*HEADER    ANTIMICROBIAL PROTEIN                   12-FEB-01   1I2V              
*TITLE     NMR SOLUTION STRUCTURES OF AN ANTIFUNGAL AND ANTIBACTERIAL            
*TITLE    2 MUTANT OF HELIOMICIN                                                 
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: DEFENSIN HELIOMICIN;                                       
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 ENGINEERED: YES;                                                     
*COMPND   5 MUTATION: YES                                                        
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: HELIOTHIS VIRESCENS;                            
*SOURCE   3 ORGANISM_COMMON: TOBACCO BUDWORM;                                    
*SOURCE   4 EXPRESSION_SYSTEM: SACCHAROMYCES CEREVISIAE;                         
*SOURCE   5 EXPRESSION_SYSTEM_COMMON: YEAST;                                     
*SOURCE   6 EXPRESSION_SYSTEM_STRAIN: TGY 48-1;                                  
*SOURCE   7 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
*SOURCE   8 EXPRESSION_SYSTEM_PLASMID: PSEA2                                     
*KEYWDS    ALPHA-BETA PROTEIN, CSAB MOTIF (CYSTEINE STABILIZED ALPHA-            
*KEYWDS   2 HELIX BETA-SHEET MOTIF)                                              
*EXPDTA    NMR, 18 STRUCTURES                                                    
*AUTHOR    M.LAMBERTY, A.CAILLE, C.LANDON, S.TASSIN-MOINDROT, C.HETRU,           
*AUTHOR   2 P.BULET, F.VOVELLE                                                   
*REVDAT   1   12-FEB-02 1I2V    0                                                

classification ALL !
assign (resid  1 and name HA  )   (resid 44 and name HN  )    3.2  1.4 0.0 
assign (resid  1 and name HA  )   (resid 44 and name QG2 )    4.6  2.8 0.0 
assign (resid  1 and name HB1 )   (resid  2 and name HN  )    3.6  1.8 0.0 
assign (resid  1 and name HB2 )   (resid  2 and name HN  )    3.6  1.8 0.0 
assign (resid  2 and name HN  )   (resid  2 and name HB1 )    3.2  1.4 0.0 
assign (resid  2 and name HN  )   (resid  2 and name HB2 )    3.2  1.4 0.0 
assign (resid  2 and name HN  )   (resid 41 and name HE3 )    6.0  4.2 0.0 
assign (resid  2 and name HN  )   (resid 41 and name HZ3 )    6.0  4.2 0.0 
assign (resid  2 and name HN  )   (resid 42 and name HN  )    3.3  1.5 0.0 
assign (resid  2 and name HN  )   (resid 44 and name QG2 )    5.4  3.6 0.0 
assign (resid  2 and name HA  )   (resid  3 and name HN  )    2.8  1.0 0.0 
assign (resid  2 and name HA  )   (resid 42 and name HN  )    6.0  4.2 0.0 
assign (resid  3 and name HN  )   (resid  3 and name HG  )    6.0  4.2 0.0 
assign (resid  3 and name HN  )   (resid  3 and name QD1 )    7.0  5.2 0.0 
assign (resid  3 and name HN  )   (resid  3 and name QD2 )    7.0  5.2 0.0 
assign (resid  3 and name HN  )   (resid  4 and name HN  )    5.1  3.3 0.0 
assign (resid  3 and name HN  )   (resid 41 and name HZ3 )    6.0  4.2 0.0 
assign (resid  3 and name HA  )   (resid  3 and name QD1 )    5.8  4.0 0.0 
assign (resid  3 and name HA  )   (resid  3 and name QD2 )    5.8  4.0 0.0 
assign (resid  3 and name HA  )   (resid  4 and name HN  )    2.5  0.7 0.0 
assign (resid  3 and name HA  )   (resid  4 and name QG2 )    7.0  5.2 0.0 
assign (resid  3 and name HA  )   (resid  4 and name QD  )    7.0  5.2 0.0 
assign (resid  3 and name HA  )   (resid 41 and name HE3 )    6.0  4.2 0.0 
assign (resid  3 and name HA  )   (resid 41 and name HZ3 )    6.0  4.2 0.0 
assign (resid  3 and name HA  )   (resid 42 and name HN  )    3.8  2.0 0.0 
assign (resid  3 and name HB1 )   (resid 41 and name HZ3 )    6.0  4.2 0.0 
assign (resid  3 and name HB2 )   (resid 41 and name HZ3 )    6.0  4.2 0.0 
assign (resid  3 and name HG  )   (resid  4 and name HN  )    6.0  4.2 0.0 
assign (resid  3 and name HG  )   (resid  5 and name HN  )    4.5  2.7 0.0 
assign (resid  3 and name HG  )   (resid 41 and name HZ3 )    6.0  4.2 0.0 
assign (resid  3 and name QD1 )   (resid  4 and name HN  )    7.0  5.2 0.0 
assign (resid  3 and name QD1 )   (resid  5 and name HN  )    5.2  3.4 0.0 
assign (resid  3 and name QD1 )   (resid 39 and name HB1 )    7.0  5.2 0.0 
assign (resid  3 and name QD1 )   (resid 39 and name HB2 )    7.0  5.2 0.0 
assign (resid  3 and name QD1 )   (resid 39 and name HD21)    8.8  7.0 0.0 
assign (resid  3 and name QD1 )   (resid 39 and name HD22)    8.8  7.0 0.0 
assign (resid  3 and name QD1 )   (resid 40 and name HN  )    7.0  5.2 0.0 
assign (resid  3 and name QD1 )   (resid 41 and name HZ3 )    7.0  5.2 0.0 
assign (resid  3 and name QD1 )   (resid 41 and name HH2 )    7.0  5.2 0.0 
assign (resid  3 and name QD2 )   (resid  4 and name HN  )    7.0  5.2 0.0 
