63    HA   HIS  11           HA       HIS  11   2.148   0.358  -3.915
   64   1HB   HIS  11          2HB       HIS  11   1.314   0.154  -6.210
   65   2HB   HIS  11          1HB       HIS  11   1.670   1.853  -6.514
   66    HD1  HIS  11           HD1      HIS  11   3.926  -0.648  -4.747
   67    HD2  HIS  11           HD2      HIS  11   3.826   1.597  -8.257
   68    HE1  HIS  11           HE1      HIS  11   6.179  -0.961  -5.859
   69    H    ARG  12           H        ARG  12   1.705   3.787  -4.796
   70    HA   ARG  12           HA       ARG  12   4.430   4.593  -4.543
   71   1HB   ARG  12          2HB       ARG  12   2.231   5.883  -5.345
   72   2HB   ARG  12          1HB       ARG  12   2.259   6.462  -3.680
   73   1HG   ARG  12          2HG       ARG  12   4.766   6.978  -4.129
   74   2HG   ARG  12          1HG       ARG  12   4.337   6.830  -5.834
   75   1HD   ARG  12          2HD       ARG  12   3.305   8.839  -5.845
   76   2HD   ARG  12          1HD       ARG  12   2.422   8.474  -4.362
   77    HE   ARG  12           HE       ARG  12   4.664   9.081  -3.195
   78   1HH1  ARG  12          2HH1      ARG  12   3.111  11.500  -3.696
   79   2HH1  ARG  12          1HH1      ARG  12   4.175  12.482  -4.645
   80   1HH2  ARG  12          1HH2      ARG  12   6.260   9.841  -5.515
   81   2HH2  ARG  12          2HH2      ARG  12   5.966  11.538  -5.679
   82    H    HIS  13           H        HIS  13   1.834   4.283  -2.134
   83    HA   HIS  13           HA       HIS  13   3.260   5.436   0.072
   84   1HB   HIS  13          2HB       HIS  13   0.870   5.139   0.248
   85   2HB   HIS  13          1HB       HIS  13   1.009   3.407  -0.046
   86    HD1  HIS  13           HD1      HIS  13   2.564   5.850   2.463
   87    HD2  HIS  13           HD2      HIS  13   0.861   2.048   2.334
   88    HE1  HIS  13           HE1      HIS  13   2.620   4.959   4.834
   89    H    CYS  14           H        CYS  14   2.990   2.081  -1.123
   90    HA   CYS  14           HA       CYS  14   4.533   0.850   0.950
   91   1HB   CYS  14          2HB       CYS  14   4.283   0.020  -1.958
   92   2HB   CYS  14          1HB       CYS  14   4.819  -1.010  -0.633
   93    H    LYS  15           H        LYS  15   5.441   2.521  -2.026
   94    HA   LYS  15           HA       LYS  15   8.208   1.764  -2.066
   95   1HB   LYS  15          2HB       LYS  15   6.656   4.076  -3.230
   96   2HB   LYS  15          1HB       LYS  15   8.409   3.980  -3.398
   97   1HG   LYS  15          2HG       LYS  15   7.596   1.427  -4.085
   98   2HG   LYS  15          1HG       LYS  15   6.316   2.435  -4.760
   99   1HD   LYS  15          2HD       LYS  15   8.219   3.901  -5.707
  100   2HD   LYS  15          1HD       LYS  15   9.279   2.539  -5.337
  101   1HE   LYS  15          2HE       LYS  15   7.559   1.105  -6.638
  102   2HE   LYS  15          1HE       LYS  15   6.959   2.640  -7.264
  103   1HZ   LYS  15          1HZ       LYS  15   8.628   1.671  -8.720
  104   2HZ   LYS  15          2HZ       LYS  15   9.762   1.673  -7.456
  105   3HZ   LYS  15          3HZ       LYS  15   9.174   3.141  -8.077
  106    H    SER  16           H        SER  16   6.512   4.579  -0.629
  107    HA   SER  16           HA       SER  16   8.896   5.839   0.364
  108   1HB   SER  16          2HB       SER  16   7.275   7.005   1.953
  109   2HB   SER  16          1HB       SER  16   6.943   7.201   0.237
  110    HG   SER  16           HG       SER  16   5.682   5.471   2.099
  111    H    ILE  17           H        ILE  17   6.946   3.182   1.573
  112    HA   ILE  17           HA       ILE  17   7.938   3.282   4.298
  113    HB   ILE  17           HB       ILE  17   6.764   0.951   2.743
  114   1HG1  ILE  17          2HG1      ILE  17   5.375   2.687   4.792
  115   2HG1  ILE  17          1HG1      ILE  17   5.358   3.093   3.076
  116   1HG2  ILE  17          1HG2      ILE  17   6.367  -0.052   4.928
  117   2HG2  ILE  17          2HG2      ILE  17   7.031   1.367   5.737
  118   3HG2  ILE  17          3HG2      ILE  17   8.083   0.324   4.779
  119   1HD1  ILE  17          1HD1      ILE  17   4.712   0.402   3.073
  120   2HD1  ILE  17          2HD1      ILE  17   3.557   1.727   2.937
  121   3HD1  ILE  17          3HD1      ILE  17   3.886   1.002   4.511
  122    HA   PRO  18           HA       PRO  18  11.938   1.606   3.356
  123   1HB   PRO  18          2HB       PRO  18  12.768   1.392   5.970
  124   2HB   PRO  18          1HB       PRO  18  12.747   2.915   5.066
  125   1HG   PRO  18          2HG       PRO  18  10.888   1.974   7.201
  126   2HG   PRO  18          1HG       PRO  18  11.321   3.629   6.739
  127   1HD   PRO  18          2HD       PRO  18   8.933   2.294   6.037
  128   2HD   PRO  18          1HD       PRO  18   9.543   3.792   5.302
  129    H    GLY  19           H        GLY  19  12.427  -0.505   2.917
  130   1HA   GLY  19          2HA       GLY  19  12.831  -2.804   3.543
  131   2HA   GLY  19          1HA       GLY  19  11.674  -2.624   4.859
  132    H    ARG  20           H        ARG  20  10.127  -1.181   2.353
  133    HA   ARG  20           HA       ARG  20   8.749  -3.720   1.611
  134   1HB   ARG  20          2HB       ARG  20   7.848  -0.911   2.011
  135   2HB   ARG  20          1HB       ARG  20   7.029  -1.845   0.764
  136   1HG   ARG  20          2HG       ARG  20   5.828  -2.149   2.847
  137   2HG   ARG  20          1HG       ARG  20   6.649  -3.660   2.455
  138   1HD   ARG  20          2HD       ARG  20   8.352  -3.278   4.068
  139   2HD   ARG  20          1HD       ARG  20   7.910  -1.580   4.245
  140    HE   ARG  20           HE       ARG  20   6.025  -2.247   5.589
  141   1HH1  ARG  20          1HH2      ARG  20   8.210  -4.040   6.688
  142   2HH1  ARG  20          2HH2      ARG  20   7.409  -5.572   6.734
  143   1HH2  ARG  20          2HH1      ARG  20   4.837  -4.591   4.609
  144   2HH2  ARG  20          1HH1      ARG  20   5.493  -5.887   5.554
  145    H    CYS  21           H        CYS  21   7.807  -3.717  -0.622
  146    HA   CYS  21           HA       CYS  21   9.554  -2.299  -2.590
  147   1HB   CYS  21          2HB       CYS  21   9.394  -5.115  -2.122
  148   2HB   CYS  21          1HB       CYS  21   8.654  -4.787  -3.688
  149    H    GLY  22           H        GLY  22   6.557  -4.234  -2.295
  150   1HA   GLY  22          2HA       GLY  22   5.122  -2.140  -3.828
  151   2HA   GLY  22          1HA       GLY  22   5.039  -3.800  -4.415
  152    H    GLY  23           H        GLY  23   2.638  -2.824  -3.822
  153   1HA   GLY  23          2HA       GLY  23   1.752  -4.464  -1.598
  154   2HA   GLY  23          1HA       GLY  23   1.650  -2.748  -1.218
  155    H    TYR  24           H        TYR  24  -0.706  -3.337  -1.083
  156    HA   TYR  24           HA       TYR  24  -2.081  -2.498  -3.507
  157   1HB   TYR  24          2HB       TYR  24  -3.431  -4.541  -3.805
  158   2HB   TYR  24          1HB       TYR  24  -1.720  -4.888  -4.043
  159    HD1  TYR  24           HD1      TYR  24  -4.662  -5.495  -1.979
  160    HD2  TYR  24           HD2      TYR  24  -0.406  -6.025  -2.237
  161    HE1  TYR  24           HE1      TYR  24  -4.768  -7.202  -0.187
  162    HE2  TYR  24           HE2      TYR  24  -0.512  -7.733  -0.444
  163    HH   TYR  24           HH       TYR  24  -2.332  -8.153   1.593
  164    H    CYS  25           H        CYS  25  -4.566  -2.654  -3.088
  165    HA   CYS  25           HA       CYS  25  -5.034  -1.767  -0.294
  166   1HB   CYS  25          2HB       CYS  25  -6.764  -1.572  -2.779
  167   2HB   CYS  25          1HB       CYS  25  -7.228  -0.970  -1.189
  168    H    GLY  26           H        GLY  26  -5.973  -3.144   1.138
  169   1HA   GLY  26          2HA       GLY  26  -8.133  -4.923   0.497
  170   2HA   GLY  26          1HA       GLY  26  -6.626  -5.832   0.556
  171    H    GLY  27           H        GLY  27  -9.114  -5.580   2.394
  172   1HA   GLY  27          2HA       GLY  27  -8.558  -6.457   4.766
  173   2HA   GLY  27          1HA       GLY  27  -7.674  -4.941   4.934
  174    H    TRP  28           H        TRP  28  -8.843  -2.997   5.160
  175    HA   TRP  28           HA       TRP  28 -11.608  -3.339   6.124
  176   1HB   TRP  28          2HB       TRP  28  -9.922  -1.959   7.372
  177   2HB   TRP  28          1HB       TRP  28  -9.906  -0.829   6.019
  178    HD1  TRP  28           HD1      TRP  28 -12.322  -2.264   8.658
  179    HE1  TRP  28           HE1      TRP  28 -14.189  -0.537   9.067
  180    HE3  TRP  28           HE3      TRP  28 -11.126   1.195   5.096
  181    HZ2  TRP  28           HZ2      TRP  28 -15.061   1.979   8.027
  182    HZ3  TRP  28           HZ3      TRP  28 -12.488   3.247   4.831
  183    HH2  TRP  28           HH2      TRP  28 -14.454   3.642   6.288
  184    H    HIS  29           H        HIS  29 -12.865  -3.637   4.271
  185    HA   HIS  29           HA       HIS  29 -14.061  -3.053   2.349
  186   1HB   HIS  29          2HB       HIS  29 -13.351  -0.234   3.221
  187   2HB   HIS  29          1HB       HIS  29 -14.677  -0.691   2.158
  188    HD1  HIS  29           HD1      HIS  29 -14.941   0.713   5.038
  189    HD2  HIS  29           HD2      HIS  29 -15.578  -3.316   4.196
  190    HE1  HIS  29           HE1      HIS  29 -16.408  -0.183   6.898
  191    H    ARG  30           H        ARG  30 -11.161  -3.528   2.121
  192    HA   ARG  30           HA       ARG  30  -9.441  -3.336   0.555
  193   1HB   ARG  30          2HB       ARG  30 -11.370  -3.953  -0.951
  194   2HB   ARG  30          1HB       ARG  30 -11.605  -2.231  -1.260
  195   1HG   ARG  30          2HG       ARG  30  -9.702  -2.058  -2.530
  196   2HG   ARG  30          1HG       ARG  30  -8.836  -3.266  -1.584
  197   1HD   ARG  30          2HD       ARG  30 -10.866  -4.745  -2.739
  198   2HD   ARG  30          1HD       ARG  30 -10.442  -3.599  -4.013
  199    HE   ARG  30           HE       ARG  30  -8.157  -4.945  -2.728
  200   1HH1  ARG  30          2HH1      ARG  30  -8.226  -3.753  -5.520
  201   2HH1  ARG  30          1HH1      ARG  30  -8.273  -5.178  -6.503
  202   1HH2  ARG  30          1HH2      ARG  30  -9.180  -7.272  -3.876
  203   2HH2  ARG  30          2HH2      ARG  30  -8.813  -7.181  -5.566
  204    H    LEU  31           H        LEU  31 -10.050  -1.055   2.344
  205    HA   LEU  31           HA       LEU  31  -9.081   1.215   0.668
  206   1HB   LEU  31          2HB       LEU  31 -10.564   1.140   3.304
  207   2HB   LEU  31          1HB       LEU  31  -9.815   2.606   2.676
  208    HG   LEU  31           HG       LEU  31 -11.701   0.993   0.965
  209   1HD1  LEU  31          1HD1      LEU  31 -13.557   2.351   1.744
  210   2HD1  LEU  31          2HD1      LEU  31 -12.494   3.249   2.827
  211   3HD1  LEU  31          3HD1      LEU  31 -12.830   1.546   3.133
  212   1HD2  LEU  31          1HD2      LEU  31 -10.982   3.941   1.063
  213   2HD2  LEU  31          2HD2      LEU  31 -12.005   3.162  -0.143
  214   3HD2  LEU  31          3HD2      LEU  31 -10.288   2.769  -0.057
  215    H    ARG  32           H        ARG  32  -8.182  -1.003   3.161
  216    HA   ARG  32           HA       ARG  32  -6.071   0.669   4.312
  217   1HB   ARG  32          2HB       ARG  32  -7.264  -1.159   5.585
  218   2HB   ARG  32          1HB       ARG  32  -6.452  -2.333   4.550
  219   1HG   ARG  32          2HG       ARG  32  -4.254  -1.430   5.281
  220   2HG   ARG  32          1HG       ARG  32  -5.091  -0.314   6.361
  221   1HD   ARG  32          2HD       ARG  32  -4.574  -2.107   7.784
  222   2HD   ARG  32          1HD       ARG  32  -6.233  -2.464   7.307
  223    HE   ARG  32           HE       ARG  32  -5.023  -3.920   5.465
  224   1HH1  ARG  32          1HH2      ARG  32  -5.616  -5.391   7.943
  225   2HH1  ARG  32          2HH2      ARG  32  -4.064  -5.980   8.435
  226   1HH2  ARG  32          2HH1      ARG  32  -2.296  -3.775   6.409
  227   2HH2  ARG  32          1HH1      ARG  32  -2.175  -5.061   7.563
  228    H    CYS  33           H        CYS  33  -3.889   0.602   3.755
  229    HA   CYS  33           HA       CYS  33  -3.248  -0.742   1.197
  230   1HB   CYS  33          2HB       CYS  33  -2.166   1.556   2.722
  231   2HB   CYS  33          1HB       CYS  33  -0.972   0.589   1.855
  232    H    THR  34           H        THR  34  -2.244  -2.667   1.183
  233    HA   THR  34           HA       THR  34  -0.729  -3.504   3.617
  234    HB   THR  34           HB       THR  34  -2.173  -5.120   1.498
  235    HG1  THR  34           HG1      THR  34  -2.477  -5.113   4.313
  236   1HG2  THR  34          1HG2      THR  34  -0.370  -6.519   1.884
  237   2HG2  THR  34          2HG2      THR  34  -1.423  -7.008   3.212
  238   3HG2  THR  34          3HG2      THR  34  -0.093  -5.889   3.507
  239    H    CYS  35           H        CYS  35   1.410  -3.155   3.271
  240    HA   CYS  35           HA       CYS  35   2.535  -3.684   0.553
  241   1HB   CYS  35          2HB       CYS  35   3.866  -2.177   2.818
  242   2HB   CYS  35          1HB       CYS  35   4.340  -2.202   1.120
  243    H    TYR  36           H        TYR  36   4.266  -5.158   0.352
  244    HA   TYR  36           HA       TYR  36   4.844  -6.753   2.816
  245   1HB   TYR  36          2HB       TYR  36   5.539  -8.540   1.051
  246   2HB   TYR  36          1HB       TYR  36   3.826  -8.264   1.346
  247    HD1  TYR  36           HD1      TYR  36   6.648  -7.478  -0.949
  248    HD2  TYR  36           HD2      TYR  36   2.393  -7.401  -0.360
  249    HE1  TYR  36           HE1      TYR  36   6.325  -6.918  -3.342
  250    HE2  TYR  36           HE2      TYR  36   2.071  -6.837  -2.752
  251    HH   TYR  36           HH       TYR  36   4.171  -5.594  -4.643
  252    H    ARG  37           H        ARG  37   7.023  -7.700   2.966
  253    HA   ARG  37           HA       ARG  37   9.084  -5.738   2.480
  254   1HB   ARG  37          2HB       ARG  37   9.036  -8.538   3.569
  255   2HB   ARG  37          1HB       ARG  37  10.576  -7.762   3.207
  256   1HG   ARG  37          2HG       ARG  37  10.243  -6.066   4.798
  257   2HG   ARG  37          1HG       ARG  37   8.500  -6.323   4.845
  258   1HD   ARG  37          2HD       ARG  37   9.446  -7.241   6.880
  259   2HD   ARG  37          1HD       ARG  37   8.928  -8.583   5.862
  260    HE   ARG  37           HE       ARG  37  11.309  -8.932   5.260
  261   1HH1  ARG  37          1HH2      ARG  37  12.447  -6.290   5.982
  262   2HH1  ARG  37          2HH2      ARG  37  13.189  -6.596   7.517
  263   1HH2  ARG  37          2HH1      ARG  37  11.463  -9.567   8.051
  264   2HH2  ARG  37          1HH1      ARG  37  12.635  -8.463   8.690
  265    H    CYS  38           H        CYS  38  10.839  -5.845   1.044
  266    HA   CYS  38           HA       CYS  38  10.302  -7.171  -1.503
  267   1HB   CYS  38          2HB       CYS  38  11.506  -4.858  -0.971
  268   2HB   CYS  38          1HB       CYS  38  12.938  -5.884  -0.903
  269    H    GLY  39           HN       GLY  39  11.234  -9.043  -2.253
  270   1HA   GLY  39          2HA       GLY  39  12.920 -10.579  -0.367
  271   2HA   GLY  39          1HA       GLY  39  12.133 -11.224  -1.808
  Start of MODEL   16
    1   1H    GLY   1          1H        GLY   1  -7.529   3.448   2.162
    2   2H    GLY   1          2H        GLY   1  -8.356   4.728   1.409
    3   3H    GLY   1          3H        GLY   1  -8.608   4.406   3.057
    4   1HA   GLY   1          2HA       GLY   1  -7.104   6.360   2.457
    5   2HA   GLY   1          1HA       GLY   1  -6.537   5.226   3.682
    6    H    PHE   2           H        PHE   2  -4.632   6.673   2.413
    7    HA   PHE   2           HA       PHE   2  -2.632   6.494   1.203
    8   1HB   PHE   2          2HB       PHE   2  -3.179   3.518   1.136
    9   2HB   PHE   2          1HB       PHE   2  -1.615   4.330   1.096
   10    HD1  PHE   2           HD1      PHE   2  -3.834   2.591   3.158
   11    HD2  PHE   2           HD2      PHE   2  -1.261   6.030   3.181
   12    HE1  PHE   2           HE1      PHE   2  -3.734   2.500   5.635
   13    HE2  PHE   2           HE2      PHE   2  -1.161   5.940   5.657
   14    HZ   PHE   2           HZ       PHE   2  -2.397   4.174   6.883
   15    H    GLY   3           H        GLY   3  -5.228   6.755  -0.257
   16   1HA   GLY   3          2HA       GLY   3  -5.791   6.990  -2.517
   17   2HA   GLY   3          1HA       GLY   3  -4.207   6.348  -2.938
   18    H    CYS   4           H        CYS   4  -6.758   4.801  -0.977
   19    HA   CYS   4           HA       CYS   4  -6.681   2.495  -2.860
   20   1HB   CYS   4          2HB       CYS   4  -7.431   2.805   0.035
   21   2HB   CYS   4          1HB       CYS   4  -8.076   1.451  -0.890
   22    HA   PRO   5           HA       PRO   5  -8.095   0.625  -2.619
   23   1HB   PRO   5          2HB       PRO   5  -9.515  -0.625  -4.607
   24   2HB   PRO   5          1HB       PRO   5 -10.086  -0.476  -2.937
   25   1HG   PRO   5          2HG       PRO   5 -10.995   0.991  -5.365
   26   2HG   PRO   5          1HG       PRO   5 -11.878   0.636  -3.872
   27   1HD   PRO   5          2HD       PRO   5 -10.679   3.115  -4.556
   28   2HD   PRO   5          1HD       PRO   5 -11.310   2.658  -2.960
   29    H    ASN   6           H        ASN   6  -7.754   3.045  -4.821
   30    HA   ASN   6           HA       ASN   6  -6.826   1.838  -7.216
   31   1HB   ASN   6          2HB       ASN   6  -7.185   4.363  -6.592
   32   2HB   ASN   6          1HB       ASN   6  -5.497   4.290  -6.085
   33   1HD2  ASN   6          1HD2      ASN   6  -7.601   4.479  -8.848
   34   2HD2  ASN   6          2HD2      ASN   6  -6.390   4.394 -10.034
   35    H    ASN   7           H        ASN   7  -4.826   1.003  -7.825
   36    HA   ASN   7           HA       ASN   7  -3.023   0.259  -5.606
   37   1HB   ASN   7          2HB       ASN   7  -3.488  -0.723  -8.386
   38   2HB   ASN   7          1HB       ASN   7  -1.897  -0.985  -7.672
   39   1HD2  ASN   7          1HD2      ASN   7  -5.238  -2.011  -7.591
   40   2HD2  ASN   7          2HD2      ASN   7  -5.058  -3.166  -6.360
   41    H    TYR   8           H        TYR   8  -3.127   2.541  -8.227
   42    HA   TYR   8           HA       TYR   8  -0.298   2.886  -8.599
   43   1HB   TYR   8          2HB       TYR   8  -2.223   3.782 -10.065
   44   2HB   TYR   8          1HB       TYR   8  -2.366   5.077  -8.882
   45    HD1  TYR   8           HD1      TYR   8  -1.875   6.315 -11.198
   46    HD2  TYR   8           HD2      TYR   8   1.023   4.058  -8.963
   47    HE1  TYR   8           HE1      TYR   8  -0.042   7.544 -12.326
   48    HE2  TYR   8           HE2      TYR   8   2.850   5.289 -10.094
   49    HH   TYR   8           HH       TYR   8   2.731   7.968 -11.396
   50    H    GLN   9           H        GLN   9  -2.645   4.838  -6.709
   51    HA   GLN   9           HA       GLN   9  -0.640   6.391  -5.360
   52   1HB   GLN   9          2HB       GLN   9  -3.465   5.723  -4.469
   53   2HB   GLN   9          1HB       GLN   9  -2.461   7.016  -3.816
   54   1HG   GLN   9          2HG       GLN   9  -2.991   6.901  -6.774
   55   2HG   GLN   9          1HG       GLN   9  -4.212   7.572  -5.694
   56   1HE2  GLN   9          1HE2      GLN   9  -1.029   8.130  -7.097
   57   2HE2  GLN   9          2HE2      GLN   9  -0.821   9.691  -6.463
   58    H    CYS  10           H        CYS  10  -2.327   3.367  -4.541
   59    HA   CYS  10           HA       CYS  10  -1.288   3.041  -1.899
   60   1HB   CYS  10          2HB       CYS  10  -3.135   1.677  -3.014
   61   2HB   CYS  10          1HB       CYS  10  -1.859   0.796  -3.852
   62    H    HIS  11           H        HIS  11  -0.073   2.009  -5.080
   63    HA   HIS  11           HA       HIS  11   2.225   0.575  -4.232
   64   1HB   HIS  11          2HB       HIS  11   1.254   0.783  -6.596
   65   2HB   HIS  11          1HB       HIS  11   2.093   2.327  -6.701
   66    HD1  HIS  11           HD1      HIS  11   3.165  -1.123  -5.440
   67    HD2  HIS  11           HD2      HIS  11   4.454   1.877  -8.028
   68    HE1  HIS  11           HE1      HIS  11   5.381  -1.900  -6.393
   69    H    ARG  12           H        ARG  12   1.830   4.058  -4.953
   70    HA   ARG  12           HA       ARG  12   4.551   4.790  -4.454
   71   1HB   ARG  12          2HB       ARG  12   2.492   6.150  -5.461
   72   2HB   ARG  12          1HB       ARG  12   2.346   6.699  -3.790
   73   1HG   ARG  12          2HG       ARG  12   4.672   7.450  -3.797
   74   2HG   ARG  12          1HG       ARG  12   4.891   6.827  -5.433
   75   1HD   ARG  12          2HD       ARG  12   2.900   8.374  -6.057
   76   2HD   ARG  12          1HD       ARG  12   3.236   9.176  -4.523
   77    HE   ARG  12           HE       ARG  12   4.696   9.646  -6.881
   78   1HH1  ARG  12          1HH2      ARG  12   5.024  10.919  -4.072
   79   2HH1  ARG  12          2HH2      ARG  12   6.707  10.624  -3.792
   80   1HH2  ARG  12          2HH1      ARG  12   6.989   8.277  -6.340
   81   2HH2  ARG  12          1HH1      ARG  12   7.825   9.126  -5.083
   82    H    HIS  13           H        HIS  13   1.717   4.548  -2.314
   83    HA   HIS  13           HA       HIS  13   2.923   5.658   0.026
   84   1HB   HIS  13          2HB       HIS  13   0.514   5.308  -0.086
   85   2HB   HIS  13          1HB       HIS  13   0.739   3.569  -0.264
   86    HD1  HIS  13           HD1      HIS  13   2.017   6.173   2.240
   87    HD2  HIS  13           HD2      HIS  13   0.327   2.364   2.168
   88    HE1  HIS  13           HE1      HIS  13   1.837   5.425   4.653
   89    H    CYS  14           H        CYS  14   2.707   2.272  -1.122
   90    HA   CYS  14           HA       CYS  14   4.115   1.088   1.060
   91   1HB   CYS  14          2HB       CYS  14   3.757   0.273  -1.828
   92   2HB   CYS  14          1HB       CYS  14   4.664  -0.718  -0.688
   93    H    LYS  15           H        LYS  15   5.250   2.742  -1.845
   94    HA   LYS  15           HA       LYS  15   8.015   1.946  -1.636
   95   1HB   LYS  15          2HB       LYS  15   6.727   4.353  -2.960
   96   2HB   LYS  15          1HB       LYS  15   8.420   3.902  -3.148
   97   1HG   LYS  15          2HG       LYS  15   6.894   1.558  -3.641
   98   2HG   LYS  15          1HG       LYS  15   6.124   2.864  -4.541
   99   1HD   LYS  15          2HD       LYS  15   8.418   3.479  -5.424
  100   2HD   LYS  15          1HD       LYS  15   9.019   1.987  -4.698
  101   1HE   LYS  15          2HE       LYS  15   6.614   1.873  -6.491
  102   2HE   LYS  15          1HE       LYS  15   8.216   1.999  -7.214
  103   1HZ   LYS  15          1HZ       LYS  15   7.154  -0.138  -5.468
  104   2HZ   LYS  15          2HZ       LYS  15   8.825   0.074  -5.697
  105   3HZ   LYS  15          3HZ       LYS  15   7.822  -0.277  -7.022
  106    H    SER  16           H        SER  16   6.189   4.796  -0.482
  107    HA   SER  16           HA       SER  16   8.402   6.212   0.621
  108   1HB   SER  16          2HB       SER  16   6.768   7.468   1.898
  109   2HB   SER  16          1HB       SER  16   6.095   7.153   0.304
  110    HG   SER  16           HG       SER  16   4.928   5.422   1.223
  111    H    ILE  17           H        ILE  17   6.604   3.438   1.806
  112    HA   ILE  17           HA       ILE  17   7.718   3.622   4.517
  113    HB   ILE  17           HB       ILE  17   6.242   1.335   3.169
  114   1HG1  ILE  17          2HG1      ILE  17   4.985   3.142   5.198
  115   2HG1  ILE  17          1HG1      ILE  17   5.158   3.754   3.552
  116   1HG2  ILE  17          1HG2      ILE  17   7.505   0.614   5.135
  117   2HG2  ILE  17          2HG2      ILE  17   5.785   0.654   5.526
  118   3HG2  ILE  17          3HG2      ILE  17   6.845   1.950   6.079
  119   1HD1  ILE  17          1HD1      ILE  17   3.100   2.700   3.389
  120   2HD1  ILE  17          2HD1      ILE  17   3.529   1.451   4.556
  121   3HD1  ILE  17          3HD1      ILE  17   4.168   1.381   2.914
  122    HA   PRO  18           HA       PRO  18  11.460   1.565   3.283
  123   1HB   PRO  18          2HB       PRO  18  12.534   1.420   5.811
  124   2HB   PRO  18          1HB       PRO  18  12.539   2.890   4.821
  125   1HG   PRO  18          2HG       PRO  18  10.848   2.225   7.186
  126   2HG   PRO  18          1HG       PRO  18  11.350   3.810   6.575
  127   1HD   PRO  18          2HD       PRO  18   8.809   2.621   6.204
  128   2HD   PRO  18          1HD       PRO  18   9.439   4.034   5.330
  129    H    GLY  19           H        GLY  19  12.066  -0.582   3.134
  130   1HA   GLY  19          2HA       GLY  19  12.353  -2.828   3.999
  131   2HA   GLY  19          1HA       GLY  19  11.047  -2.526   5.141
  132    H    ARG  20           H        ARG  20   9.548  -1.255   2.704
  133    HA   ARG  20           HA       ARG  20   8.537  -3.863   1.652
  134   1HB   ARG  20          2HB       ARG  20   6.957  -1.334   1.378
  135   2HB   ARG  20          1HB       ARG  20   6.389  -2.989   1.581
  136   1HG   ARG  20          2HG       ARG  20   7.830  -1.500   3.788
  137   2HG   ARG  20          1HG       ARG  20   6.081  -1.426   3.588
  138   1HD   ARG  20          2HD       ARG  20   5.857  -3.795   3.906
  139   2HD   ARG  20          1HD       ARG  20   7.602  -4.032   3.815
  140    HE   ARG  20           HE       ARG  20   6.266  -2.576   6.065
  141   1HH1  ARG  20          1HH2      ARG  20   9.171  -2.184   5.978
  142   2HH1  ARG  20          2HH2      ARG  20   9.784  -3.502   6.923
  143   1HH2  ARG  20          2HH1      ARG  20   6.840  -5.343   6.741
  144   2HH2  ARG  20          1HH1      ARG  20   8.456  -5.295   7.361
  145    H    CYS  21           H        CYS  21   8.226  -4.087  -0.604
  146    HA   CYS  21           HA       CYS  21   9.665  -2.062  -2.255
  147   1HB   CYS  21          2HB       CYS  21   9.630  -4.915  -2.261
  148   2HB   CYS  21          1HB       CYS  21   8.923  -4.371  -3.781
  149    H    GLY  22           H        GLY  22   6.698  -4.064  -2.347
  150   1HA   GLY  22          2HA       GLY  22   5.334  -1.829  -3.769
  151   2HA   GLY  22          1HA       GLY  22   5.218  -3.464  -4.419
  152    H    GLY  23           H        GLY  23   2.811  -2.661  -3.917
  153   1HA   GLY  23          2HA       GLY  23   1.912  -4.246  -1.667
  154   2HA   GLY  23          1HA       GLY  23   1.747  -2.526  -1.335
  155    H    TYR  24           H        TYR  24  -0.562  -3.646  -1.256
  156    HA   TYR  24           HA       TYR  24  -1.953  -2.784  -3.713
  157   1HB   TYR  24          2HB       TYR  24  -3.157  -4.876  -4.001
  158   2HB   TYR  24          1HB       TYR  24  -1.430  -5.229  -4.023
  159    HD1  TYR  24           HD1      TYR  24  -0.317  -6.165  -1.968
  160    HD2  TYR  24           HD2      TYR  24  -4.579  -5.716  -2.268
  161    HE1  TYR  24           HE1      TYR  24  -0.617  -7.699  -0.042
  162    HE2  TYR  24           HE2      TYR  24  -4.877  -7.251  -0.345
  163    HH   TYR  24           HH       TYR  24  -3.254  -9.266   0.666
  164    H    CYS  25           H        CYS  25  -4.332  -2.622  -3.332
  165    HA   CYS  25           HA       CYS  25  -4.887  -1.792  -0.561
  166   1HB   CYS  25          2HB       CYS  25  -6.529  -1.689  -3.107
  167   2HB   CYS  25          1HB       CYS  25  -7.138  -1.156  -1.541
  168    H    GLY  26           H        GLY  26  -5.607  -3.263   0.892
  169   1HA   GLY  26          2HA       GLY  26  -7.849  -4.968   0.496
  170   2HA   GLY  26          1HA       GLY  26  -6.393  -5.926   0.232
  171    H    GLY  27           H        GLY  27  -8.452  -5.926   2.458
  172   1HA   GLY  27          2HA       GLY  27  -7.499  -6.900   4.644
  173   2HA   GLY  27          1HA       GLY  27  -6.635  -5.368   4.767
  174    H    TRP  28           H        TRP  28  -8.116  -3.385   4.600
  175    HA   TRP  28           HA       TRP  28 -10.585  -3.893   6.201
  176   1HB   TRP  28          2HB       TRP  28  -8.785  -2.517   7.289
  177   2HB   TRP  28          1HB       TRP  28  -8.978  -1.327   6.003
  178    HD1  TRP  28           HD1      TRP  28 -10.962  -2.947   8.879
  179    HE1  TRP  28           HE1      TRP  28 -12.822  -1.318   9.602
  180    HE3  TRP  28           HE3      TRP  28 -10.402   0.673   5.320
  181    HZ2  TRP  28           HZ2      TRP  28 -13.925   1.189   8.784
  182    HZ3  TRP  28           HZ3      TRP  28 -11.868   2.669   5.318