assign (resid  3 and name QD2 )   (resid  5 and name HN  )    5.2  3.4 0.0 
assign (resid  3 and name QD2 )   (resid 39 and name HB1 )    7.0  5.2 0.0 
assign (resid  3 and name QD2 )   (resid 39 and name HB2 )    7.0  5.2 0.0 
assign (resid  3 and name QD2 )   (resid 39 and name HD21)    8.8  7.0 0.0 
assign (resid  3 and name QD2 )   (resid 39 and name HD22)    8.8  7.0 0.0 
assign (resid  3 and name QD2 )   (resid 40 and name HN  )    7.0  5.2 0.0 
assign (resid  3 and name QD2 )   (resid 41 and name HZ3 )    7.0  5.2 0.0 
assign (resid  3 and name QD2 )   (resid 41 and name HH2 )    7.0  5.2 0.0 
assign (resid  4 and name HN  )   (resid  4 and name QD  )    7.0  5.2 0.0 
assign (resid  4 and name HN  )   (resid  5 and name HN  )    2.7  0.9 0.0 
assign (resid  4 and name HN  )   (resid 42 and name HN  )    4.8  3.0 0.0 
assign (resid  4 and name HB  )   (resid 15 and name QG2 )    7.0  5.2 0.0 
assign (resid  4 and name QG2 )   (resid  5 and name HN  )    7.0  5.2 0.0 
assign (resid  4 and name QG2 )   (resid 25 and name HD1 )    7.0  5.2 0.0 
assign (resid  4 and name QG2 )   (resid 25 and name HD2 )    7.0  5.2 0.0 
assign (resid  4 and name QG2 )   (resid 42 and name HN  )    7.0  5.2 0.0 
assign (resid  4 and name QD  )   (resid  5 and name HN  )    7.0  5.2 0.0 
assign (resid  4 and name QD  )   (resid 21 and name HN  )    7.0  5.2 0.0 
assign (resid  4 and name QD  )   (resid 22 and name HN  )    6.2  4.4 0.0 
assign (resid  4 and name QD  )   (resid 22 and name HA  )    7.0  5.2 0.0 
assign (resid  4 and name QD  )   (resid 25 and name HD1 )    7.0  5.2 0.0 
assign (resid  4 and name QD  )   (resid 25 and name HD2 )    7.0  5.2 0.0 
assign (resid  4 and name QD  )   (resid 40 and name HN  )    7.0  5.2 0.0 
assign (resid  4 and name QD  )   (resid 42 and name HN  )    7.0  5.2 0.0 
assign (resid  5 and name HN  )   (resid  6 and name HN  )    4.9  3.1 0.0 
assign (resid  5 and name HN  )   (resid 40 and name HN  )    3.7  1.9 0.0 
assign (resid  5 and name HA1 )   (resid  6 and name HN  )    3.0  1.2 0.0 
assign (resid  5 and name HA1 )   (resid 13 and name HB1 )    4.4  2.6 0.0 
assign (resid  5 and name HA1 )   (resid 13 and name HB2 )    4.4  2.6 0.0 
assign (resid  5 and name HA1 )   (resid 13 and name HD21)    7.6  5.8 0.0 
assign (resid  5 and name HA1 )   (resid 13 and name HD22)    7.6  5.8 0.0 
assign (resid  5 and name HA2 )   (resid  6 and name HN  )    3.0  1.2 0.0 
assign (resid  5 and name HA2 )   (resid 13 and name HB1 )    4.4  2.6 0.0 
assign (resid  5 and name HA2 )   (resid 13 and name HB2 )    4.4  2.6 0.0 
assign (resid  5 and name HA2 )   (resid 13 and name HD21)    7.6  5.8 0.0 
assign (resid  5 and name HA2 )   (resid 13 and name HD22)    7.6  5.8 0.0 
assign (resid  6 and name HN  )   (resid  6 and name HB1 )    3.3  1.5 0.0 
assign (resid  6 and name HN  )   (resid  6 and name HB2 )    3.3  1.5 0.0 
assign (resid  6 and name HN  )   (resid 11 and name QB  )    6.8  5.0 0.0 
assign (resid  6 and name HN  )   (resid 13 and name HB1 )    6.0  4.2 0.0 
assign (resid  6 and name HN  )   (resid 13 and name HB2 )    6.0  4.2 0.0 
assign (resid  6 and name HN  )   (resid 14 and name HA  )    3.5  1.7 0.0 
assign (resid  6 and name HN  )   (resid 15 and name HN  )    3.9  2.1 0.0 
assign (resid  6 and name HN  )   (resid 15 and name QG2 )    7.0  5.2 0.0 
assign (resid  6 and name HA  )   (resid 39 and name HA  )    2.5  0.7 0.0 
assign (resid  6 and name HA  )   (resid 40 and name HN  )    3.3  1.5 0.0 
assign (resid  6 and name HB1 )   (resid  8 and name HN  )    4.2  2.4 0.0 
assign (resid  6 and name HB1 )   (resid 11 and name QB  )    5.0  3.2 0.0 
assign (resid  6 and name HB2 )   (resid  8 and name HN  )    4.2  2.4 0.0 
assign (resid  6 and name HB2 )   (resid 11 and name QB  )    5.0  3.2 0.0 
assign (resid  7 and name HN  )   (resid  7 and name HB1 )    3.7  1.9 0.0 
assign (resid  7 and name HN  )   (resid  7 and name HB2 )    3.7  1.9 0.0 
assign (resid  7 and name HN  )   (resid  8 and name HN  )    6.0  4.2 0.0 
assign (resid  7 and name HN  )   (resid  8 and name HB  )    4.3  2.5 0.0 
assign (resid  7 and name HN  )   (resid  8 and name QG2 )    5.3  3.5 0.0 
assign (resid  7 and name HA  )   (resid  8 and name HN  )    3.2  1.4 0.0 
assign (resid  7 and name HA  )   (resid 15 and name HN  )    3.9  2.1 0.0 
assign (resid  7 and name CB  )   (resid 32 and name SG  )    3.1  1.3 0.0 
assign (resid  7 and name HB1 )   (resid  8 and name HN  )    6.0  4.2 0.0 
assign (resid  7 and name HB2 )   (resid  8 and name HN  )    6.0  4.2 0.0 
assign (resid  7 and name SG  )   (resid 32 and name CB  )    3.1  1.3 0.0 