  183    HH2  TRP  28           HH2      TRP  28 -13.630   2.930   7.043
  184    H    HIS  29           H        HIS  29 -12.007  -4.187   4.448
  185    HA   HIS  29           HA       HIS  29 -13.461  -3.552   2.731
  186   1HB   HIS  29          2HB       HIS  29 -12.785  -0.748   3.675
  187   2HB   HIS  29          1HB       HIS  29 -14.214  -1.227   2.766
  188    HD1  HIS  29           HD1      HIS  29 -14.157   0.016   5.736
  189    HD2  HIS  29           HD2      HIS  29 -14.718  -3.994   4.750
  190    HE1  HIS  29           HE1      HIS  29 -15.329  -1.051   7.713
  191    H    ARG  30           H        ARG  30 -10.575  -3.837   2.134
  192    HA   ARG  30           HA       ARG  30  -9.085  -3.462   0.372
  193   1HB   ARG  30          2HB       ARG  30 -11.243  -4.038  -0.880
  194   2HB   ARG  30          1HB       ARG  30 -11.447  -2.303  -1.118
  195   1HG   ARG  30          2HG       ARG  30  -9.664  -2.150  -2.570
  196   2HG   ARG  30          1HG       ARG  30  -8.784  -3.464  -1.793
  197   1HD   ARG  30          2HD       ARG  30 -11.347  -4.135  -3.172
  198   2HD   ARG  30          1HD       ARG  30  -9.940  -3.785  -4.176
  199    HE   ARG  30           HE       ARG  30  -9.285  -5.663  -2.070
  200   1HH1  ARG  30          2HH1      ARG  30  -8.153  -5.937  -4.767
  201   2HH1  ARG  30          1HH1      ARG  30  -9.029  -7.276  -5.431
  202   1HH2  ARG  30          1HH2      ARG  30 -11.577  -7.112  -3.072
  203   2HH2  ARG  30          2HH2      ARG  30 -10.974  -7.944  -4.466
  204    H    LEU  31           H        LEU  31  -9.682  -1.297   2.374
  205    HA   LEU  31           HA       LEU  31  -8.947   1.097   0.753
  206   1HB   LEU  31          2HB       LEU  31 -10.225   0.822   3.482
  207   2HB   LEU  31          1HB       LEU  31  -9.612   2.355   2.863
  208    HG   LEU  31           HG       LEU  31 -11.539   0.695   1.243
  209   1HD1  LEU  31          1HD1      LEU  31 -13.392   1.935   2.216
  210   2HD1  LEU  31          2HD1      LEU  31 -12.287   2.840   3.250
  211   3HD1  LEU  31          3HD1      LEU  31 -12.519   1.112   3.509
  212   1HD2  LEU  31          1HD2      LEU  31 -10.909   3.663   1.385
  213   2HD2  LEU  31          2HD2      LEU  31 -12.064   2.916   0.282
  214   3HD2  LEU  31          3HD2      LEU  31 -10.345   2.551   0.138
  215    H    ARG  32           H        ARG  32  -7.783  -1.162   3.116
  216    HA   ARG  32           HA       ARG  32  -5.650   0.605   4.100
  217   1HB   ARG  32          2HB       ARG  32  -6.911  -1.495   5.240
  218   2HB   ARG  32          1HB       ARG  32  -5.529  -2.335   4.543
  219   1HG   ARG  32          2HG       ARG  32  -4.348  -1.659   6.343
  220   2HG   ARG  32          1HG       ARG  32  -4.429  -0.028   5.678
  221   1HD   ARG  32          2HD       ARG  32  -6.684   0.205   6.834
  222   2HD   ARG  32          1HD       ARG  32  -6.319  -1.305   7.669
  223    HE   ARG  32           HE       ARG  32  -4.109   0.117   8.279
  224   1HH1  ARG  32          2HH1      ARG  32  -6.500  -0.080  10.163
  225   2HH1  ARG  32          1HH1      ARG  32  -6.784   1.589  10.526
  226   1HH2  ARG  32          1HH2      ARG  32  -4.851   2.760   7.882
  227   2HH2  ARG  32          2HH2      ARG  32  -5.843   3.205   9.230
  228    H    CYS  33           H        CYS  33  -3.486   0.476   3.459
  229    HA   CYS  33           HA       CYS  33  -2.994  -0.939   0.902
  230   1HB   CYS  33          2HB       CYS  33  -1.754   1.362   2.339
  231   2HB   CYS  33          1HB       CYS  33  -0.702   0.398   1.302
  232    H    THR  34           H        THR  34  -2.287  -3.003   1.125
  233    HA   THR  34           HA       THR  34  -0.577  -3.716   3.447
  234    HB   THR  34           HB       THR  34  -1.959  -5.444   1.367
  235    HG1  THR  34           HG1      THR  34  -3.567  -5.196   2.675
  236   1HG2  THR  34          1HG2      THR  34  -1.337  -7.315   2.889
  237   2HG2  THR  34          2HG2      THR  34  -0.387  -6.184   3.853
  238   3HG2  THR  34          3HG2      THR  34   0.075  -6.528   2.186
  239    H    CYS  35           H        CYS  35   1.568  -3.440   3.083
  240    HA   CYS  35           HA       CYS  35   2.642  -3.836   0.334
  241   1HB   CYS  35          2HB       CYS  35   4.215  -2.759   2.672
  242   2HB   CYS  35          1HB       CYS  35   4.485  -2.496   0.950
  243    H    TYR  36           H        TYR  36   4.654  -5.081   0.089
  244    HA   TYR  36           HA       TYR  36   4.977  -7.174   2.202
  245   1HB   TYR  36          2HB       TYR  36   5.761  -8.594   0.120
  246   2HB   TYR  36          1HB       TYR  36   4.047  -8.438   0.492
  247    HD1  TYR  36           HD1      TYR  36   2.555  -7.215  -0.946
  248    HD2  TYR  36           HD2      TYR  36   6.786  -7.216  -1.694
  249    HE1  TYR  36           HE1      TYR  36   2.160  -6.196  -3.170
  250    HE2  TYR  36           HE2      TYR  36   6.391  -6.198  -3.920
  251    HH   TYR  36           HH       TYR  36   3.164  -5.157  -4.930
  252    H    ARG  37           H        ARG  37   7.135  -8.153   2.303
  253    HA   ARG  37           HA       ARG  37   9.245  -6.209   2.305
  254   1HB   ARG  37          2HB       ARG  37   9.354  -9.237   2.451
  255   2HB   ARG  37          1HB       ARG  37  10.722  -8.172   2.774
  256   1HG   ARG  37          2HG       ARG  37   9.876  -7.465   4.789
  257   2HG   ARG  37          1HG       ARG  37   8.201  -7.584   4.248
  258   1HD   ARG  37          2HD       ARG  37   8.871 -10.198   4.173
  259   2HD   ARG  37          1HD       ARG  37   9.955  -9.663   5.456
  260    HE   ARG  37           HE       ARG  37   8.001  -8.994   6.759
  261   1HH1  ARG  37          2HH1      ARG  37   7.571 -11.808   5.293
  262   2HH1  ARG  37          1HH1      ARG  37   5.864 -11.701   5.025
  263   1HH2  ARG  37          1HH2      ARG  37   5.691  -8.311   5.763
  264   2HH2  ARG  37          2HH2      ARG  37   4.795  -9.718   5.294
  265    H    CYS  38           H        CYS  38  11.209  -6.233   1.027
  266    HA   CYS  38           HA       CYS  38  10.694  -6.970  -1.802
  267   1HB   CYS  38          2HB       CYS  38  11.569  -4.648  -0.947
  268   2HB   CYS  38          1HB       CYS  38  13.128  -5.471  -0.878
  269    H    GLY  39           HN       GLY  39  11.480  -8.880  -2.493
  270   1HA   GLY  39          2HA       GLY  39  12.968 -10.655  -2.855
  271   2HA   GLY  39          1HA       GLY  39  14.208  -9.691  -2.058
  Start of MODEL   17
    1   1H    GLY   1          1H        GLY   1  -8.320   4.872   1.412
    2   2H    GLY   1          2H        GLY   1  -8.753   4.879   3.055
    3   3H    GLY   1          3H        GLY   1  -7.696   3.689   2.457
    4   1HA   GLY   1          2HA       GLY   1  -7.064   6.588   2.408
    5   2HA   GLY   1          1HA       GLY   1  -6.603   5.526   3.739
    6    H    PHE   2           H        PHE   2  -4.492   6.606   2.609
    7    HA   PHE   2           HA       PHE   2  -2.469   6.178   1.508
    8   1HB   PHE   2          2HB       PHE   2  -3.445   3.310   1.424
    9   2HB   PHE   2          1HB       PHE   2  -1.772   3.868   1.379
   10    HD1  PHE   2           HD1      PHE   2  -1.082   5.441   3.424
   11    HD2  PHE   2           HD2      PHE   2  -4.326   2.627   3.470
   12    HE1  PHE   2           HE1      PHE   2  -1.004   5.393   5.902
   13    HE2  PHE   2           HE2      PHE   2  -4.246   2.577   5.948
   14    HZ   PHE   2           HZ       PHE   2  -2.585   3.960   7.164
   15    H    GLY   3           H        GLY   3  -4.996   6.699  -0.087
   16   1HA   GLY   3          2HA       GLY   3  -5.434   6.998  -2.365
   17   2HA   GLY   3          1HA       GLY   3  -3.855   6.298  -2.715
   18    H    CYS   4           H        CYS   4  -6.528   4.767  -0.916
   19    HA   CYS   4           HA       CYS   4  -6.461   2.545  -2.896
   20   1HB   CYS   4          2HB       CYS   4  -7.220   2.760  -0.008
   21   2HB   CYS   4          1HB       CYS   4  -7.994   1.513  -0.984
   22    HA   PRO   5           HA       PRO   5  -7.801   0.760  -2.973
   23   1HB   PRO   5          2HB       PRO   5  -9.196  -0.321  -5.075
   24   2HB   PRO   5          1HB       PRO   5  -9.777  -0.336  -3.401
   25   1HG   PRO   5          2HG       PRO   5 -10.711   1.318  -5.690
   26   2HG   PRO   5          1HG       PRO   5 -11.578   0.845  -4.219
   27   1HD   PRO   5          2HD       PRO   5 -10.370   3.376  -4.738
   28   2HD   PRO   5          1HD       PRO   5 -11.047   2.818  -3.192
   29    H    ASN   6           H        ASN   6  -7.313   3.373  -4.805
   30    HA   ASN   6           HA       ASN   6  -6.474   2.456  -7.368
   31   1HB   ASN   6          2HB       ASN   6  -6.746   4.884  -6.461
   32   2HB   ASN   6          1HB       ASN   6  -5.080   4.697  -5.911
   33   1HD2  ASN   6          1HD2      ASN   6  -7.137   4.843  -8.807
   34   2HD2  ASN   6          2HD2      ASN   6  -5.863   5.060  -9.907
   35    H    ASN   7           H        ASN   7  -5.079   0.757  -7.561
   36    HA   ASN   7           HA       ASN   7  -3.059   0.062  -5.654
   37   1HB   ASN   7          2HB       ASN   7  -3.606  -0.747  -8.502
   38   2HB   ASN   7          1HB       ASN   7  -2.159  -1.316  -7.668
   39   1HD2  ASN   7          1HD2      ASN   7  -2.416  -3.009  -6.131
   40   2HD2  ASN   7          2HD2      ASN   7  -3.921  -3.662  -5.698
   41    H    TYR   8           H        TYR   8  -2.981   2.210  -8.456
   42    HA   TYR   8           HA       TYR   8  -0.115   2.350  -8.698
   43   1HB   TYR   8          2HB       TYR   8  -1.484   3.176 -10.518
   44   2HB   TYR   8          1HB       TYR   8  -2.309   4.308  -9.451
   45    HD1  TYR   8           HD1      TYR   8   1.184   3.421 -10.519
   46    HD2  TYR   8           HD2      TYR   8  -1.587   6.514  -9.428
   47    HE1  TYR   8           HE1      TYR   8   2.912   5.136 -10.991
   48    HE2  TYR   8           HE2      TYR   8   0.140   8.229  -9.898
   49    HH   TYR   8           HH       TYR   8   2.958   8.047  -9.898
   50    H    GLN   9           H        GLN   9  -2.459   4.529  -7.076
   51    HA   GLN   9           HA       GLN   9  -0.438   6.122  -5.775
   52   1HB   GLN   9          2HB       GLN   9  -3.345   5.646  -5.030
   53   2HB   GLN   9          1HB       GLN   9  -2.317   6.897  -4.333
   54   1HG   GLN   9          2HG       GLN   9  -2.915   6.652  -7.296
   55   2HG   GLN   9          1HG       GLN   9  -3.780   7.725  -6.200
   56   1HE2  GLN   9          1HE2      GLN   9  -1.926   8.390  -8.528
   57   2HE2  GLN   9          2HE2      GLN   9  -0.743   9.406  -7.860
   58    H    CYS  10           H        CYS  10  -2.323   3.265  -4.840
   59    HA   CYS  10           HA       CYS  10  -1.484   3.027  -2.134
   60   1HB   CYS  10          2HB       CYS  10  -3.271   1.658  -3.309
   61   2HB   CYS  10          1HB       CYS  10  -1.972   0.731  -4.055
   62    H    HIS  11           H        HIS  11  -0.039   1.790  -5.148
   63    HA   HIS  11           HA       HIS  11   2.163   0.397  -4.000
   64   1HB   HIS  11          2HB       HIS  11   1.597   0.136  -6.360
   65   2HB   HIS  11          1HB       HIS  11   1.919   1.843  -6.660
   66    HD1  HIS  11           HD1      HIS  11   4.070  -0.564  -4.646
   67    HD2  HIS  11           HD2      HIS  11   4.257   1.665  -8.162
   68    HE1  HIS  11           HE1      HIS  11   6.439  -0.789  -5.509
   69    H    ARG  12           H        ARG  12   1.751   3.813  -4.908
   70    HA   ARG  12           HA       ARG  12   4.429   4.671  -4.420
   71   1HB   ARG  12          2HB       ARG  12   2.407   5.945  -5.483
   72   2HB   ARG  12          1HB       ARG  12   2.045   6.412  -3.822
   73   1HG   ARG  12          2HG       ARG  12   3.924   7.727  -3.632
   74   2HG   ARG  12          1HG       ARG  12   4.866   6.726  -4.737
   75   1HD   ARG  12          2HD       ARG  12   3.299   7.587  -6.586
   76   2HD   ARG  12          1HD       ARG  12   2.785   8.806  -5.418
   77    HE   ARG  12           HE       ARG  12   5.644   8.512  -6.265
   78   1HH1  ARG  12          1HH2      ARG  12   5.111  10.351  -4.004
   79   2HH1  ARG  12          2HH2      ARG  12   4.892  11.878  -4.793
   80   1HH2  ARG  12          2HH1      ARG  12   4.380  10.472  -7.931
   81   2HH2  ARG  12          1HH1      ARG  12   4.479  11.947  -7.029
   82    H    HIS  13           H        HIS  13   1.601   4.416  -2.254
   83    HA   HIS  13           HA       HIS  13   2.829   5.547   0.069
   84   1HB   HIS  13          2HB       HIS  13   0.430   5.239   0.033
   85   2HB   HIS  13          1HB       HIS  13   0.606   3.502  -0.220
   86    HD1  HIS  13           HD1      HIS  13   1.725   6.076   2.378
   87    HD2  HIS  13           HD2      HIS  13   0.494   2.100   2.152
   88    HE1  HIS  13           HE1      HIS  13   1.682   5.202   4.756
   89    H    CYS  14           H        CYS  14   2.728   2.204  -1.164
   90    HA   CYS  14           HA       CYS  14   4.095   1.037   1.091
   91   1HB   CYS  14          2HB       CYS  14   3.829   0.110  -1.783
   92   2HB   CYS  14          1HB       CYS  14   4.516  -0.868  -0.488
   93    H    LYS  15           H        LYS  15   5.169   2.612  -1.873
   94    HA   LYS  15           HA       LYS  15   7.922   1.788  -1.745
   95   1HB   LYS  15          2HB       LYS  15   6.448   4.015  -3.135
   96   2HB   LYS  15          1HB       LYS  15   8.212   3.966  -3.158
   97   1HG   LYS  15          2HG       LYS  15   7.917   1.492  -3.900
   98   2HG   LYS  15          1HG       LYS  15   6.261   1.963  -4.287
   99   1HD   LYS  15          2HD       LYS  15   8.536   3.655  -5.279
  100   2HD   LYS  15          1HD       LYS  15   8.143   2.157  -6.122
  101   1HE   LYS  15          2HE       LYS  15   6.359   3.114  -7.104
  102   2HE   LYS  15          1HE       LYS  15   5.719   3.618  -5.541
  103   1HZ   LYS  15          1HZ       LYS  15   7.062   5.575  -5.600
  104   2HZ   LYS  15          2HZ       LYS  15   6.207   5.481  -7.065
  105   3HZ   LYS  15          3HZ       LYS  15   7.855   5.065  -7.013
  106    H    SER  16           H        SER  16   6.171   4.624  -0.441
  107    HA   SER  16           HA       SER  16   8.510   5.962   0.558
  108   1HB   SER  16          2HB       SER  16   6.820   7.050   2.166
  109   2HB   SER  16          1HB       SER  16   6.551   7.296   0.445
  110    HG   SER  16           HG       SER  16   5.236   5.525   2.222
  111    H    ILE  17           H        ILE  17   6.524   3.335   1.814
  112    HA   ILE  17           HA       ILE  17   7.612   3.406   4.505
  113    HB   ILE  17           HB       ILE  17   6.295   1.117   3.003
  114   1HG1  ILE  17          2HG1      ILE  17   4.971   2.807   5.110
  115   2HG1  ILE  17          1HG1      ILE  17   5.049   3.402   3.451
  116   1HG2  ILE  17          1HG2      ILE  17   5.818   0.304   5.339
  117   2HG2  ILE  17          2HG2      ILE  17   6.886   1.569   5.944
  118   3HG2  ILE  17          3HG2      ILE  17   7.531   0.287   4.919
  119   1HD1  ILE  17          1HD1      ILE  17   3.466   1.949   2.754
  120   2HD1  ILE  17          2HD1      ILE  17   3.129   1.666   4.461
  121   3HD1  ILE  17          3HD1      ILE  17   4.230   0.597   3.591
  122    HA   PRO  18           HA       PRO  18  11.510   1.619   3.344
  123   1HB   PRO  18          2HB       PRO  18  12.515   1.492   5.901
  124   2HB   PRO  18          1HB       PRO  18  12.458   2.978   4.937
  125   1HG   PRO  18          2HG       PRO  18  10.745   2.167   7.238
  126   2HG   PRO  18          1HG       PRO  18  11.163   3.790   6.667
  127   1HD   PRO  18          2HD       PRO  18   8.715   2.450   6.201
  128   2HD   PRO  18          1HD       PRO  18   9.276   3.917   5.372
  129    H    GLY  19           H        GLY  19  11.813  -0.510   2.890
  130   1HA   GLY  19          2HA       GLY  19  12.342  -2.766   3.752
  131   2HA   GLY  19          1HA       GLY  19  11.052  -2.552   4.936
  132    H    ARG  20           H        ARG  20   9.155  -1.379   3.071
  133    HA   ARG  20           HA       ARG  20   8.202  -3.874   1.835
  134   1HB   ARG  20          2HB       ARG  20   6.848  -1.191   1.578
  135   2HB   ARG  20          1HB       ARG  20   6.119  -2.793   1.537
  136   1HG   ARG  20          2HG       ARG  20   7.510  -1.754   4.013
  137   2HG   ARG  20          1HG       ARG  20   5.808  -1.423   3.697
  138   1HD   ARG  20          2HD       ARG  20   6.181  -4.193   3.226
  139   2HD   ARG  20          1HD       ARG  20   7.013  -3.829   4.736
  140    HE   ARG  20           HE       ARG  20   4.248  -4.118   4.575
  141   1HH1  ARG  20          2HH1      ARG  20   6.432  -2.683   6.589
  142   2HH1  ARG  20          1HH1      ARG  20   5.371  -1.463   7.208
  143   1HH2  ARG  20          1HH2      ARG  20   2.880  -2.057   4.858
  144   2HH2  ARG  20          2HH2      ARG  20   3.355  -1.104   6.224
  145    H    CYS  21           H        CYS  21   7.955  -4.206  -0.387
  146    HA   CYS  21           HA       CYS  21   9.467  -2.318  -2.133
  147   1HB   CYS  21          2HB       CYS  21   9.412  -5.163  -1.936
  148   2HB   CYS  21          1HB       CYS  21   8.730  -4.729  -3.503
  149    H    GLY  22           H        GLY  22   6.542  -4.384  -2.249
  150   1HA   GLY  22          2HA       GLY  22   5.189  -2.227  -3.808
  151   2HA   GLY  22          1HA       GLY  22   5.076  -3.908  -4.333
  152    H    GLY  23           H        GLY  23   2.684  -2.833  -3.863
  153   1HA   GLY  23          2HA       GLY  23   1.719  -4.326  -1.552
  154   2HA   GLY  23          1HA       GLY  23   1.585  -2.584  -1.339
  155    H    TYR  24           H        TYR  24  -0.729  -3.850  -1.262
  156    HA   TYR  24           HA       TYR  24  -2.067  -3.042  -3.781
  157   1HB   TYR  24          2HB       TYR  24  -3.295  -5.131  -3.972
  158   2HB   TYR  24          1HB       TYR  24  -1.574  -5.507  -3.938
  159    HD1  TYR  24           HD1      TYR  24  -0.521  -6.393  -1.849
  160    HD2  TYR  24           HD2      TYR  24  -4.764  -5.803  -2.191
  161    HE1  TYR  24           HE1      TYR  24  -0.884  -7.821   0.146
  162    HE2  TYR  24           HE2      TYR  24  -5.124  -7.231  -0.198
  163    HH   TYR  24           HH       TYR  24  -3.531  -9.270   0.913
  164    H    CYS  25           H        CYS  25  -4.455  -2.828  -3.449
  165    HA   CYS  25           HA       CYS  25  -5.020  -1.822  -0.740
  166   1HB   CYS  25          2HB       CYS  25  -6.554  -1.763  -3.346
  167   2HB   CYS  25          1HB       CYS  25  -7.253  -1.198  -1.829
  168    H    GLY  26           H        GLY  26  -5.637  -3.305   0.748
  169   1HA   GLY  26          2HA       GLY  26  -8.005  -4.905   0.421
  170   2HA   GLY  26          1HA       GLY  26  -6.572  -5.918   0.264
  171    H    GLY  27           H        GLY  27  -8.681  -5.728   2.435
  172   1HA   GLY  27          2HA       GLY  27  -7.791  -6.576   4.699
  173   2HA   GLY  27          1HA       GLY  27  -6.898  -5.057   4.742
  174    H    TRP  28           H        TRP  28  -8.008  -3.143   5.238
  175    HA   TRP  28           HA       TRP  28 -10.573  -3.488   6.607
  176   1HB   TRP  28          2HB       TRP  28  -8.739  -1.990   7.461
  177   2HB   TRP  28          1HB       TRP  28  -9.030  -0.928   6.085
  178    HD1  TRP  28           HD1      TRP  28 -10.803  -2.300   9.214
  179    HE1  TRP  28           HE1      TRP  28 -12.666  -0.653   9.881
  180    HE3  TRP  28           HE3      TRP  28 -10.556   0.953   5.285
  181    HZ2  TRP  28           HZ2      TRP  28 -13.890   1.732   8.885
  182    HZ3  TRP  28           HZ3      TRP  28 -12.079   2.903   5.172
  183    HH2  TRP  28           HH2      TRP  28 -13.747   3.295   6.963
  184    H    HIS  29           H        HIS  29 -12.051  -3.983   4.939
  185    HA   HIS  29           HA       HIS  29 -13.588  -3.535   3.235
  186   1HB   HIS  29          2HB       HIS  29 -12.973  -0.638   3.892
  187   2HB   HIS  29          1HB       HIS  29 -14.432  -1.255   3.124
  188    HD1  HIS  29           HD1      HIS  29 -14.261   0.274   5.950
  189    HD2  HIS  29           HD2      HIS  29 -14.698  -3.833   5.392
  190    HE1  HIS  29           HE1      HIS  29 -15.271  -0.636   8.088
  191    H    ARG  30           H        ARG  30 -10.685  -3.737   2.586
  192    HA   ARG  30           HA       ARG  30  -9.274  -3.475   0.747
  193   1HB   ARG  30          2HB       ARG  30 -11.388  -4.286  -0.394
  194   2HB   ARG  30          1HB       ARG  30 -11.768  -2.597  -0.732
  195   1HG   ARG  30          2HG       ARG  30 -10.104  -2.390  -2.296
  196   2HG   ARG  30          1HG       ARG  30  -9.028  -3.501  -1.450
  197   1HD   ARG  30          2HD       ARG  30 -10.956  -5.242  -2.156
  198   2HD   ARG  30          1HD       ARG  30 -11.140  -4.074  -3.466
  199    HE   ARG  30           HE       ARG  30  -8.361  -4.870  -2.996
  200   1HH1  ARG  30          1HH2      ARG  30 -10.140  -4.177  -5.537
  201   2HH1  ARG  30          2HH2      ARG  30  -9.948  -5.658  -6.412
  202   1HH2  ARG  30          2HH1      ARG  30  -8.634  -7.397  -3.705
  203   2HH2  ARG  30          1HH1      ARG  30  -9.094  -7.487  -5.373
  204    H    LEU  31           H        LEU  31  -9.811  -1.174   2.562
  205    HA   LEU  31           HA       LEU  31  -9.221   1.076   0.686
  206   1HB   LEU  31          2HB       LEU  31 -10.404   1.123   3.477
  207   2HB   LEU  31          1HB       LEU  31  -9.987   2.561   2.547
  208    HG   LEU  31           HG       LEU  31 -11.796   0.470   1.357
  209   1HD1  LEU  31          1HD1      LEU  31 -13.735   1.574   2.287
  210   2HD1  LEU  31          2HD1      LEU  31 -12.727   2.801   3.055
  211   3HD1  LEU  31          3HD1      LEU  31 -12.674   1.133   3.624
  212   1HD2  LEU  31          1HD2      LEU  31 -10.866   2.309  -0.044
  213   2HD2  LEU  31          2HD2      LEU  31 -11.606   3.484   1.042
  214   3HD2  LEU  31          3HD2      LEU  31 -12.622   2.401   0.092
  215    H    ARG  32           H        ARG  32  -7.660  -1.051   2.700
  216    HA   ARG  32           HA       ARG  32  -5.705   0.974   3.686
  217   1HB   ARG  32          2HB       ARG  32  -6.792  -0.767   5.260
  218   2HB   ARG  32          1HB       ARG  32  -5.766  -1.950   4.449
  219   1HG   ARG  32          2HG       ARG  32  -3.859  -0.196   4.960
  220   2HG   ARG  32          1HG       ARG  32  -4.980   0.353   6.205
  221   1HD   ARG  32          2HD       ARG  32  -4.769  -1.568   7.440
  222   2HD   ARG  32          1HD       ARG  32  -4.547  -2.583   6.015
  223    HE   ARG  32           HE       ARG  32  -2.362  -0.798   7.018
  224   1HH1  ARG  32          1HH2      ARG  32  -2.976  -3.801   7.840
  225   2HH1  ARG  32          2HH2      ARG  32  -1.722  -4.589   6.942
  226   1HH2  ARG  32          2HH1      ARG  32  -1.013  -1.808   4.981
  227   2HH2  ARG  32          1HH1      ARG  32  -0.605  -3.456   5.325
  228    H    CYS  33           H        CYS  33  -3.481   0.728   3.147
  229    HA   CYS  33           HA       CYS  33  -3.001  -0.816   0.671
  230   1HB   CYS  33          2HB       CYS  33  -1.613   1.428   2.088
  231   2HB   CYS  33          1HB       CYS  33  -0.664   0.400   1.014
  232    H    THR  34           H        THR  34  -2.551  -2.943   1.094
  233    HA   THR  34           HA       THR  34  -0.874  -3.656   3.417
  234    HB   THR  34           HB       THR  34  -2.291  -5.345   1.337
  235    HG1  THR  34           HG1      THR  34  -2.716  -5.189   4.130
  236   1HG2  THR  34          1HG2      THR  34  -1.669  -7.216   2.992
  237   2HG2  THR  34          2HG2      THR  34  -0.468  -6.092   3.627
  238   3HG2  THR  34          3HG2      THR  34  -0.381  -6.618   1.946
  239    H    CYS  35           H        CYS  35   1.258  -3.321   3.097
  240    HA   CYS  35           HA       CYS  35   2.451  -3.937   0.438
  241   1HB   CYS  35          2HB       CYS  35   3.951  -2.592   2.667
  242   2HB   CYS  35          1HB       CYS  35   4.162  -2.420   0.925
  243    H    TYR  36           H        TYR  36   4.411  -5.216   0.368
  244    HA   TYR  36           HA       TYR  36   4.762  -6.986   2.756
  245   1HB   TYR  36          2HB       TYR  36   5.611  -8.645   0.881
  246   2HB   TYR  36          1HB       TYR  36   3.889  -8.486   1.213
  247    HD1  TYR  36           HD1      TYR  36   6.625  -7.492  -1.089
  248    HD2  TYR  36           HD2      TYR  36   2.386  -7.491  -0.384
  249    HE1  TYR  36           HE1      TYR  36   6.232  -6.781  -3.432
  250    HE2  TYR  36           HE2      TYR  36   1.996  -6.779  -2.725
  251    HH   TYR  36           HH       TYR  36   3.408  -7.044  -4.987
  252    H    ARG  37           H        ARG  37   6.946  -7.907   2.995
  253    HA   ARG  37           HA       ARG  37   9.009  -5.921   2.752
  254   1HB   ARG  37          2HB       ARG  37   9.005  -8.847   3.493
  255   2HB   ARG  37          1HB       ARG  37  10.512  -7.939   3.369
  256   1HG   ARG  37          2HG       ARG  37   9.784  -6.367   5.058
  257   2HG   ARG  37          1HG       ARG  37   8.167  -7.069   5.081
  258   1HD   ARG  37          2HD       ARG  37  10.657  -8.650   5.769
  259   2HD   ARG  37          1HD       ARG  37   9.688  -7.810   6.978
  260    HE   ARG  37           HE       ARG  37   7.803  -9.331   5.707
  261   1HH1  ARG  37          1HH2      ARG  37   9.991 -11.175   4.830
  262   2HH1  ARG  37          2HH2      ARG  37  10.068 -12.305   6.141
  263   1HH2  ARG  37          2HH1      ARG  37   8.300 -10.271   8.338
  264   2HH2  ARG  37          1HH1      ARG  37   9.104 -11.791   8.136
  265    H    CYS  38           H        CYS  38  10.951  -6.025   1.480
  266    HA   CYS  38           HA       CYS  38  10.499  -7.155  -1.219
  267   1HB   CYS  38          2HB       CYS  38  11.393  -4.747  -0.606
  268   2HB   CYS  38          1HB       CYS  38  12.942  -5.580  -0.470
  269    H    GLY  39           HN       GLY  39  11.583  -8.932  -1.967
  270   1HA   GLY  39          2HA       GLY  39  13.448 -10.303  -0.128
  271   2HA   GLY  39          1HA       GLY  39  12.735 -10.998  -1.584
  Start of MODEL   18
    1   1H    GLY   1          1H        GLY   1  -9.058   4.715   2.882
    2   2H    GLY   1          2H        GLY   1  -8.023   3.662   2.039
    3   3H    GLY   1          3H        GLY   1  -8.681   5.020   1.256
    4   1HA   GLY   1          2HA       GLY   1  -7.333   6.514   2.379
    5   2HA   GLY   1          1HA       GLY   1  -6.969   5.337   3.640
    6    H    PHE   2           H        PHE   2  -4.795   6.480   2.629
    7    HA   PHE   2           HA       PHE   2  -2.749   6.089   1.550
    8   1HB   PHE   2          2HB       PHE   2  -3.720   3.223   1.389
    9   2HB   PHE   2          1HB       PHE   2  -2.049   3.780   1.383
   10    HD1  PHE   2           HD1      PHE   2  -1.093   4.862   3.450
   11    HD2  PHE   2           HD2      PHE   2  -4.930   2.930   3.429
   12    HE1  PHE   2           HE1      PHE   2  -1.047   4.742   5.926
   13    HE2  PHE   2           HE2      PHE   2  -4.884   2.811   5.906
   14    HZ   PHE   2           HZ       PHE   2  -2.943   3.717   7.154
   15    H    GLY   3           H        GLY   3  -5.244   6.631  -0.102
   16   1HA   GLY   3          2HA       GLY   3  -5.639   6.944  -2.389
   17   2HA   GLY   3          1HA       GLY   3  -4.041   6.271  -2.708
   18    H    CYS   4           H        CYS   4  -6.845   4.789  -1.055
   19    HA   CYS   4           HA       CYS   4  -6.646   2.516  -2.976
   20   1HB   CYS   4          2HB       CYS   4  -7.542   2.759  -0.120
   21   2HB   CYS   4          1HB       CYS   4  -8.177   1.448  -1.113
   22    HA   PRO   5           HA       PRO   5  -7.957   0.704  -3.047
   23   1HB   PRO   5          2HB       PRO   5  -9.310  -0.447  -5.138
   24   2HB   PRO   5          1HB       PRO   5  -9.914  -0.425  -3.473
   25   1HG   PRO   5          2HG       PRO   5 -10.837   1.153  -5.819
   26   2HG   PRO   5          1HG       PRO   5 -11.717   0.715  -4.347
   27   1HD   PRO   5          2HD       PRO   5 -10.525   3.240  -4.927
   28   2HD   PRO   5          1HD       PRO   5 -11.226   2.725  -3.378
   29    H    ASN   6           H        ASN   6  -7.334   3.256  -4.829
   30    HA   ASN   6           HA       ASN   6  -6.558   2.425  -7.429
   31   1HB   ASN   6          2HB       ASN   6  -6.614   4.804  -6.422