assign (resid  7 and name SG  )   (resid 32 and name SG  )    2.1  0.3 0.0 
assign (resid  8 and name HN  )   (resid  8 and name QG2 )    4.2  2.4 0.0 
assign (resid  8 and name HN  )   (resid  9 and name HN  )    6.0  4.2 0.0 
assign (resid  8 and name HN  )   (resid 11 and name QB  )    6.2  4.4 0.0 
assign (resid  8 and name HA  )   (resid  9 and name HN  )    2.5  0.7 0.0 
assign (resid  8 and name HB  )   (resid  9 and name HN  )    4.9  3.1 0.0 
assign (resid  8 and name HB  )   (resid 11 and name HN  )    4.6  2.8 0.0 
assign (resid  8 and name HB  )   (resid 11 and name QB  )    4.6  2.8 0.0 
assign (resid  8 and name QG1 )   (resid  9 and name HN  )    4.8  3.0 0.0 
assign (resid  8 and name QG1 )   (resid 11 and name HN  )    5.9  4.1 0.0 
assign (resid  8 and name QG1 )   (resid 11 and name QB  )    7.2  5.4 0.0 
assign (resid  8 and name QG2 )   (resid  9 and name HN  )    6.3  4.5 0.0 
assign (resid  8 and name QG2 )   (resid 11 and name QB  )    8.1  6.3 0.0 
assign (resid  8 and name QG2 )   (resid 38 and name HA  )    4.1  2.3 0.0 
assign (resid  8 and name QG2 )   (resid 38 and name HB  )    4.0  2.2 0.0 
assign (resid  9 and name HA  )   (resid  9 and name HD1 )    6.0  4.2 0.0 
assign (resid  9 and name HA  )   (resid  9 and name HE3 )    6.0  4.2 0.0 
assign (resid  9 and name HA  )   (resid  9 and name HZ3 )    6.0  4.2 0.0 
assign (resid  9 and name HA  )   (resid 10 and name HN  )    2.6  0.8 0.0 
assign (resid 10 and name HN  )   (resid 11 and name HN  )    2.5  0.7 0.0 
assign (resid 10 and name HN  )   (resid 11 and name QB  )    7.0  5.2 0.0 
assign (resid 11 and name HA  )   (resid 12 and name HN  )    2.6  0.8 0.0 
assign (resid 11 and name QB  )   (resid 12 and name HA  )    6.8  4.9 0.0 
assign (resid 11 and name QB  )   (resid 14 and name HN  )    5.7  3.9 0.0 
assign (resid 11 and name QB  )   (resid 14 and name HA  )    5.9  4.1 0.0 
assign (resid 12 and name HN  )   (resid 12 and name HB  )    3.0  1.2 0.0 
assign (resid 12 and name HN  )   (resid 12 and name QG2 )    4.5  2.7 0.0 
assign (resid 12 and name HA  )   (resid 12 and name HB  )    3.0  1.2 0.0 
assign (resid 12 and name HA  )   (resid 13 and name HN  )    2.8  1.0 0.0 
assign (resid 12 and name HA  )   (resid 14 and name HN  )    4.0  2.2 0.0 
assign (resid 12 and name HB  )   (resid 13 and name HN  )    3.1  1.3 0.0 
assign (resid 12 and name QG1 )   (resid 13 and name HN  )    5.8  4.0 0.0 
assign (resid 12 and name QG1 )   (resid 13 and name HD21)    7.0  5.2 0.0 
assign (resid 12 and name QG1 )   (resid 13 and name HD22)    7.0  5.2 0.0 
assign (resid 12 and name QG2 )   (resid 13 and name HN  )    6.3  4.5 0.0 
assign (resid 13 and name HN  )   (resid 14 and name HN  )    3.8  2.0 0.0 
assign (resid 13 and name HA  )   (resid 13 and name HB1 )    2.9  1.1 0.0 
assign (resid 13 and name HA  )   (resid 13 and name HB2 )    2.9  1.1 0.0 
assign (resid 14 and name HN  )   (resid 14 and name HB1 )    2.9  1.1 0.0 
assign (resid 14 and name HN  )   (resid 14 and name HB2 )    2.9  1.1 0.0 
assign (resid 14 and name HN  )   (resid 15 and name HN  )    5.3  3.5 0.0 
assign (resid 14 and name HA  )   (resid 15 and name HN  )    2.5  0.7 0.0 
assign (resid 15 and name HN  )   (resid 15 and name HB  )    3.6  1.8 0.0 
assign (resid 15 and name HN  )   (resid 15 and name QG2 )    4.3  2.5 0.0 
assign (resid 15 and name HA  )   (resid 15 and name HB  )    3.0  1.2 0.0 
assign (resid 15 and name HA  )   (resid 15 and name QG2 )    3.6  1.8 0.0 
assign (resid 15 and name HA  )   (resid 17 and name HN  )    6.0  4.2 0.0 
assign (resid 15 and name HB  )   (resid 16 and name HN  )    3.9  2.1 0.0 
assign (resid 15 and name QG2 )   (resid 16 and name HN  )    6.2  4.4 0.0 
assign (resid 15 and name QG2 )   (resid 17 and name HN  )    5.0  3.2 0.0 
assign (resid 15 and name QG2 )   (resid 18 and name HN  )    5.7  3.9 0.0 
assign (resid 15 and name QG2 )   (resid 18 and name HB1 )    3.5  1.7 0.0 
assign (resid 15 and name QG2 )   (resid 21 and name HN  )    7.0  5.2 0.0 
assign (resid 16 and name HN  )   (resid 17 and name HN  )    3.0  1.2 0.0 
assign (resid 16 and name HB1 )   (resid 17 and name HN  )    4.5  2.7 0.0 
assign (resid 16 and name HB2 )   (resid 17 and name HN  )    4.5  2.7 0.0 
assign (resid 17 and name HN  )   (resid 17 and name HB2 )    3.2  1.4 0.0 
assign (resid 17 and name HN  )   (resid 18 and name HN  )    4.1  2.3 0.0 
assign (resid 17 and name HA  )   (resid 17 and name HB1 )    2.5  0.7 0.0 
assign (resid 17 and name HA  )   (resid 17 and name HB2 )    2.5  0.7 0.0 
assign (resid 17 and name HA  )   (resid 18 and name HN  )    2.6  0.8 0.0 
assign (resid 17 and name HA  )   (resid 19 and name HN  )    4.5  2.7 0.0 