   32   2HB   ASN   6          1HB       ASN   6  -5.002   4.443  -5.810
   33   1HD2  ASN   6          1HD2      ASN   6  -6.822   5.278  -8.673
   34   2HD2  ASN   6          2HD2      ASN   6  -5.508   5.287  -9.745
   35    H    ASN   7           H        ASN   7  -4.844   1.257  -8.184
   36    HA   ASN   7           HA       ASN   7  -3.132  -0.159  -6.290
   37   1HB   ASN   7          2HB       ASN   7  -3.421  -0.144  -9.293
   38   2HB   ASN   7          1HB       ASN   7  -2.064  -0.971  -8.528
   39   1HD2  ASN   7          1HD2      ASN   7  -2.686  -2.662  -6.821
   40   2HD2  ASN   7          2HD2      ASN   7  -4.139  -3.511  -7.042
   41    H    TYR   8           H        TYR   8  -2.639   2.388  -8.744
   42    HA   TYR   8           HA       TYR   8   0.202   2.566  -8.467
   43   1HB   TYR   8          2HB       TYR   8  -1.363   3.615 -10.265
   44   2HB   TYR   8          1HB       TYR   8  -1.543   4.940  -9.115
   45    HD1  TYR   8           HD1      TYR   8   0.283   6.446  -8.628
   46    HD2  TYR   8           HD2      TYR   8   0.854   3.075 -11.229
   47    HE1  TYR   8           HE1      TYR   8   2.466   7.375  -9.353
   48    HE2  TYR   8           HE2      TYR   8   3.036   4.004 -11.954
   49    HH   TYR   8           HH       TYR   8   4.741   6.109 -10.401
   50    H    GLN   9           H        GLN   9  -2.403   4.521  -6.964
   51    HA   GLN   9           HA       GLN   9  -0.665   6.091  -5.319
   52   1HB   GLN   9          2HB       GLN   9  -3.577   5.322  -4.980
   53   2HB   GLN   9          1HB       GLN   9  -2.746   6.488  -3.950
   54   1HG   GLN   9          2HG       GLN   9  -2.664   6.801  -6.942
   55   2HG   GLN   9          1HG       GLN   9  -4.067   7.363  -6.033
   56   1HE2  GLN   9          1HE2      GLN   9  -3.721   9.110  -4.446
   57   2HE2  GLN   9          2HE2      GLN   9  -2.333  10.084  -4.518
   58    H    CYS  10           H        CYS  10  -2.369   3.018  -4.701
   59    HA   CYS  10           HA       CYS  10  -1.563   2.752  -1.963
   60   1HB   CYS  10          2HB       CYS  10  -3.321   1.379  -3.266
   61   2HB   CYS  10          1HB       CYS  10  -1.959   0.419  -3.841
   62    H    HIS  11           H        HIS  11  -0.093   1.694  -5.019
   63    HA   HIS  11           HA       HIS  11   2.141   0.319  -3.846
   64   1HB   HIS  11          2HB       HIS  11   1.463  -0.011  -6.200
   65   2HB   HIS  11          1HB       HIS  11   1.886   1.663  -6.558
   66    HD1  HIS  11           HD1      HIS  11   3.877  -0.840  -4.494
   67    HD2  HIS  11           HD2      HIS  11   4.221   1.340  -8.029
   68    HE1  HIS  11           HE1      HIS  11   6.229  -1.229  -5.349
   69    H    ARG  12           H        ARG  12   1.598   3.678  -4.864
   70    HA   ARG  12           HA       ARG  12   4.259   4.645  -4.535
   71   1HB   ARG  12          2HB       ARG  12   2.177   5.821  -5.554
   72   2HB   ARG  12          1HB       ARG  12   1.814   6.295  -3.894
   73   1HG   ARG  12          2HG       ARG  12   3.982   7.395  -3.691
   74   2HG   ARG  12          1HG       ARG  12   4.447   6.839  -5.300
   75   1HD   ARG  12          2HD       ARG  12   3.055   8.344  -6.374
   76   2HD   ARG  12          1HD       ARG  12   1.906   8.395  -5.037
   77    HE   ARG  12           HE       ARG  12   3.173  10.147  -4.082
   78   1HH1  ARG  12          2HH1      ARG  12   5.827   8.782  -4.066
   79   2HH1  ARG  12          1HH1      ARG  12   6.756   9.760  -5.153
   80   1HH2  ARG  12          1HH2      ARG  12   3.975  11.292  -6.567
   81   2HH2  ARG  12          2HH2      ARG  12   5.703  11.186  -6.574
   82    H    HIS  13           H        HIS  13   1.562   4.347  -2.217
   83    HA   HIS  13           HA       HIS  13   2.858   5.607   0.001
   84   1HB   HIS  13          2HB       HIS  13   0.455   5.175   0.032
   85   2HB   HIS  13          1HB       HIS  13   0.734   3.437  -0.068
   86    HD1  HIS  13           HD1      HIS  13   1.915   6.262   2.233
   87    HD2  HIS  13           HD2      HIS  13   0.625   2.304   2.432
   88    HE1  HIS  13           HE1      HIS  13   1.928   5.627   4.685
   89    H    CYS  14           H        CYS  14   2.722   2.182  -1.017
   90    HA   CYS  14           HA       CYS  14   4.269   1.133   1.148
   91   1HB   CYS  14          2HB       CYS  14   3.922   0.147  -1.698
   92   2HB   CYS  14          1HB       CYS  14   4.718  -0.778  -0.426
   93    H    LYS  15           H        LYS  15   5.178   2.685  -1.887
   94    HA   LYS  15           HA       LYS  15   7.953   1.974  -1.899
   95   1HB   LYS  15          2HB       LYS  15   6.295   4.125  -3.168
   96   2HB   LYS  15          1HB       LYS  15   8.049   4.298  -3.188
   97   1HG   LYS  15          2HG       LYS  15   7.818   1.701  -3.953
   98   2HG   LYS  15          1HG       LYS  15   6.323   2.358  -4.621
   99   1HD   LYS  15          2HD       LYS  15   7.918   4.294  -5.460
  100   2HD   LYS  15          1HD       LYS  15   9.164   3.057  -5.282
  101   1HE   LYS  15          2HE       LYS  15   7.667   1.526  -6.663
  102   2HE   LYS  15          1HE       LYS  15   6.684   2.948  -7.017
  103   1HZ   LYS  15          1HZ       LYS  15   9.575   2.614  -7.618
  104   2HZ   LYS  15          2HZ       LYS  15   8.681   4.034  -7.897
  105   3HZ   LYS  15          3HZ       LYS  15   8.308   2.609  -8.746
  106    H    SER  16           H        SER  16   6.269   4.885  -0.642
  107    HA   SER  16           HA       SER  16   8.583   6.192   0.377
  108   1HB   SER  16          2HB       SER  16   6.763   7.111   2.101
  109   2HB   SER  16          1HB       SER  16   6.784   7.631   0.421
  110    HG   SER  16           HG       SER  16   5.248   5.471   1.465
  111    H    ILE  17           H        ILE  17   6.737   3.490   1.655
  112    HA   ILE  17           HA       ILE  17   7.910   3.696   4.332
  113    HB   ILE  17           HB       ILE  17   6.424   1.372   3.066
  114   1HG1  ILE  17          2HG1      ILE  17   5.177   3.256   5.033
  115   2HG1  ILE  17          1HG1      ILE  17   5.325   3.792   3.360
  116   1HG2  ILE  17          1HG2      ILE  17   6.021   0.718   5.411
  117   2HG2  ILE  17          2HG2      ILE  17   6.964   2.101   5.964
  118   3HG2  ILE  17          3HG2      ILE  17   7.750   0.797   5.075
  119   1HD1  ILE  17          1HD1      ILE  17   3.381   2.672   3.034
  120   2HD1  ILE  17          2HD1      ILE  17   3.564   1.740   4.520
  121   3HD1  ILE  17          3HD1      ILE  17   4.390   1.226   3.048
  122    HA   PRO  18           HA       PRO  18  11.626   1.617   3.045
  123   1HB   PRO  18          2HB       PRO  18  12.796   1.635   5.535
  124   2HB   PRO  18          1HB       PRO  18  12.754   3.041   4.459
  125   1HG   PRO  18          2HG       PRO  18  11.161   2.518   6.923
  126   2HG   PRO  18          1HG       PRO  18  11.625   4.064   6.194
  127   1HD   PRO  18          2HD       PRO  18   9.082   2.835   5.997
  128   2HD   PRO  18          1HD       PRO  18   9.662   4.199   5.017
  129    H    GLY  19           H        GLY  19  12.119  -0.554   2.939
  130   1HA   GLY  19          2HA       GLY  19  12.461  -2.741   3.969
  131   2HA   GLY  19          1HA       GLY  19  11.189  -2.356   5.126
  132    H    ARG  20           H        ARG  20   9.602  -1.214   2.714
  133    HA   ARG  20           HA       ARG  20   8.555  -3.859   1.803
  134   1HB   ARG  20          2HB       ARG  20   6.960  -1.353   1.457
  135   2HB   ARG  20          1HB       ARG  20   6.410  -2.989   1.806
  136   1HG   ARG  20          2HG       ARG  20   7.919  -1.292   3.814
  137   2HG   ARG  20          1HG       ARG  20   6.160  -1.341   3.722
  138   1HD   ARG  20          2HD       ARG  20   6.065  -3.605   4.359
  139   2HD   ARG  20          1HD       ARG  20   7.755  -3.890   3.944
  140    HE   ARG  20           HE       ARG  20   6.878  -2.302   6.328
  141   1HH1  ARG  20          1HH2      ARG  20   8.076  -5.263   5.900
  142   2HH1  ARG  20          2HH2      ARG  20   9.618  -5.015   6.651
  143   1HH2  ARG  20          2HH1      ARG  20   9.315  -1.555   6.739
  144   2HH2  ARG  20          1HH1      ARG  20  10.319  -2.911   7.127
  145    H    CYS  21           H        CYS  21   8.235  -4.202  -0.427
  146    HA   CYS  21           HA       CYS  21   9.634  -2.260  -2.195
  147   1HB   CYS  21          2HB       CYS  21   9.501  -5.119  -2.099
  148   2HB   CYS  21          1HB       CYS  21   8.818  -4.585  -3.635
  149    H    GLY  22           H        GLY  22   6.620  -4.202  -2.164
  150   1HA   GLY  22          2HA       GLY  22   5.280  -1.970  -3.601
  151   2HA   GLY  22          1HA       GLY  22   5.141  -3.602  -4.248
  152    H    GLY  23           H        GLY  23   2.756  -2.727  -3.746
  153   1HA   GLY  23          2HA       GLY  23   1.835  -4.284  -1.468
  154   2HA   GLY  23          1HA       GLY  23   1.645  -2.553  -1.207
  155    H    TYR  24           H        TYR  24  -0.673  -3.564  -1.124
  156    HA   TYR  24           HA       TYR  24  -1.992  -2.863  -3.660
  157   1HB   TYR  24          2HB       TYR  24  -3.197  -4.960  -3.884
  158   2HB   TYR  24          1HB       TYR  24  -1.473  -5.323  -3.836
  159    HD1  TYR  24           HD1      TYR  24  -0.432  -6.184  -1.718
  160    HD2  TYR  24           HD2      TYR  24  -4.679  -5.697  -2.148
  161    HE1  TYR  24           HE1      TYR  24  -0.800  -7.632   0.259
  162    HE2  TYR  24           HE2      TYR  24  -5.045  -7.147  -0.172
  163    HH   TYR  24           HH       TYR  24  -3.380  -9.167   0.960
  164    H    CYS  25           H        CYS  25  -4.397  -2.747  -3.349
  165    HA   CYS  25           HA       CYS  25  -5.020  -1.727  -0.656
  166   1HB   CYS  25          2HB       CYS  25  -6.532  -1.760  -3.276
  167   2HB   CYS  25          1HB       CYS  25  -7.263  -1.199  -1.771
  168    H    GLY  26           H        GLY  26  -5.626  -3.201   0.847
  169   1HA   GLY  26          2HA       GLY  26  -7.930  -4.876   0.525
  170   2HA   GLY  26          1HA       GLY  26  -6.474  -5.855   0.351
  171    H    GLY  27           H        GLY  27  -8.561  -5.740   2.527
  172   1HA   GLY  27          2HA       GLY  27  -7.597  -6.565   4.786
  173   2HA   GLY  27          1HA       GLY  27  -6.821  -4.982   4.837
  174    H    TRP  28           H        TRP  28  -8.257  -3.079   4.834
  175    HA   TRP  28           HA       TRP  28 -10.785  -3.656   6.294
  176   1HB   TRP  28          2HB       TRP  28  -9.070  -2.137   7.340
  177   2HB   TRP  28          1HB       TRP  28  -9.327  -1.011   6.010
  178    HD1  TRP  28           HD1      TRP  28 -11.219  -2.635   8.942
  179    HE1  TRP  28           HE1      TRP  28 -13.190  -1.106   9.586
  180    HE3  TRP  28           HE3      TRP  28 -10.883   0.855   5.228
  181    HZ2  TRP  28           HZ2      TRP  28 -14.455   1.282   8.655
  182    HZ3  TRP  28           HZ3      TRP  28 -12.481   2.746   5.134
  183    HH2  TRP  28           HH2      TRP  28 -14.267   2.962   6.839
  184    H    HIS  29           H        HIS  29 -12.134  -4.113   4.514
  185    HA   HIS  29           HA       HIS  29 -13.588  -3.628   2.752
  186   1HB   HIS  29          2HB       HIS  29 -13.123  -0.755   3.609
  187   2HB   HIS  29          1HB       HIS  29 -14.503  -1.368   2.702
  188    HD1  HIS  29           HD1      HIS  29 -14.571  -0.024   5.632
  189    HD2  HIS  29           HD2      HIS  29 -14.838  -4.092   4.773
  190    HE1  HIS  29           HE1      HIS  29 -15.689  -1.106   7.632
  191    H    ARG  30           H        ARG  30 -10.670  -3.728   2.221
  192    HA   ARG  30           HA       ARG  30  -9.197  -3.341   0.443
  193   1HB   ARG  30          2HB       ARG  30 -11.367  -4.014  -0.780
  194   2HB   ARG  30          1HB       ARG  30 -11.575  -2.293  -1.096
  195   1HG   ARG  30          2HG       ARG  30  -9.468  -2.187  -2.282
  196   2HG   ARG  30          1HG       ARG  30  -9.068  -3.839  -1.813
  197   1HD   ARG  30          2HD       ARG  30 -11.524  -3.154  -3.443
  198   2HD   ARG  30          1HD       ARG  30  -9.973  -3.555  -4.180
  199    HE   ARG  30           HE       ARG  30 -10.207  -5.746  -2.770
  200   1HH1  ARG  30          1HH2      ARG  30 -12.980  -4.944  -1.829
  201   2HH1  ARG  30          2HH2      ARG  30 -13.986  -5.808  -2.945
  202   1HH2  ARG  30          2HH1      ARG  30 -11.408  -6.412  -5.200
  203   2HH2  ARG  30          1HH1      ARG  30 -13.091  -6.643  -4.863
  204    H    LEU  31           H        LEU  31  -9.890  -1.148   2.397
  205    HA   LEU  31           HA       LEU  31  -9.251   1.219   0.698
  206   1HB   LEU  31          2HB       LEU  31 -10.608   0.978   3.387
  207   2HB   LEU  31          1HB       LEU  31 -10.020   2.518   2.760
  208    HG   LEU  31           HG       LEU  31 -11.915   0.715   1.229
  209   1HD1  LEU  31          1HD1      LEU  31 -13.706   2.215   1.933
  210   2HD1  LEU  31          2HD1      LEU  31 -12.566   3.182   2.867
  211   3HD1  LEU  31          3HD1      LEU  31 -12.928   1.528   3.358
  212   1HD2  LEU  31          1HD2      LEU  31 -10.930   3.561   0.895
  213   2HD2  LEU  31          2HD2      LEU  31 -12.336   2.932   0.038
  214   3HD2  LEU  31          3HD2      LEU  31 -10.747   2.218  -0.233
  215    H    ARG  32           H        ARG  32  -7.803  -0.988   2.812
  216    HA   ARG  32           HA       ARG  32  -5.841   1.012   3.821
  217   1HB   ARG  32          2HB       ARG  32  -7.009  -0.861   5.277
  218   2HB   ARG  32          1HB       ARG  32  -5.774  -1.898   4.562
  219   1HG   ARG  32          2HG       ARG  32  -4.394   0.419   5.334
  220   2HG   ARG  32          1HG       ARG  32  -5.506   0.099   6.663
  221   1HD   ARG  32          2HD       ARG  32  -4.590  -2.422   6.151
  222   2HD   ARG  32          1HD       ARG  32  -3.167  -1.462   5.745
  223    HE   ARG  32           HE       ARG  32  -4.502  -0.987   8.364
  224   1HH1  ARG  32          1HH2      ARG  32  -2.784  -3.542   8.000
  225   2HH1  ARG  32          2HH2      ARG  32  -1.276  -2.998   8.655
  226   1HH2  ARG  32          2HH1      ARG  32  -2.143   0.368   8.545
  227   2HH2  ARG  32          1HH1      ARG  32  -0.911  -0.776   8.962