assign (resid 17 and name HA  )   (resid 20 and name HN  )    5.1  3.3 0.0 
assign (resid 18 and name HN  )   (resid 18 and name HB1 )    2.9  1.1 0.0 
assign (resid 18 and name HN  )   (resid 18 and name HB2 )    2.9  1.1 0.0 
assign (resid 18 and name HN  )   (resid 19 and name HN  )    6.0  4.2 0.0 
assign (resid 18 and name HN  )   (resid 20 and name HN  )    4.7  2.9 0.0 
assign (resid 18 and name HA  )   (resid 18 and name HB1 )    2.8  1.0 0.0 
assign (resid 18 and name HA  )   (resid 21 and name HN  )    3.8  2.0 0.0 
assign (resid 18 and name HA  )   (resid 22 and name HN  )    4.6  2.8 0.0 
assign (resid 18 and name CB  )   (resid 40 and name SG  )    3.1  1.3 0.0 
assign (resid 18 and name HB1 )   (resid 19 and name HN  )    6.0  4.2 0.0 
assign (resid 18 and name HB2 )   (resid 19 and name HN  )    3.0  1.2 0.0 
assign (resid 18 and name HB2 )   (resid 31 and name HA  )    3.2  1.4 0.0 
assign (resid 18 and name HB2 )   (resid 32 and name HN  )    6.0  4.2 0.0 
assign (resid 18 and name SG  )   (resid 40 and name CB  )    3.1  1.3 0.0 
assign (resid 18 and name SG  )   (resid 40 and name SG  )    2.1  0.3 0.0 
assign (resid 19 and name HN  )   (resid 20 and name HN  )    3.2  1.4 0.0 
assign (resid 19 and name HN  )   (resid 21 and name HN  )    6.0  4.2 0.0 
assign (resid 19 and name HN  )   (resid 30 and name HN  )    4.3  2.5 0.0 
assign (resid 19 and name HA  )   (resid 19 and name HB1 )    3.1  1.3 0.0 
assign (resid 19 and name HA  )   (resid 19 and name HB2 )    3.1  1.3 0.0 
assign (resid 19 and name HA  )   (resid 19 and name HD21)    6.0  4.2 0.0 
assign (resid 19 and name HA  )   (resid 19 and name HD22)    6.0  4.2 0.0 
assign (resid 19 and name HA  )   (resid 22 and name HN  )    6.0  4.2 0.0 
assign (resid 19 and name HA  )   (resid 22 and name HB1 )    3.3  1.5 0.0 
assign (resid 19 and name HA  )   (resid 22 and name HB2 )    3.9  2.1 0.0 
assign (resid 19 and name HA  )   (resid 23 and name HN  )    6.0  4.2 0.0 
assign (resid 19 and name HA  )   (resid 30 and name HN  )    2.8  1.0 0.0 
assign (resid 19 and name HB1 )   (resid 20 and name HN  )    3.6  1.8 0.0 
assign (resid 19 and name HB1 )   (resid 30 and name HN  )    6.0  4.2 0.0 
assign (resid 19 and name HB2 )   (resid 20 and name HN  )    3.6  1.8 0.0 
assign (resid 19 and name HB2 )   (resid 30 and name HN  )    6.0  4.2 0.0 
assign (resid 19 and name HD21)   (resid 20 and name HN  )    6.0  4.2 0.0 
assign (resid 19 and name HD22)   (resid 20 and name HN  )    6.0  4.2 0.0 
assign (resid 20 and name HN  )   (resid 21 and name HN  )    3.0  1.2 0.0 
assign (resid 20 and name HA1 )   (resid 22 and name HN  )    6.0  4.2 0.0 
assign (resid 20 and name HA2 )   (resid 22 and name HN  )    6.0  4.2 0.0 
assign (resid 21 and name HN  )   (resid 21 and name HG1 )    6.0  4.2 0.0 
assign (resid 21 and name HN  )   (resid 21 and name HG2 )    6.0  4.2 0.0 
assign (resid 21 and name HN  )   (resid 22 and name HN  )    2.9  1.1 0.0 
assign (resid 21 and name HN  )   (resid 23 and name HN  )    4.2  2.4 0.0 
assign (resid 21 and name HA  )   (resid 21 and name HG1 )    4.1  2.3 0.0 
assign (resid 21 and name HA  )   (resid 21 and name HG2 )    4.1  2.3 0.0 
assign (resid 21 and name HA  )   (resid 24 and name HN  )    3.4  1.6 0.0 
assign (resid 21 and name HA  )   (resid 24 and name HG  )    4.6  2.8 0.0 
assign (resid 21 and name HA  )   (resid 25 and name HN  )    4.8  3.0 0.0 
assign (resid 21 and name HB1 )   (resid 22 and name HN  )    3.6  1.8 0.0 
assign (resid 21 and name HB2 )   (resid 22 and name HN  )    3.6  1.8 0.0 
assign (resid 21 and name HG1 )   (resid 22 and name HN  )    6.0  4.2 0.0 
assign (resid 21 and name HG1 )   (resid 25 and name HE  )    4.6  2.8 0.0 
assign (resid 21 and name HG2 )   (resid 22 and name HN  )    6.0  4.2 0.0 
assign (resid 21 and name HG2 )   (resid 25 and name HE  )    4.6  2.8 0.0 
assign (resid 22 and name HN  )   (resid 22 and name HB1 )    2.8  1.0 0.0 
assign (resid 22 and name HN  )   (resid 22 and name HB2 )    3.4  1.6 0.0 
assign (resid 22 and name HN  )   (resid 23 and name HN  )    3.0  1.2 0.0 
assign (resid 22 and name HN  )   (resid 23 and name HG  )    6.0  4.2 0.0 
assign (resid 22 and name HN  )   (resid 24 and name HN  )    3.5  1.7 0.0 
assign (resid 22 and name HA  )   (resid 22 and name HB2 )    3.0  1.2 0.0 
assign (resid 22 and name HA  )   (resid 24 and name HN  )    4.5  2.7 0.0 
assign (resid 22 and name CB  )   (resid 42 and name SG  )    3.1  1.3 0.0 
assign (resid 22 and name HB1 )   (resid 23 and name HN  )    3.3  1.5 0.0 
assign (resid 22 and name HB1 )   (resid 30 and name HN  )    6.0  4.2 0.0 
assign (resid 22 and name HB2 )   (resid 23 and name HN  )    3.5  1.7 0.0 
assign (resid 22 and name HB2 )   (resid 30 and name HN  )    6.0  4.2 0.0 
assign (resid 22 and name HB2 )   (resid 42 and name HA  )    6.0  4.2 0.0 
assign (resid 22 and name SG  )   (resid 42 and name CB  )    3.1  1.3 0.0 
assign (resid 22 and name SG  )   (resid 42 and name SG  )    2.1  0.3 0.0 
assign (resid 23 and name HN  )   (resid 23 and name HB1 )    2.8  1.0 0.0 
assign (resid 23 and name HN  )   (resid 23 and name HB2 )    3.3  1.5 0.0 
assign (resid 23 and name HN  )   (resid 23 and name HG  )    3.1  1.3 0.0 
assign (resid 23 and name HN  )   (resid 24 and name HN  )    2.8  1.0 0.0 
assign (resid 23 and name HN  )   (resid 25 and name HN  )    4.9  3.1 0.0 
assign (resid 23 and name HA  )   (resid 23 and name HB2 )    3.0  1.2 0.0 
assign (resid 23 and name HA  )   (resid 23 and name HG  )    3.8  2.0 0.0 
assign (resid 23 and name HA  )   (resid 24 and name HN  )    3.6  1.8 0.0 
assign (resid 23 and name HA  )   (resid 26 and name HN  )    4.2  2.4 0.0 
assign (resid 23 and name HA  )   (resid 27 and name HN  )    3.5  1.8 0.0 
assign (resid 23 and name HB1 )   (resid 24 and name HA  )    6.0  4.2 0.0 
assign (resid 23 and name HB2 )   (resid 24 and name HN  )    3.5  1.8 0.0 
assign (resid 24 and name HN  )   (resid 24 and name HB1 )    3.1  1.3 0.0 
assign (resid 24 and name HN  )   (resid 24 and name HB2 )    3.1  1.3 0.0 
assign (resid 24 and name HN  )   (resid 24 and name HG  )    3.3  1.5 0.0 
assign (resid 24 and name HN  )   (resid 25 and name HN  )    3.0  1.2 0.0 
assign (resid 24 and name HN  )   (resid 26 and name HN  )    4.5  2.7 0.0 
assign (resid 24 and name HA  )   (resid 24 and name HG  )    4.0  2.2 0.0 
assign (resid 25 and name HN  )   (resid 26 and name HN  )    2.9  1.1 0.0 
assign (resid 25 and name HN  )   (resid 27 and name HN  )    3.9  2.1 0.0 
assign (resid 25 and name HA  )   (resid 25 and name HD1 )    5.2  3.4 0.0 
assign (resid 25 and name HA  )   (resid 25 and name HD2 )    5.2  3.4 0.0 
assign (resid 25 and name HA  )   (resid 25 and name HE  )    6.0  4.2 0.0 
assign (resid 25 and name HA  )   (resid 27 and name HN  )    4.4  2.6 0.0 
assign (resid 25 and name HB1 )   (resid 25 and name HE  )    4.6  2.8 0.0 
assign (resid 25 and name HB2 )   (resid 25 and name HE  )    4.6  2.8 0.0 
assign (resid 25 and name HG1 )   (resid 25 and name HE  )    4.1  2.3 0.0 
assign (resid 25 and name HG2 )   (resid 25 and name HE  )    4.1  2.3 0.0 
assign (resid 26 and name HN  )   (resid 26 and name HA1 )    3.0  1.2 0.0 
assign (resid 26 and name HN  )   (resid 26 and name HA2 )    3.0  1.2 0.0 
assign (resid 26 and name HN  )   (resid 27 and name HN  )    2.8  1.0 0.0 
assign (resid 27 and name HN  )   (resid 28 and name HN  )    4.9  3.1 0.0 
assign (resid 27 and name HA  )   (resid 28 and name HN  )    3.3  1.5 0.0 
assign (resid 27 and name HB1 )   (resid 28 and name HN  )    6.0  4.2 0.0 
assign (resid 27 and name HB2 )   (resid 28 and name HN  )    6.0  4.2 0.0 
assign (resid 28 and name HN  )   (resid 29 and name HN  )    6.0  4.2 0.0 
assign (resid 28 and name HN  )   (resid 42 and name HB2 )    6.0  4.2 0.0 
assign (resid 28 and name HN  )   (resid 44 and name HA  )    4.2  2.4 0.0 
assign (resid 28 and name HB1 )   (resid 29 and name HN  )    4.1  2.3 0.0 
assign (resid 28 and name HB2 )   (resid 29 and name HN  )    4.1  2.3 0.0 
assign (resid 29 and name HN  )   (resid 30 and name HN  )    4.9  3.1 0.0 
assign (resid 30 and name HN  )   (resid 31 and name HN  )    4.4  2.6 0.0 
assign (resid 30 and name HA1 )   (resid 31 and name HN  )    3.0  1.2 0.0 
assign (resid 30 and name HA1 )   (resid 42 and name HA  )    2.5  0.7 0.0 
assign (resid 30 and name HA1 )   (resid 43 and name HG1 )    7.8  5.9 0.0 
assign (resid 30 and name HA1 )   (resid 43 and name HG2 )    7.8  5.9 0.0 
assign (resid 30 and name HA2 )   (resid 31 and name HN  )    3.0  1.2 0.0 
assign (resid 30 and name HA2 )   (resid 42 and name HA  )    2.5  0.7 0.0 
assign (resid 30 and name HA2 )   (resid 43 and name HG1 )    7.8  5.9 0.0 
assign (resid 30 and name HA2 )   (resid 43 and name HG2 )    7.8  5.9 0.0 
assign (resid 31 and name HN  )   (resid 31 and name HB2 )    4.2  2.4 0.0 
assign (resid 31 and name HN  )   (resid 31 and name HD2 )    6.0  4.2 0.0 
assign (resid 31 and name HN  )   (resid 41 and name HN  )    3.4  1.6 0.0 
assign (resid 31 and name HN  )   (resid 42 and name HA  )    4.1  2.3 0.0 
assign (resid 31 and name HA  )   (resid 32 and name HN  )    2.6  0.8 0.0 
assign (resid 31 and name HB1 )   (resid 32 and name HN  )    3.1  1.3 0.0 
assign (resid 31 and name HB2 )   (resid 32 and name HN  )    6.0  4.2 0.0 