  228    H    CYS  33           H        CYS  33  -3.593   0.728   3.354
  229    HA   CYS  33           HA       CYS  33  -3.085  -0.817   0.875
  230   1HB   CYS  33          2HB       CYS  33  -1.776   1.499   2.231
  231   2HB   CYS  33          1HB       CYS  33  -0.767   0.453   1.233
  232    H    THR  34           H        THR  34  -2.321  -2.841   1.110
  233    HA   THR  34           HA       THR  34  -0.735  -3.514   3.539
  234    HB   THR  34           HB       THR  34  -2.159  -5.269   1.514
  235    HG1  THR  34           HG1      THR  34  -3.732  -4.909   2.843
  236   1HG2  THR  34          1HG2      THR  34  -0.601  -6.031   4.002
  237   2HG2  THR  34          2HG2      THR  34  -0.106  -6.355   2.341
  238   3HG2  THR  34          3HG2      THR  34  -1.539  -7.140   3.003
  239    H    CYS  35           H        CYS  35   1.419  -3.301   3.207
  240    HA   CYS  35           HA       CYS  35   2.540  -3.789   0.496
  241   1HB   CYS  35          2HB       CYS  35   4.087  -2.718   2.852
  242   2HB   CYS  35          1HB       CYS  35   4.405  -2.490   1.135
  243    H    TYR  36           H        TYR  36   4.542  -5.068   0.314
  244    HA   TYR  36           HA       TYR  36   4.793  -7.130   2.467
  245   1HB   TYR  36          2HB       TYR  36   5.568  -8.611   0.422
  246   2HB   TYR  36          1HB       TYR  36   3.855  -8.419   0.777
  247    HD1  TYR  36           HD1      TYR  36   6.633  -7.241  -1.398
  248    HD2  TYR  36           HD2      TYR  36   2.389  -7.264  -0.724
  249    HE1  TYR  36           HE1      TYR  36   6.267  -6.282  -3.656
  250    HE2  TYR  36           HE2      TYR  36   2.025  -6.305  -2.979
  251    HH   TYR  36           HH       TYR  36   3.252  -5.012  -4.651
  252    H    ARG  37           H        ARG  37   6.945  -8.187   2.539
  253    HA   ARG  37           HA       ARG  37   9.086  -6.257   2.526
  254   1HB   ARG  37          2HB       ARG  37   9.074  -9.272   2.825
  255   2HB   ARG  37          1HB       ARG  37  10.524  -8.285   3.004
  256   1HG   ARG  37          2HG       ARG  37   9.750  -7.261   4.953
  257   2HG   ARG  37          1HG       ARG  37   8.058  -7.582   4.570
  258   1HD   ARG  37          2HD       ARG  37   8.553 -10.044   4.868
  259   2HD   ARG  37          1HD       ARG  37  10.142  -9.585   5.481
  260    HE   ARG  37           HE       ARG  37   8.958  -8.395   7.334
  261   1HH1  ARG  37          1HH2      ARG  37   6.215  -8.257   6.259
  262   2HH1  ARG  37          2HH2      ARG  37   5.421  -9.585   7.038
  263   1HH2  ARG  37          2HH1      ARG  37   8.382 -11.152   7.969
  264   2HH2  ARG  37          1HH1      ARG  37   6.653 -11.230   8.011
  265    H    CYS  38           H        CYS  38  11.075  -6.398   1.268
  266    HA   CYS  38           HA       CYS  38  10.544  -7.225  -1.537
  267   1HB   CYS  38          2HB       CYS  38  11.437  -4.873  -0.779
  268   2HB   CYS  38          1HB       CYS  38  12.989  -5.705  -0.676
  269    H    GLY  39           HN       GLY  39  11.440  -9.068  -2.291
  270   1HA   GLY  39          2HA       GLY  39  13.492 -10.453  -0.670
  271   2HA   GLY  39          1HA       GLY  39  12.598 -11.151  -2.021
  Start of MODEL   19
    1   1H    GLY   1          1H        GLY   1  -7.566   3.407   2.125
    2   2H    GLY   1          2H        GLY   1  -8.330   4.738   1.396
    3   3H    GLY   1          3H        GLY   1  -8.626   4.376   3.029
    4   1HA   GLY   1          2HA       GLY   1  -7.053   6.291   2.552
    5   2HA   GLY   1          1HA       GLY   1  -6.518   5.075   3.710
    6    H    PHE   2           H        PHE   2  -4.605   6.579   2.475
    7    HA   PHE   2           HA       PHE   2  -2.624   6.440   1.231
    8   1HB   PHE   2          2HB       PHE   2  -3.177   3.460   1.211
    9   2HB   PHE   2          1HB       PHE   2  -1.611   4.253   1.052
   10    HD1  PHE   2           HD1      PHE   2  -1.014   5.927   3.047
   11    HD2  PHE   2           HD2      PHE   2  -3.810   2.675   3.310
   12    HE1  PHE   2           HE1      PHE   2  -0.763   5.909   5.514
   13    HE2  PHE   2           HE2      PHE   2  -3.558   2.658   5.777
   14    HZ   PHE   2           HZ       PHE   2  -2.035   4.274   6.878
   15    H    GLY   3           H        GLY   3  -5.212   6.711  -0.219
   16   1HA   GLY   3          2HA       GLY   3  -5.816   6.926  -2.470
   17   2HA   GLY   3          1HA       GLY   3  -4.212   6.344  -2.904
   18    H    CYS   4           H        CYS   4  -6.837   4.770  -1.038
   19    HA   CYS   4           HA       CYS   4  -6.599   2.439  -2.883
   20   1HB   CYS   4          2HB       CYS   4  -7.451   2.746  -0.018
   21   2HB   CYS   4          1HB       CYS   4  -8.028   1.368  -0.953
   22    HA   PRO   5           HA       PRO   5  -7.867   0.573  -2.830
   23   1HB   PRO   5          2HB       PRO   5  -9.227  -0.706  -4.840
   24   2HB   PRO   5          1HB       PRO   5  -9.798  -0.630  -3.166
   25   1HG   PRO   5          2HG       PRO   5 -10.814   0.819  -5.555
   26   2HG   PRO   5          1HG       PRO   5 -11.651   0.419  -4.048
   27   1HD   PRO   5          2HD       PRO   5 -10.545   2.951  -4.758
   28   2HD   PRO   5          1HD       PRO   5 -11.198   2.482  -3.174
   29    H    ASN   6           H        ASN   6  -7.353   3.063  -4.734
   30    HA   ASN   6           HA       ASN   6  -6.603   2.136  -7.308
   31   1HB   ASN   6          2HB       ASN   6  -6.695   4.559  -6.398
   32   2HB   ASN   6          1HB       ASN   6  -5.055   4.258  -5.822
   33   1HD2  ASN   6          1HD2      ASN   6  -7.027   4.706  -8.721
   34   2HD2  ASN   6          2HD2      ASN   6  -5.725   4.787  -9.808
   35    H    ASN   7           H        ASN   7  -4.858   1.006  -8.054
   36    HA   ASN   7           HA       ASN   7  -3.105  -0.319  -6.135
   37   1HB   ASN   7          2HB       ASN   7  -3.349  -0.369  -9.146
   38   2HB   ASN   7          1HB       ASN   7  -2.041  -1.209  -8.314
   39   1HD2  ASN   7          1HD2      ASN   7  -2.668  -2.963  -6.780
   40   2HD2  ASN   7          2HD2      ASN   7  -4.171  -3.731  -6.948
   41    H    TYR   8           H        TYR   8  -2.669   2.173  -8.657
   42    HA   TYR   8           HA       TYR   8   0.167   2.414  -8.398
   43   1HB   TYR   8          2HB       TYR   8  -0.836   3.406 -10.322
   44   2HB   TYR   8          1HB       TYR   8  -1.986   4.317  -9.348
   45    HD1  TYR   8           HD1      TYR   8  -1.533   6.556  -8.882
   46    HD2  TYR   8           HD2      TYR   8   1.721   3.903  -9.791
   47    HE1  TYR   8           HE1      TYR   8   0.048   8.464  -8.793
   48    HE2  TYR   8           HE2      TYR   8   3.302   5.812  -9.701
   49    HH   TYR   8           HH       TYR   8   2.723   8.694 -10.076
   50    H    GLN   9           H        GLN   9  -2.454   4.367  -6.920
   51    HA   GLN   9           HA       GLN   9  -0.732   5.987  -5.317
   52   1HB   GLN   9          2HB       GLN   9  -3.613   5.173  -4.830
   53   2HB   GLN   9          1HB       GLN   9  -2.773   6.478  -3.994
   54   1HG   GLN   9          2HG       GLN   9  -2.930   6.414  -7.007
   55   2HG   GLN   9          1HG       GLN   9  -4.234   7.106  -6.043
   56   1HE2  GLN   9          1HE2      GLN   9  -3.684   9.000  -4.660
   57   2HE2  GLN   9          2HE2      GLN   9  -2.330   9.954  -5.030
   58    H    CYS  10           H        CYS  10  -2.415   2.920  -4.590
   59    HA   CYS  10           HA       CYS  10  -1.567   2.730  -1.860
   60   1HB   CYS  10          2HB       CYS  10  -3.355   1.326  -2.992
   61   2HB   CYS  10          1HB       CYS  10  -2.051   0.403  -3.737
   62    H    HIS  11           H        HIS  11  -0.142   1.542  -4.902
   63    HA   HIS  11           HA       HIS  11   2.091   0.193  -3.714
   64   1HB   HIS  11          2HB       HIS  11   1.183   0.152  -6.178
   65   2HB   HIS  11          1HB       HIS  11   2.260   1.530  -6.406
   66    HD1  HIS  11           HD1      HIS  11   2.236  -2.108  -6.355
   67    HD2  HIS  11           HD2      HIS  11   5.067   0.859  -5.616
   68    HE1  HIS  11           HE1      HIS  11   4.503  -3.236  -6.465
   69    H    ARG  12           H        ARG  12   1.635   3.527  -4.881
   70    HA   ARG  12           HA       ARG  12   4.299   4.460  -4.534
   71   1HB   ARG  12          2HB       ARG  12   2.217   5.634  -5.583
   72   2HB   ARG  12          1HB       ARG  12   1.901   6.185  -3.938
   73   1HG   ARG  12          2HG       ARG  12   4.644   6.642  -4.344
   74   2HG   ARG  12          1HG       ARG  12   3.867   7.147  -5.845
   75   1HD   ARG  12          2HD       ARG  12   3.286   9.061  -4.809
   76   2HD   ARG  12          1HD       ARG  12   2.197   8.111  -3.800
   77    HE   ARG  12           HE       ARG  12   3.803   8.205  -2.037
   78   1HH1  ARG  12          1HH2      ARG  12   4.272  10.986  -3.108
   79   2HH1  ARG  12          2HH2      ARG  12   5.997  11.022  -3.256
   80   1HH2  ARG  12          2HH1      ARG  12   6.351   7.571  -3.049
   81   2HH2  ARG  12          1HH1      ARG  12   7.180   9.083  -3.222
   82    H    HIS  13           H        HIS  13   1.627   4.136  -2.210
   83    HA   HIS  13           HA       HIS  13   2.937   5.492  -0.031
   84   1HB   HIS  13          2HB       HIS  13   0.538   5.168   0.060
   85   2HB   HIS  13          1HB       HIS  13   0.720   3.421  -0.087
   86    HD1  HIS  13           HD1      HIS  13   2.100   6.104   2.268
   87    HD2  HIS  13           HD2      HIS  13   0.541   2.241   2.393
   88    HE1  HIS  13           HE1      HIS  13   2.105   5.408   4.703
   89    H    CYS  14           H        CYS  14   2.719   2.054  -0.976
   90    HA   CYS  14           HA       CYS  14   4.271   1.074   1.245
   91   1HB   CYS  14          2HB       CYS  14   3.698  -0.089  -1.492
   92   2HB   CYS  14          1HB       CYS  14   4.552  -0.964  -0.222
   93    H    LYS  15           H        LYS  15   5.100   2.348  -1.937
   94    HA   LYS  15           HA       LYS  15   7.833   1.485  -2.006
   95   1HB   LYS  15          2HB       LYS  15   6.326   3.733  -3.344
   96   2HB   LYS  15          1HB       LYS  15   8.063   3.530  -3.577
   97   1HG   LYS  15          2HG       LYS  15   6.083   1.284  -4.022
   98   2HG   LYS  15          1HG       LYS  15   6.579   2.384  -5.308
   99   1HD   LYS  15          2HD       LYS  15   9.013   1.718  -4.398
  100   2HD   LYS  15          1HD       LYS  15   8.146   0.260  -3.918
  101   1HE   LYS  15          2HE       LYS  15   8.453  -0.453  -6.044
  102   2HE   LYS  15          1HE       LYS  15   7.221   0.725  -6.496
  103   1HZ   LYS  15          1HZ       LYS  15   9.061   2.386  -6.657
  104   2HZ   LYS  15          2HZ       LYS  15   9.120   1.147  -7.820
  105   3HZ   LYS  15          3HZ       LYS  15  10.164   1.107  -6.478
  106    H    SER  16           H        SER  16   6.291   4.454  -0.726
  107    HA   SER  16           HA       SER  16   8.742   5.770  -0.025
  108   1HB   SER  16          2HB       SER  16   7.332   7.148   1.484
  109   2HB   SER  16          1HB       SER  16   6.634   7.008  -0.124
  110    HG   SER  16           HG       SER  16   5.821   5.890   2.310
  111    H    ILE  17           H        ILE  17   6.870   3.243   1.545
  112    HA   ILE  17           HA       ILE  17   8.210   3.488   4.124
  113    HB   ILE  17           HB       ILE  17   6.684   1.126   2.975
  114   1HG1  ILE  17          2HG1      ILE  17   5.576   3.123   4.938
  115   2HG1  ILE  17          1HG1      ILE  17   5.523   3.472   3.211
  116   1HG2  ILE  17          1HG2      ILE  17   7.484   1.898   5.799
  117   2HG2  ILE  17          2HG2      ILE  17   8.037   0.490   4.892
  118   3HG2  ILE  17          3HG2      ILE  17   6.355   0.599   5.411
  119   1HD1  ILE  17          1HD1      ILE  17   4.669   0.768   3.599
  120   2HD1  ILE  17          2HD1      ILE  17   3.734   2.132   2.982
  121   3HD1  ILE  17          3HD1      ILE  17   3.771   1.798   4.714
  122    HA   PRO  18           HA       PRO  18  11.878   1.406   2.733
  123   1HB   PRO  18          2HB       PRO  18  13.114   1.363   5.190
  124   2HB   PRO  18          1HB       PRO  18  13.049   2.792   4.143
  125   1HG   PRO  18          2HG       PRO  18  11.516   2.221   6.636
  126   2HG   PRO  18          1HG       PRO  18  11.973   3.781   5.933
  127   1HD   PRO  18          2HD       PRO  18   9.417   2.581   5.772
  128   2HD   PRO  18          1HD       PRO  18   9.986   3.953   4.799
  129    H    GLY  19           H        GLY  19  12.335  -0.755   2.537
  130   1HA   GLY  19          2HA       GLY  19  12.720  -2.971   3.481
  131   2HA   GLY  19          1HA       GLY  19  11.505  -2.619   4.708
  132    H    ARG  20           H        ARG  20   9.764  -1.416   2.472
  133    HA   ARG  20           HA       ARG  20   8.653  -4.028   1.569
  134   1HB   ARG  20          2HB       ARG  20   7.062  -1.567   1.123
  135   2HB   ARG  20          1HB       ARG  20   6.551  -3.140   1.727
  136   1HG   ARG  20          2HG       ARG  20   8.119  -1.111   3.353
  137   2HG   ARG  20          1HG       ARG  20   6.373  -1.326   3.441
  138   1HD   ARG  20          2HD       ARG  20   6.569  -3.501   4.357
  139   2HD   ARG  20          1HD       ARG  20   8.260  -3.642   3.879
  140    HE   ARG  20           HE       ARG  20   8.838  -2.084   5.683
  141   1HH1  ARG  20          2HH1      ARG  20   5.617  -1.486   5.441
  142   2HH1  ARG  20          1HH1      ARG  20   5.221  -1.763   7.104
  143   1HH2  ARG  20          1HH2      ARG  20   8.309  -3.141   7.891
  144   2HH2  ARG  20          2HH2      ARG  20   6.747  -2.700   8.494
  145    H    CYS  21           H        CYS  21   8.379  -4.458  -0.623
  146    HA   CYS  21           HA       CYS  21   9.764  -2.603  -2.479
  147   1HB   CYS  21          2HB       CYS  21   9.555  -5.425  -2.301
  148   2HB   CYS  21          1HB       CYS  21   8.733  -4.952  -3.788
  149    H    GLY  22           H        GLY  22   6.567  -4.094  -2.003
  150   1HA   GLY  22          2HA       GLY  22   5.364  -1.918  -3.590
  151   2HA   GLY  22          1HA       GLY  22   5.109  -3.549  -4.207