assign (resid 31 and name HD2 )   (resid 32 and name HN  )    4.2  2.4 0.0 
assign (resid 31 and name HD2 )   (resid 33 and name HA1 )    4.8  3.0 0.0 
assign (resid 31 and name HD2 )   (resid 33 and name HA2 )    4.8  3.0 0.0 
assign (resid 31 and name HE1 )   (resid 43 and name HG1 )    5.6  3.8 0.0 
assign (resid 31 and name HE1 )   (resid 43 and name HG2 )    5.6  3.8 0.0 
assign (resid 32 and name HN  )   (resid 32 and name HB1 )    2.8  1.0 0.0 
assign (resid 32 and name HA  )   (resid 33 and name HN  )    2.5  0.7 0.0 
assign (resid 32 and name HA  )   (resid 40 and name HA  )    2.5  0.7 0.0 
assign (resid 32 and name HA  )   (resid 41 and name HN  )    3.5  1.7 0.0 
assign (resid 32 and name HA  )   (resid 41 and name HD1 )    5.3  3.5 0.0 
assign (resid 32 and name HB2 )   (resid 33 and name HN  )    2.8  1.0 0.0 
assign (resid 33 and name HN  )   (resid 33 and name HA1 )    2.7  0.9 0.0 
assign (resid 33 and name HN  )   (resid 33 and name HA2 )    2.7  0.9 0.0 
assign (resid 33 and name HN  )   (resid 39 and name HN  )    4.3  2.5 0.0 
assign (resid 33 and name HN  )   (resid 40 and name HA  )    3.1  1.3 0.0 
assign (resid 33 and name HN  )   (resid 41 and name HD1 )    6.0  4.2 0.0 
assign (resid 33 and name HA1 )   (resid 41 and name HD1 )    5.0  3.2 0.0 
assign (resid 33 and name HA2 )   (resid 41 and name HD1 )    5.0  3.2 0.0 
assign (resid 34 and name HN  )   (resid 35 and name HN  )    2.6  0.8 0.0 
assign (resid 34 and name HB1 )   (resid 35 and name HN  )    6.0  4.2 0.0 
assign (resid 34 and name HB2 )   (resid 35 and name HN  )    6.0  4.2 0.0 
assign (resid 35 and name HN  )   (resid 35 and name HB1 )    3.2  1.4 0.0 
assign (resid 35 and name HN  )   (resid 35 and name HB2 )    3.2  1.4 0.0 
assign (resid 35 and name HN  )   (resid 36 and name HN  )    3.1  1.3 0.0 
assign (resid 35 and name HA  )   (resid 36 and name HA  )    4.3  2.5 0.0 
assign (resid 35 and name HA  )   (resid 36 and name QB  )    6.8  4.9 0.0 
assign (resid 35 and name HA  )   (resid 37 and name HN  )    4.3  2.5 0.0 
assign (resid 35 and name HB1 )   (resid 36 and name HN  )    4.7  2.9 0.0 
assign (resid 35 and name HB2 )   (resid 36 and name HN  )    4.7  2.9 0.0 
assign (resid 36 and name HN  )   (resid 36 and name HA  )    2.7  0.9 0.0 
assign (resid 36 and name HN  )   (resid 37 and name HN  )    2.5  0.7 0.0 
assign (resid 37 and name HN  )   (resid 37 and name HA  )    2.8  1.0 0.0 
assign (resid 37 and name HN  )   (resid 37 and name HB1 )    3.5  1.7 0.0 
assign (resid 37 and name HN  )   (resid 37 and name HB2 )    3.5  1.7 0.0 
assign (resid 37 and name HN  )   (resid 38 and name HN  )    4.2  2.5 0.0 
assign (resid 37 and name HN  )   (resid 38 and name QG1 )    7.0  5.2 0.0 
assign (resid 37 and name HN  )   (resid 38 and name QG2 )    7.0  5.2 0.0 
assign (resid 38 and name HN  )   (resid 39 and name HN  )    3.8  2.0 0.0 
assign (resid 38 and name HA  )   (resid 38 and name HB  )    2.8  1.0 0.0 
assign (resid 38 and name HB  )   (resid 39 and name HN  )    4.4  2.6 0.0 
assign (resid 38 and name QG1 )   (resid 39 and name HN  )    7.0  5.2 0.0 
assign (resid 38 and name QG1 )   (resid 39 and name HD21)   10.1  8.3 0.0 
assign (resid 38 and name QG1 )   (resid 39 and name HD22)   10.1  8.3 0.0 
assign (resid 38 and name QG2 )   (resid 39 and name HN  )    7.0  5.2 0.0 
assign (resid 38 and name QG2 )   (resid 39 and name HD21)   10.1  8.3 0.0 
assign (resid 38 and name QG2 )   (resid 39 and name HD22)   10.1  8.3 0.0 
assign (resid 39 and name HN  )   (resid 39 and name HB1 )    3.7  1.9 0.0 
assign (resid 39 and name HN  )   (resid 39 and name HB2 )    3.7  1.9 0.0 
assign (resid 39 and name HN  )   (resid 41 and name HD1 )    6.0  4.2 0.0 
assign (resid 39 and name HA  )   (resid 40 and name HN  )    2.6  0.8 0.0 
assign (resid 39 and name HB1 )   (resid 41 and name HE1 )    2.6  0.8 0.0 
assign (resid 39 and name HB2 )   (resid 41 and name HE1 )    2.6  0.8 0.0 
assign (resid 40 and name HN  )   (resid 40 and name HB1 )    3.2  1.4 0.0 
assign (resid 40 and name HN  )   (resid 40 and name HB2 )    3.2  1.4 0.0 
assign (resid 40 and name HA  )   (resid 41 and name HN  )    2.5  0.7 0.0 
assign (resid 40 and name HB1 )   (resid 41 and name HN  )    6.0  4.2 0.0 
assign (resid 40 and name HB2 )   (resid 41 and name HN  )    6.0  4.2 0.0 
assign (resid 41 and name HN  )   (resid 41 and name HD1 )    4.5  2.7 0.0 
assign (resid 41 and name HN  )   (resid 42 and name HN  )    5.2  3.4 0.0 
assign (resid 41 and name HB1 )   (resid 41 and name HZ3 )    6.0  4.2 0.0 
assign (resid 41 and name HB1 )   (resid 42 and name HN  )    4.3  2.5 0.0 
assign (resid 41 and name HB2 )   (resid 41 and name HZ3 )    6.0  4.2 0.0 