  152    H    GLY  23           H        GLY  23   2.785  -2.662  -3.716
  153   1HA   GLY  23          2HA       GLY  23   1.832  -4.059  -1.364
  154   2HA   GLY  23          1HA       GLY  23   1.735  -2.315  -1.152
  155    H    TYR  24           H        TYR  24  -0.593  -3.627  -1.054
  156    HA   TYR  24           HA       TYR  24  -1.996  -2.696  -3.486
  157   1HB   TYR  24          2HB       TYR  24  -3.176  -4.803  -3.816
  158   2HB   TYR  24          1HB       TYR  24  -1.441  -5.109  -3.882
  159    HD1  TYR  24           HD1      TYR  24  -4.544  -5.731  -2.074
  160    HD2  TYR  24           HD2      TYR  24  -0.268  -6.104  -1.898
  161    HE1  TYR  24           HE1      TYR  24  -4.762  -7.356  -0.215
  162    HE2  TYR  24           HE2      TYR  24  -0.486  -7.728  -0.039
  163    HH   TYR  24           HH       TYR  24  -2.679  -8.073   1.855
  164    H    CYS  25           H        CYS  25  -4.428  -2.761  -3.115
  165    HA   CYS  25           HA       CYS  25  -5.000  -1.955  -0.321
  166   1HB   CYS  25          2HB       CYS  25  -6.709  -1.803  -2.825
  167   2HB   CYS  25          1HB       CYS  25  -7.157  -1.155  -1.249
  168    H    GLY  26           H        GLY  26  -5.900  -3.397   1.079
  169   1HA   GLY  26          2HA       GLY  26  -8.076  -5.135   0.423
  170   2HA   GLY  26          1HA       GLY  26  -6.582  -6.067   0.390
  171    H    GLY  27           H        GLY  27  -9.029  -5.773   2.319
  172   1HA   GLY  27          2HA       GLY  27  -8.419  -6.799   4.631
  173   2HA   GLY  27          1HA       GLY  27  -7.496  -5.311   4.840
  174    H    TRP  28           H        TRP  28  -8.633  -3.328   5.091
  175    HA   TRP  28           HA       TRP  28 -11.368  -3.655   6.156
  176   1HB   TRP  28          2HB       TRP  28  -9.626  -2.311   7.368
  177   2HB   TRP  28          1HB       TRP  28  -9.644  -1.163   6.032
  178    HD1  TRP  28           HD1      TRP  28 -11.987  -2.615   8.726
  179    HE1  TRP  28           HE1      TRP  28 -13.827  -0.880   9.218
  180    HE3  TRP  28           HE3      TRP  28 -10.874   0.887   5.179
  181    HZ2  TRP  28           HZ2      TRP  28 -14.709   1.658   8.242
  182    HZ3  TRP  28           HZ3      TRP  28 -12.226   2.951   4.987
  183    HH2  TRP  28           HH2      TRP  28 -14.143   3.341   6.509
  184    H    HIS  29           H        HIS  29 -12.656  -3.932   4.311
  185    HA   HIS  29           HA       HIS  29 -13.902  -3.302   2.436
  186   1HB   HIS  29          2HB       HIS  29 -13.152  -0.497   3.323
  187   2HB   HIS  29          1HB       HIS  29 -14.516  -0.940   2.301
  188    HD1  HIS  29           HD1      HIS  29 -14.684   0.442   5.196
  189    HD2  HIS  29           HD2      HIS  29 -15.348  -3.583   4.352
  190    HE1  HIS  29           HE1      HIS  29 -16.090  -0.466   7.098
  191    H    ARG  30           H        ARG  30 -10.980  -3.755   2.165
  192    HA   ARG  30           HA       ARG  30  -9.305  -3.557   0.550
  193   1HB   ARG  30          2HB       ARG  30 -11.422  -4.053  -0.862
  194   2HB   ARG  30          1HB       ARG  30 -11.380  -2.337  -1.268
  195   1HG   ARG  30          2HG       ARG  30  -9.356  -2.517  -2.414
  196   2HG   ARG  30          1HG       ARG  30  -8.872  -3.965  -1.531
  197   1HD   ARG  30          2HD       ARG  30  -9.518  -5.045  -3.430
  198   2HD   ARG  30          1HD       ARG  30 -11.139  -4.856  -2.761
  199    HE   ARG  30           HE       ARG  30 -10.018  -2.790  -4.605
  200   1HH1  ARG  30          1HH2      ARG  30 -11.131  -5.013  -6.146
  201   2HH1  ARG  30          2HH2      ARG  30 -12.809  -4.607  -6.291
  202   1HH2  ARG  30          2HH1      ARG  30 -12.733  -2.283  -3.706
  203   2HH2  ARG  30          1HH1      ARG  30 -13.721  -3.055  -4.900
  204    H    LEU  31           H        LEU  31  -9.839  -1.307   2.393
  205    HA   LEU  31           HA       LEU  31  -8.946   0.990   0.712
  206   1HB   LEU  31          2HB       LEU  31 -10.343   0.877   3.392
  207   2HB   LEU  31          1HB       LEU  31  -9.622   2.355   2.757
  208    HG   LEU  31           HG       LEU  31 -11.561   0.743   1.102
  209   1HD1  LEU  31          1HD1      LEU  31 -12.251   2.977   3.033
  210   2HD1  LEU  31          2HD1      LEU  31 -12.660   1.277   3.261
  211   3HD1  LEU  31          3HD1      LEU  31 -13.369   2.182   1.924
  212   1HD2  LEU  31          1HD2      LEU  31 -10.182   2.503   0.018
  213   2HD2  LEU  31          2HD2      LEU  31 -10.817   3.686   1.162
  214   3HD2  LEU  31          3HD2      LEU  31 -11.896   2.914   0.001
  215    H    ARG  32           H        ARG  32  -7.972  -1.209   3.217
  216    HA   ARG  32           HA       ARG  32  -5.799   0.484   4.226
  217   1HB   ARG  32          2HB       ARG  32  -7.020  -1.343   5.557
  218   2HB   ARG  32          1HB       ARG  32  -6.094  -2.505   4.609
  219   1HG   ARG  32          2HG       ARG  32  -4.570  -2.264   6.294
  220   2HG   ARG  32          1HG       ARG  32  -4.101  -0.828   5.385
  221   1HD   ARG  32          2HD       ARG  32  -4.413  -0.025   7.586
  222   2HD   ARG  32          1HD       ARG  32  -5.917   0.398   6.765
  223    HE   ARG  32           HE       ARG  32  -5.859  -2.178   8.233
  224   1HH1  ARG  32          1HH2      ARG  32  -8.217  -0.390   7.225
  225   2HH1  ARG  32          2HH2      ARG  32  -8.850   0.151   8.742
  226   1HH2  ARG  32          2HH1      ARG  32  -6.043  -0.824  10.550
  227   2HH2  ARG  32          1HH1      ARG  32  -7.610  -0.092  10.635
  228    H    CYS  33           H        CYS  33  -3.663   0.405   3.544
  229    HA   CYS  33           HA       CYS  33  -3.128  -1.096   1.048
  230   1HB   CYS  33          2HB       CYS  33  -1.927   1.269   2.412
  231   2HB   CYS  33          1HB       CYS  33  -0.861   0.289   1.404
  232    H    THR  34           H        THR  34  -2.307  -3.108   1.268
  233    HA   THR  34           HA       THR  34  -0.632  -3.754   3.638
  234    HB   THR  34           HB       THR  34  -1.904  -5.556   1.551
  235    HG1  THR  34           HG1      THR  34  -3.575  -5.206   2.761
  236   1HG2  THR  34          1HG2      THR  34  -1.331  -7.067   3.797
  237   2HG2  THR  34          2HG2      THR  34   0.080  -6.017   3.661
  238   3HG2  THR  34          3HG2      THR  34  -0.384  -7.051   2.309
  239    H    CYS  35           H        CYS  35   1.529  -3.518   3.321
  240    HA   CYS  35           HA       CYS  35   2.638  -3.817   0.576
  241   1HB   CYS  35          2HB       CYS  35   4.219  -2.887   2.963
  242   2HB   CYS  35          1HB       CYS  35   4.464  -2.507   1.259
  243    H    TYR  36           H        TYR  36   4.584  -5.104   0.256
  244    HA   TYR  36           HA       TYR  36   4.932  -7.255   2.307
  245   1HB   TYR  36          2HB       TYR  36   5.650  -8.639   0.187
  246   2HB   TYR  36          1HB       TYR  36   3.943  -8.452   0.571
  247    HD1  TYR  36           HD1      TYR  36   2.477  -7.121  -0.813
  248    HD2  TYR  36           HD2      TYR  36   6.693  -7.296  -1.628
  249    HE1  TYR  36           HE1      TYR  36   2.094  -6.056  -3.018
  250    HE2  TYR  36           HE2      TYR  36   6.308  -6.230  -3.834
  251    HH   TYR  36           HH       TYR  36   3.545  -6.123  -5.370
  252    H    ARG  37           H        ARG  37   7.105  -8.274   2.286
  253    HA   ARG  37           HA       ARG  37   9.197  -6.254   2.144
  254   1HB   ARG  37          2HB       ARG  37   9.211  -9.211   2.785
  255   2HB   ARG  37          1HB       ARG  37  10.681  -8.237   2.766
  256   1HG   ARG  37          2HG       ARG  37   8.610  -6.885   4.271
  257   2HG   ARG  37          1HG       ARG  37   8.855  -8.514   4.900
  258   1HD   ARG  37          2HD       ARG  37  10.578  -7.567   6.047
  259   2HD   ARG  37          1HD       ARG  37  11.441  -7.707   4.515
  260    HE   ARG  37           HE       ARG  37  10.391  -5.298   4.136
  261   1HH1  ARG  37          2HH1      ARG  37   9.488  -4.958   6.930
  262   2HH1  ARG  37          1HH1      ARG  37  10.856  -4.221   7.695
  263   1HH2  ARG  37          1HH2      ARG  37  13.069  -5.092   5.162
  264   2HH2  ARG  37          2HH2      ARG  37  12.892  -4.294   6.688
  265    H    CYS  38           H        CYS  38  11.208  -6.546   0.911
  266    HA   CYS  38           HA       CYS  38  10.639  -7.586  -1.817
  267   1HB   CYS  38          2HB       CYS  38  11.565  -5.175  -1.191
  268   2HB   CYS  38          1HB       CYS  38  13.109  -6.024  -1.174
  269    H    GLY  39           HN       GLY  39  11.580  -9.452  -2.470
  270   1HA   GLY  39          2HA       GLY  39  13.616 -10.721  -0.745
  271   2HA   GLY  39          1HA       GLY  39  12.760 -11.499  -2.075
  Start of MODEL   20
    1   1H    GLY   1          1H        GLY   1  -8.689   4.564   1.623
    2   2H    GLY   1          2H        GLY   1  -8.831   4.418   3.310
    3   3H    GLY   1          3H        GLY   1  -7.706   3.465   2.463
    4   1HA   GLY   1          2HA       GLY   1  -7.574   6.424   2.476
    5   2HA   GLY   1          1HA       GLY   1  -6.776   5.443   3.704
    6    H    PHE   2           H        PHE   2  -5.039   6.872   2.349
    7    HA   PHE   2           HA       PHE   2  -3.135   6.807   0.988
    8   1HB   PHE   2          2HB       PHE   2  -3.592   3.812   0.916
    9   2HB   PHE   2          1HB       PHE   2  -2.066   4.666   0.706
   10    HD1  PHE   2           HD1      PHE   2  -4.229   3.062   3.046
   11    HD2  PHE   2           HD2      PHE   2  -1.280   6.167   2.696
   12    HE1  PHE   2           HE1      PHE   2  -3.841   2.969   5.493
   13    HE2  PHE   2           HE2      PHE   2  -0.892   6.074   5.144
   14    HZ   PHE   2           HZ       PHE   2  -2.172   4.474   6.542
   15    H    GLY   3           H        GLY   3  -5.794   7.073  -0.294
   16   1HA   GLY   3          2HA       GLY   3  -6.647   7.192  -2.467
   17   2HA   GLY   3          1HA       GLY   3  -5.007   6.888  -3.035
   18    H    CYS   4           H        CYS   4  -7.323   4.901  -1.155
   19    HA   CYS   4           HA       CYS   4  -6.751   2.639  -3.004
   20   1HB   CYS   4          2HB       CYS   4  -7.729   2.848  -0.173
   21   2HB   CYS   4          1HB       CYS   4  -8.104   1.403  -1.112
   22    HA   PRO   5           HA       PRO   5  -7.751   0.622  -2.984
   23   1HB   PRO   5          2HB       PRO   5  -8.831  -0.827  -5.047
   24   2HB   PRO   5          1HB       PRO   5  -9.480  -0.836  -3.399
   25   1HG   PRO   5          2HG       PRO   5 -10.577   0.471  -5.837
   26   2HG   PRO   5          1HG       PRO   5 -11.420  -0.056  -4.370
   27   1HD   PRO   5          2HD       PRO   5 -10.658   2.612  -5.023
   28   2HD   PRO   5          1HD       PRO   5 -11.296   2.041  -3.465
   29    H    ASN   6           H        ASN   6  -7.563   3.161  -4.919
   30    HA   ASN   6           HA       ASN   6  -6.575   2.369  -7.438
   31   1HB   ASN   6          2HB       ASN   6  -6.979   4.759  -6.439
   32   2HB   ASN   6          1HB       ASN   6  -5.295   4.640  -5.933
   33   1HD2  ASN   6          1HD2      ASN   6  -4.180   5.928  -7.444
   34   2HD2  ASN   6          2HD2      ASN   6  -4.311   5.756  -9.126
   35    H    ASN   7           H        ASN   7  -4.990   0.943  -7.833
   36    HA   ASN   7           HA       ASN   7  -3.028   0.106  -5.919
   37   1HB   ASN   7          2HB       ASN   7  -3.436  -0.320  -8.862
   38   2HB   ASN   7          1HB       ASN   7  -1.912  -0.814  -8.125
   39   1HD2  ASN   7          1HD2      ASN   7  -5.464  -1.295  -7.878
   40   2HD2  ASN   7          2HD2      ASN   7  -5.358  -2.810  -7.122
   41    H    TYR   8           H        TYR   8  -3.007   2.658  -8.348
   42    HA   TYR   8           HA       TYR   8  -0.168   3.054  -8.457
   43   1HB   TYR   8          2HB       TYR   8  -2.060   4.045  -9.965
   44   2HB   TYR   8          1HB       TYR   8  -2.146   5.309  -8.740
   45    HD1  TYR   8           HD1      TYR   8  -0.257   6.824  -8.349
   46    HD2  TYR   8           HD2      TYR   8  -0.086   3.782 -11.377
   47    HE1  TYR   8           HE1      TYR   8   1.731   7.925  -9.341
   48    HE2  TYR   8           HE2      TYR   8   1.902   4.883 -12.369
   49    HH   TYR   8           HH       TYR   8   3.820   6.828 -10.956
   50    H    GLN   9           H        GLN   9  -2.707   4.501  -6.399
   51    HA   GLN   9           HA       GLN   9  -0.867   6.200  -4.949
   52   1HB   GLN   9          2HB       GLN   9  -3.649   5.215  -4.246
   53   2HB   GLN   9          1HB       GLN   9  -2.769   6.445  -3.342
   54   1HG   GLN   9          2HG       GLN   9  -2.897   6.931  -6.251
   55   2HG   GLN   9          1HG       GLN   9  -4.457   6.984  -5.432
   56   1HE2  GLN   9          1HE2      GLN   9  -4.909   9.154  -4.989
   57   2HE2  GLN   9          2HE2      GLN   9  -3.795  10.262  -4.347
   58    H    CYS  10           H        CYS  10  -2.254   2.971  -4.380
   59    HA   CYS  10           HA       CYS  10  -1.088   2.630  -1.765
   60   1HB   CYS  10          2HB       CYS  10  -2.965   1.253  -3.053
   61   2HB   CYS  10          1HB       CYS  10  -1.581   0.277  -3.549
   62    H    HIS  11           H        HIS  11  -0.017   1.842  -5.064
   63    HA   HIS  11           HA       HIS  11   2.364   0.427  -4.292
   64   1HB   HIS  11          2HB       HIS  11   1.332   0.323  -6.571
   65   2HB   HIS  11          1HB       HIS  11   1.849   1.985  -6.845
   66    HD1  HIS  11           HD1      HIS  11   3.708  -1.032  -5.390
   67    HD2  HIS  11           HD2      HIS  11   4.111   1.820  -8.406
   68    HE1  HIS  11           HE1      HIS  11   5.948  -1.461  -6.485
   69    H    ARG  12           H        ARG  12   1.782   3.839  -5.222
   70    HA   ARG  12           HA       ARG  12   4.497   4.703  -4.901
   71   1HB   ARG  12          2HB       ARG  12   2.562   5.968  -6.024
   72   2HB   ARG  12          1HB       ARG  12   2.061   6.429  -4.397
   73   1HG   ARG  12          2HG       ARG  12   4.936   6.835  -5.001
   74   2HG   ARG  12          1HG       ARG  12   3.822   7.872  -5.894
   75   1HD   ARG  12          2HD       ARG  12   3.229   9.043  -4.036