assign (resid 41 and name HB2 )   (resid 42 and name HN  )    4.3  2.5 0.0 
assign (resid 41 and name HE3 )   (resid 42 and name HN  )    6.0  4.2 0.0 
assign (resid 41 and name HZ3 )   (resid 42 and name HN  )    6.0  4.2 0.0 
assign (resid 42 and name HN  )   (resid 42 and name HB1 )    3.0  1.2 0.0 
assign (resid 42 and name HN  )   (resid 42 and name HB2 )    3.7  1.9 0.0 
assign (resid 42 and name HN  )   (resid 43 and name HN  )    4.9  3.1 0.0 
assign (resid 42 and name HA  )   (resid 42 and name HB2 )    3.0  1.2 0.0 
assign (resid 42 and name HA  )   (resid 43 and name HN  )    2.6  0.8 0.0 
assign (resid 42 and name HB1 )   (resid 43 and name HN  )    6.0  4.2 0.0 
assign (resid 42 and name HB2 )   (resid 43 and name HN  )    6.0  4.2 0.0 
assign (resid 43 and name HN  )   (resid 44 and name HN  )    3.2  1.4 0.0 
assign (resid 43 and name HA  )   (resid 44 and name HN  )    2.5  0.7 0.0 
assign (resid 43 and name HA  )   (resid 44 and name QG2 )    7.0  5.2 0.0 
assign (resid 43 and name HB1 )   (resid 44 and name HN  )    5.1  3.3 0.0 
assign (resid 43 and name HB2 )   (resid 44 and name HN  )    5.1  3.3 0.0 
assign (resid 17 and name O   )   (resid 21 and name N   )    3.0  0.5 0.5 
assign (resid 17 and name O   )   (resid 21 and name HN  )    2.0  0.5 0.35 
assign (resid 19 and name O   )   (resid 23 and name N   )    3.0  0.5 0.5 
assign (resid 19 and name O   )   (resid 23 and name HN  )    2.0  0.5 0.35 
assign (resid 22 and name O   )   (resid 27 and name N   )    3.0  0.5 0.5 
assign (resid 22 and name O   )   (resid 27 and name HN  )    2.0  0.5 0.35 
assign (resid 31 and name O   )   (resid 41 and name N   )    3.0  0.5 0.5 
assign (resid 31 and name O   )   (resid 41 and name HN  )    2.0  0.5 0.35 
assign (resid 39 and name O   )   (resid 33 and name N   )    3.0  0.5 0.5 
assign (resid 39 and name O   )   (resid 33 and name HN  )    2.0  0.5 0.35 
assign (resid  5 and name O   )   (resid 40 and name N   )    3.0  0.5 0.5 
assign (resid  5 and name O   )   (resid 40 and name HN  )    2.0  0.5 0.35 
assign (resid 18 and name O   )   (resid 22 and name N   )    3.0  0.5 0.5 
assign (resid 18 and name O   )   (resid 22 and name HN  )    2.0  0.5 0.35 
assign (resid 41 and name O   )   (resid 31 and name N   )    3.0  0.5 0.5 
assign (resid 41 and name O   )   (resid 31 and name HN  )    2.0  0.5 0.35 
assign (resid 20 and name O   )   (resid 24 and name N   )    3.0  0.5 0.5 
assign (resid 20 and name O   )   (resid 24 and name HN  )    2.0  0.5 0.35 
assign (resid  2 and name O   )   (resid 42 and name N   )    3.0  0.5 0.5 
assign (resid  2 and name O   )   (resid 42 and name HN  )    2.0  0.5 0.35 
assign (resid 13 and name O   )   (resid  6 and name N   )    3.0  0.5 0.5 
assign (resid 13 and name O   )   (resid  6 and name HN  )    2.0  0.5 0.35 
assign (resid 23 and name O   )   (resid 26 and name N   )    3.0  0.5 0.5 
assign (resid 23 and name O   )   (resid 26 and name HN  )    2.0  0.5 0.35 
assign (resid 22 and name O   )   (resid 25 and name HN  )    3.0  0.5 0.5 
assign (resid 22 and name O   )   (resid 25 and name HN  )    2.0  0.5 0.35 
classification NAS !
assign (resid  1 and name HB* )   (resid  2 and name HN  )    3.2  1.4 0.0 
assign (resid  1 and name HB* )   (resid  2 and name HA  )    6.9  5.1 0.0 
assign (resid  1 and name HB* )   (resid 41 and name HE3 )    6.9  5.1 0.0 
assign (resid  1 and name HB* )   (resid 41 and name HZ3 )    6.9  5.1 0.0 
assign (resid  1 and name HB* )   (resid 42 and name HN  )    6.9  5.1 0.0 
assign (resid  1 and name HB* )   (resid 43 and name HA  )    6.9  5.1 0.0 
assign (resid  2 and name HN  )   (resid  2 and name HG* )    6.9  5.1 0.0 
assign (resid  2 and name HA  )   (resid  2 and name HG* )    3.4  1.6 0.0 
assign (resid  2 and name HB* )   (resid  3 and name HN  )    5.8  4.0 0.0 
assign (resid  2 and name HB* )   (resid 27 and name HE* )    9.0  7.2 0.0 
assign (resid  2 and name HB* )   (resid 42 and name HN  )    6.9  5.1 0.0 
assign (resid  2 and name HG* )   (resid  3 and name HN  )    6.9  5.1 0.0 
assign (resid  2 and name HG* )   (resid 27 and name HE* )    9.0  7.2 0.0 
assign (resid  2 and name HG* )   (resid 28 and name HD* )    7.8  5.9 0.0 
assign (resid  2 and name HD* )   (resid  3 and name HN  )    4.8  3.0 0.0 
assign (resid  2 and name HD* )   (resid 27 and name HE* )    9.0  7.2 0.0 
assign (resid  3 and name HN  )   (resid  3 and name HB* )    3.5  1.7 0.0 
assign (resid  3 and name HB* )   (resid  4 and name HN  )    3.7  1.9 0.0 
assign (resid  3 and name HB* )   (resid 41 and name HE3 )    6.9  5.1 0.0 
assign (resid  3 and name HB* )   (resid 41 and name HZ3 )    5.3  3.5 0.0 