   76   2HD   ARG  12          1HD       ARG  12   3.184   7.598  -3.026
   77    HE   ARG  12           HE       ARG  12   5.715   7.787  -2.937
   78   1HH1  ARG  12          1HH2      ARG  12   5.976   9.992  -4.957
   79   2HH1  ARG  12          2HH2      ARG  12   6.135  11.391  -3.949
   80   1HH2  ARG  12          2HH1      ARG  12   4.943   9.799  -1.098
   81   2HH2  ARG  12          1HH1      ARG  12   5.549  11.281  -1.756
   82    H    HIS  13           H        HIS  13   1.769   4.441  -2.644
   83    HA   HIS  13           HA       HIS  13   3.042   5.740  -0.418
   84   1HB   HIS  13          2HB       HIS  13   0.613   5.368  -0.477
   85   2HB   HIS  13          1HB       HIS  13   0.865   3.623  -0.479
   86    HD1  HIS  13           HD1      HIS  13   2.154   6.493   1.706
   87    HD2  HIS  13           HD2      HIS  13   0.528   2.672   2.077
   88    HE1  HIS  13           HE1      HIS  13   2.033   6.003   4.188
   89    H    CYS  14           H        CYS  14   2.726   2.284  -1.310
   90    HA   CYS  14           HA       CYS  14   4.278   1.276   0.878
   91   1HB   CYS  14          2HB       CYS  14   3.704   0.161  -1.879
   92   2HB   CYS  14          1HB       CYS  14   4.576  -0.739  -0.638
   93    H    LYS  15           H        LYS  15   5.157   2.500  -2.323
   94    HA   LYS  15           HA       LYS  15   7.878   1.635  -2.368
   95   1HB   LYS  15          2HB       LYS  15   6.377   3.885  -3.697
   96   2HB   LYS  15          1HB       LYS  15   8.125   3.744  -3.886
   97   1HG   LYS  15          2HG       LYS  15   6.674   1.208  -4.271
   98   2HG   LYS  15          1HG       LYS  15   6.273   2.449  -5.457
   99   1HD   LYS  15          2HD       LYS  15   8.559   2.691  -6.120
  100   2HD   LYS  15          1HD       LYS  15   9.127   1.742  -4.744
  101   1HE   LYS  15          2HE       LYS  15   7.623  -0.147  -5.762
  102   2HE   LYS  15          1HE       LYS  15   7.740   0.804  -7.243
  103   1HZ   LYS  15          1HZ       LYS  15   9.487  -0.919  -6.999
  104   2HZ   LYS  15          2HZ       LYS  15  10.086  -0.078  -5.651
  105   3HZ   LYS  15          3HZ       LYS  15  10.102   0.650  -7.186
  106    H    SER  16           H        SER  16   6.373   4.598  -1.046
  107    HA   SER  16           HA       SER  16   8.890   5.800  -0.288
  108   1HB   SER  16          2HB       SER  16   7.490   7.346   1.057
  109   2HB   SER  16          1HB       SER  16   6.898   7.184  -0.592
  110    HG   SER  16           HG       SER  16   5.148   6.242   0.139
  111    H    ILE  17           H        ILE  17   6.867   3.363   1.174
  112    HA   ILE  17           HA       ILE  17   7.990   3.712   3.860
  113    HB   ILE  17           HB       ILE  17   6.327   1.460   2.681
  114   1HG1  ILE  17          2HG1      ILE  17   5.385   3.546   4.644
  115   2HG1  ILE  17          1HG1      ILE  17   5.392   3.899   2.916
  116   1HG2  ILE  17          1HG2      ILE  17   7.586   0.688   4.625
  117   2HG2  ILE  17          2HG2      ILE  17   5.900   0.915   5.089
  118   3HG2  ILE  17          3HG2      ILE  17   7.107   2.118   5.541
  119   1HD1  ILE  17          1HD1      ILE  17   3.643   2.090   4.460
  120   2HD1  ILE  17          2HD1      ILE  17   4.241   1.417   2.944
  121   3HD1  ILE  17          3HD1      ILE  17   3.335   2.929   2.940
  122    HA   PRO  18           HA       PRO  18  11.593   1.303   2.875
  123   1HB   PRO  18          2HB       PRO  18  12.657   1.381   5.410
  124   2HB   PRO  18          1HB       PRO  18  12.755   2.727   4.261
  125   1HG   PRO  18          2HG       PRO  18  11.030   2.443   6.677
  126   2HG   PRO  18          1HG       PRO  18  11.626   3.914   5.889
  127   1HD   PRO  18          2HD       PRO  18   9.017   2.838   5.645
  128   2HD   PRO  18          1HD       PRO  18   9.722   4.111   4.626
  129    H    GLY  19           H        GLY  19  12.164  -0.882   3.090
  130   1HA   GLY  19          2HA       GLY  19  12.234  -3.015   4.230
  131   2HA   GLY  19          1HA       GLY  19  10.898  -2.486   5.249
  132    H    ARG  20           H        ARG  20   9.704  -1.456   2.488
  133    HA   ARG  20           HA       ARG  20   8.639  -4.123   1.658
  134   1HB   ARG  20          2HB       ARG  20   7.073  -1.544   1.503
  135   2HB   ARG  20          1HB       ARG  20   6.466  -3.193   1.381
  136   1HG   ARG  20          2HG       ARG  20   7.778  -2.118   3.891
  137   2HG   ARG  20          1HG       ARG  20   6.040  -2.032   3.612
  138   1HD   ARG  20          2HD       ARG  20   6.604  -4.671   3.016
  139   2HD   ARG  20          1HD       ARG  20   7.700  -4.340   4.358
  140    HE   ARG  20           HE       ARG  20   4.734  -4.246   4.482
  141   1HH1  ARG  20          1HH2      ARG  20   6.091  -2.055   6.106
  142   2HH1  ARG  20          2HH2      ARG  20   6.243  -2.823   7.651
  143   1HH2  ARG  20          2HH1      ARG  20   5.686  -6.022   6.412
  144   2HH2  ARG  20          1HH1      ARG  20   6.011  -5.075   7.824
  145    H    CYS  21           H        CYS  21   8.215  -4.385  -0.586
  146    HA   CYS  21           HA       CYS  21   9.740  -2.514  -2.324
  147   1HB   CYS  21          2HB       CYS  21   9.314  -5.382  -2.283
  148   2HB   CYS  21          1HB       CYS  21   8.861  -4.712  -3.850
  149    H    GLY  22           H        GLY  22   6.612  -4.251  -2.263
  150   1HA   GLY  22          2HA       GLY  22   5.375  -1.941  -3.657
  151   2HA   GLY  22          1HA       GLY  22   5.186  -3.539  -4.379
  152    H    GLY  23           H        GLY  23   2.829  -2.520  -3.785
  153   1HA   GLY  23          2HA       GLY  23   1.861  -4.198  -1.605
  154   2HA   GLY  23          1HA       GLY  23   1.756  -2.479  -1.237
  155    H    TYR  24           H        TYR  24  -0.595  -3.354  -1.163
  156    HA   TYR  24           HA       TYR  24  -1.970  -2.369  -3.542
  157   1HB   TYR  24          2HB       TYR  24  -3.220  -4.430  -4.007
  158   2HB   TYR  24          1HB       TYR  24  -1.492  -4.730  -4.184
  159    HD1  TYR  24           HD1      TYR  24  -0.236  -5.950  -2.407
  160    HD2  TYR  24           HD2      TYR  24  -4.502  -5.469  -2.251
  161    HE1  TYR  24           HE1      TYR  24  -0.375  -7.737  -0.694
  162    HE2  TYR  24           HE2      TYR  24  -4.642  -7.257  -0.539
  163    HH   TYR  24           HH       TYR  24  -3.016  -8.241   1.228
  164    H    CYS  25           H        CYS  25  -4.371  -2.328  -3.143
  165    HA   CYS  25           HA       CYS  25  -4.898  -1.696  -0.322
  166   1HB   CYS  25          2HB       CYS  25  -6.722  -1.571  -2.744
  167   2HB   CYS  25          1HB       CYS  25  -7.085  -0.910  -1.148
  168    H    GLY  26           H        GLY  26  -5.701  -3.167   1.091
  169   1HA   GLY  26          2HA       GLY  26  -7.835  -4.979   0.523
  170   2HA   GLY  26          1HA       GLY  26  -6.312  -5.854   0.407
  171    H    GLY  27           H        GLY  27  -8.656  -5.709   2.458
  172   1HA   GLY  27          2HA       GLY  27  -7.903  -6.714   4.725
  173   2HA   GLY  27          1HA       GLY  27  -7.011  -5.203   4.900
  174    H    TRP  28           H        TRP  28  -8.284  -3.198   4.922
  175    HA   TRP  28           HA       TRP  28 -10.869  -3.594   6.310
  176   1HB   TRP  28          2HB       TRP  28  -9.074  -2.096   7.266
  177   2HB   TRP  28          1HB       TRP  28  -9.318  -1.022   5.890
  178    HD1  TRP  28           HD1      TRP  28 -11.204  -2.446   8.925
  179    HE1  TRP  28           HE1      TRP  28 -13.111  -0.827   9.533
  180    HE3  TRP  28           HE3      TRP  28 -10.830   0.856   5.047
  181    HZ2  TRP  28           HZ2      TRP  28 -14.319   1.555   8.515
  182    HZ3  TRP  28           HZ3      TRP  28 -12.370   2.791   4.893
  183    HH2  TRP  28           HH2      TRP  28 -14.113   3.144   6.618
  184    H    HIS  29           H        HIS  29 -12.228  -4.092   4.539
  185    HA   HIS  29           HA       HIS  29 -13.651  -3.640   2.738
  186   1HB   HIS  29          2HB       HIS  29 -13.092  -0.740   3.430
  187   2HB   HIS  29          1HB       HIS  29 -14.498  -1.369   2.579
  188    HD1  HIS  29           HD1      HIS  29 -14.448   0.162   5.433
  189    HD2  HIS  29           HD2      HIS  29 -14.937  -3.929   4.810
  190    HE1  HIS  29           HE1      HIS  29 -15.586  -0.747   7.505
  191    H    ARG  30           H        ARG  30 -10.735  -3.873   2.280
  192    HA   ARG  30           HA       ARG  30  -9.193  -3.622   0.548
  193   1HB   ARG  30          2HB       ARG  30 -11.304  -4.328  -0.730
  194   2HB   ARG  30          1HB       ARG  30 -11.498  -2.621  -1.132
  195   1HG   ARG  30          2HG       ARG  30  -9.644  -2.589  -2.504
  196   2HG   ARG  30          1HG       ARG  30  -8.809  -3.837  -1.582
  197   1HD   ARG  30          2HD       ARG  30 -11.276  -4.436  -3.221
  198   2HD   ARG  30          1HD       ARG  30  -9.655  -4.512  -3.908
  199    HE   ARG  30           HE       ARG  30 -10.828  -6.542  -2.289
  200   1HH1  ARG  30          1HH2      ARG  30  -8.067  -6.096  -3.904
  201   2HH1  ARG  30          2HH2      ARG  30  -6.982  -6.727  -2.710
  202   1HH2  ARG  30          2HH1      ARG  30  -9.368  -6.770  -0.182
  203   2HH2  ARG  30          1HH1      ARG  30  -7.724  -7.120  -0.600
  204    H    LEU  31           H        LEU  31  -9.845  -1.329   2.352
  205    HA   LEU  31           HA       LEU  31  -9.097   0.942   0.565
  206   1HB   LEU  31          2HB       LEU  31 -10.444   0.909   3.278
  207   2HB   LEU  31          1HB       LEU  31  -9.898   2.380   2.473
  208    HG   LEU  31           HG       LEU  31 -11.728   0.429   1.078
  209   1HD1  LEU  31          1HD1      LEU  31 -12.761   1.113   3.247
  210   2HD1  LEU  31          2HD1      LEU  31 -13.639   1.731   1.848
  211   3HD1  LEU  31          3HD1      LEU  31 -12.578   2.799   2.766
  212   1HD2  LEU  31          1HD2      LEU  31 -11.267   3.418   0.803
  213   2HD2  LEU  31          2HD2      LEU  31 -12.312   2.434  -0.221
  214   3HD2  LEU  31          3HD2      LEU  31 -10.567   2.184  -0.245
  215    H    ARG  32           H        ARG  32  -7.985  -1.095   3.141
  216    HA   ARG  32           HA       ARG  32  -5.962   0.789   4.120
  217   1HB   ARG  32          2HB       ARG  32  -7.139  -1.223   5.374
  218   2HB   ARG  32          1HB       ARG  32  -5.845  -2.168   4.635
  219   1HG   ARG  32          2HG       ARG  32  -4.157  -0.944   5.751
  220   2HG   ARG  32          1HG       ARG  32  -5.255   0.379   6.143
  221   1HD   ARG  32          2HD       ARG  32  -6.561  -1.270   7.567
  222   2HD   ARG  32          1HD       ARG  32  -5.234  -2.407   7.328
  223    HE   ARG  32           HE       ARG  32  -4.352   0.190   8.337
  224   1HH1  ARG  32          2HH1      ARG  32  -2.956  -2.320   9.042
  225   2HH1  ARG  32          1HH1      ARG  32  -3.480  -2.611  10.667
  226   1HH2  ARG  32          1HH2      ARG  32  -6.187  -0.440  10.462
  227   2HH2  ARG  32          2HH2      ARG  32  -5.316  -1.542  11.475
  228    H    CYS  33           H        CYS  33  -3.763   0.755   3.573
  229    HA   CYS  33           HA       CYS  33  -3.100  -0.667   1.068
  230   1HB   CYS  33          2HB       CYS  33  -2.097   1.715   2.493
  231   2HB   CYS  33          1HB       CYS  33  -0.844   0.738   1.727
  232    H    THR  34           H        THR  34  -2.225  -2.653   1.203
  233    HA   THR  34           HA       THR  34  -0.575  -3.344   3.594
  234    HB   THR  34           HB       THR  34  -2.077  -5.109   1.635
  235    HG1  THR  34           HG1      THR  34  -3.600  -4.886   3.039
  236   1HG2  THR  34          1HG2      THR  34  -0.124  -6.324   2.281
  237   2HG2  THR  34          2HG2      THR  34  -1.423  -6.914   3.320
  238   3HG2  THR  34          3HG2      THR  34  -0.243  -5.763   3.949
  239    H    CYS  35           H        CYS  35   1.570  -3.159   3.160
  240    HA   CYS  35           HA       CYS  35   2.532  -3.620   0.383
  241   1HB   CYS  35          2HB       CYS  35   4.233  -2.598   2.652
  242   2HB   CYS  35          1HB       CYS  35   4.428  -2.331   0.921
  243    H    TYR  36           H        TYR  36   3.847  -5.340  -0.120
  244    HA   TYR  36           HA       TYR  36   4.297  -7.337   2.016
  245   1HB   TYR  36          2HB       TYR  36   5.237  -8.693  -0.016
  246   2HB   TYR  36          1HB       TYR  36   3.499  -8.464   0.136
  247    HD1  TYR  36           HD1      TYR  36   6.556  -7.266  -1.613
  248    HD2  TYR  36           HD2      TYR  36   2.261  -7.204  -1.480
  249    HE1  TYR  36           HE1      TYR  36   6.500  -6.214  -3.857
  250    HE2  TYR  36           HE2      TYR  36   2.207  -6.148  -3.723
  251    HH   TYR  36           HH       TYR  36   4.291  -6.227  -5.842
  252    H    ARG  37           H        ARG  37   6.349  -8.115   2.597
  253    HA   ARG  37           HA       ARG  37   8.482  -6.186   2.578
  254   1HB   ARG  37          2HB       ARG  37   8.401  -9.107   3.363
  255   2HB   ARG  37          1HB       ARG  37   9.819  -8.083   3.586
  256   1HG   ARG  37          2HG       ARG  37   8.768  -6.741   5.188
  257   2HG   ARG  37          1HG       ARG  37   7.151  -7.169   4.629
  258   1HD   ARG  37          2HD       ARG  37   7.226  -8.494   6.510
  259   2HD   ARG  37          1HD       ARG  37   7.968  -9.613   5.366
  260    HE   ARG  37           HE       ARG  37   9.342  -8.219   7.551
  261   1HH1  ARG  37          2HH1      ARG  37   9.836 -11.077   6.817
  262   2HH1  ARG  37          1HH1      ARG  37  11.368 -10.993   6.014
  263   1HH2  ARG  37          1HH2      ARG  37  11.212  -7.556   5.517
  264   2HH2  ARG  37          2HH2      ARG  37  12.149  -8.992   5.275
  265    H    CYS  38           H        CYS  38  10.424  -6.167   1.432
  266    HA   CYS  38           HA       CYS  38  10.389  -7.583  -1.159
  267   1HB   CYS  38          2HB       CYS  38  11.062  -5.074  -0.653
  268   2HB   CYS  38          1HB       CYS  38  12.634  -5.791  -0.299
  269    H    GLY  39           HN       GLY  39  11.465  -9.457  -1.463
  270   1HA   GLY  39          2HA       GLY  39  13.343 -10.418   0.606
  271   2HA   GLY  39          1HA       GLY  39  12.692 -11.376  -0.723