assign (resid  3 and name HB* )   (resid 41 and name HH2 )    6.2  4.4 0.0 
assign (resid  3 and name HD* )   (resid  4 and name HN  )    6.1  4.3 0.0 
assign (resid  3 and name HD* )   (resid  5 and name HN  )    4.2  2.4 0.0 
assign (resid  3 and name HD* )   (resid 39 and name HA  )    8.4  6.6 0.0 
assign (resid  3 and name HD* )   (resid 39 and name HB* )    5.5  3.7 0.0 
assign (resid  3 and name HD* )   (resid 39 and name HD2*)    7.2  5.4 0.0 
assign (resid  3 and name HD* )   (resid 40 and name HN  )    6.3  4.5 0.0 
assign (resid  3 and name HD* )   (resid 41 and name HA  )    8.6  6.8 0.0 
assign (resid  3 and name HD* )   (resid 41 and name HD1 )    8.6  6.8 0.0 
assign (resid  3 and name HD* )   (resid 41 and name HE3 )    8.6  6.8 0.0 
assign (resid  3 and name HD* )   (resid 41 and name HE1 )    6.2  4.4 0.0 
assign (resid  3 and name HD* )   (resid 41 and name HZ2 )    8.6  6.8 0.0 
assign (resid  4 and name HN  )   (resid  4 and name HG1*)    4.4  2.6 0.0 
assign (resid  4 and name QG2 )   (resid 21 and name HB* )    7.9  6.1 0.0 
assign (resid  4 and name QG2 )   (resid 21 and name HG* )    7.9  6.1 0.0 
assign (resid  4 and name QG2 )   (resid 27 and name HD* )    9.2  7.4 0.0 
assign (resid  4 and name QG2 )   (resid 27 and name HE* )    9.2  7.4 0.0 
assign (resid  4 and name QG2 )   (resid 40 and name HB* )    7.9  6.1 0.0 
assign (resid  4 and name HG1*)   (resid  5 and name HN  )    6.4  4.6 0.0 
assign (resid  4 and name QD  )   (resid  5 and name HA* )    7.9  6.1 0.0 
assign (resid  4 and name QD  )   (resid 21 and name HG* )    7.9  6.1 0.0 
assign (resid  4 and name QD  )   (resid 27 and name HD* )    9.2  7.4 0.0 
assign (resid  4 and name QD  )   (resid 27 and name HE* )    9.2  7.4 0.0 
assign (resid  4 and name QD  )   (resid 40 and name HB* )    7.9  6.1 0.0 
assign (resid  5 and name HN  )   (resid 40 and name HB* )    4.6  2.8 0.0 
assign (resid  5 and name HA* )   (resid  6 and name HN  )    2.8  1.0 0.0 
assign (resid  5 and name HA* )   (resid 13 and name HB* )    3.9  2.1 0.0 
assign (resid  5 and name HA* )   (resid 13 and name HD2*)    6.3  4.5 0.0 
assign (resid  6 and name HN  )   (resid  6 and name HB* )    3.0  0.5 0.5 
assign (resid  6 and name HB* )   (resid  7 and name HN  )    3.7  1.9 0.0 
assign (resid  6 and name HB* )   (resid  8 and name HN  )    3.5  1.7 0.0 
assign (resid  6 and name HB* )   (resid 11 and name QB  )    4.4  2.6 0.0 
assign (resid  7 and name HN  )   (resid  7 and name HB* )    3.2  1.4 0.0 
assign (resid  7 and name HA  )   (resid 14 and name HD* )    6.7  4.9 0.0 
assign (resid  7 and name HA  )   (resid 14 and name HE* )    6.7  4.9 0.0 
assign (resid  7 and name HB* )   (resid  8 and name HN  )    5.6  3.8 0.0 
assign (resid  7 and name HB* )   (resid 32 and name HB2 )    3.4  1.6 0.0 
assign (resid  8 and name HN  )   (resid 14 and name HD* )    7.8  5.9 0.0 
assign (resid  8 and name HA  )   (resid  9 and name HB* )    6.9  5.1 0.0 
assign (resid  8 and name HA  )   (resid 14 and name HE* )    8.1  6.3 0.0 
assign (resid  8 and name QG1 )   (resid 14 and name HD* )    9.2  7.4 0.0 
assign (resid  8 and name QG1 )   (resid 14 and name HE* )    9.2  7.4 0.0 
assign (resid  9 and name HN  )   (resid  9 and name HB* )    3.7  1.9 0.0 
assign (resid  9 and name HN  )   (resid 14 and name HD* )    8.1  6.3 0.0 
assign (resid  9 and name HN  )   (resid 14 and name HE* )    8.0  6.2 0.0 
assign (resid  9 and name HB* )   (resid 10 and name HN  )    6.9  5.1 0.0 
assign (resid  9 and name HB* )   (resid 14 and name HD* )    9.0  7.2 0.0 
assign (resid  9 and name HB* )   (resid 14 and name HE* )    9.0  7.2 0.0 
assign (resid  9 and name HD1 )   (resid 14 and name HE* )    8.1  6.3 0.0 
assign (resid  9 and name HE3 )   (resid 10 and name HA* )    6.7  4.9 0.0 
assign (resid  9 and name HE3 )   (resid 14 and name HE* )    8.1  6.3 0.0 
assign (resid 11 and name HN  )   (resid 14 and name HB* )    4.2  2.4 0.0 
assign (resid 11 and name QB  )   (resid 14 and name HB* )    6.9  5.1 0.0 
assign (resid 11 and name QB  )   (resid 14 and name HD* )    9.2  7.4 0.0 
assign (resid 12 and name QG1 )   (resid 13 and name HD2*)    6.4  4.6 0.0 
assign (resid 12 and name QG2 )   (resid 13 and name HD2*)    7.9  6.1 0.0 
assign (resid 14 and name HD* )   (resid 15 and name HN  )    8.1  6.3 0.0 
assign (resid 14 and name HD* )   (resid 15 and name QG2 )    9.2  7.4 0.0 
assign (resid 14 and name HD* )   (resid 16 and name HB1 )    7.7  5.9 0.0 
assign (resid 14 and name HD* )   (resid 16 and name HB2 )    7.7  5.9 0.0 
assign (resid 14 and name HD* )   (resid 16 and name HB* )    7.5  5.7 0.0 
assign (resid 14 and name HE* )   (resid 15 and name QG2 )    9.2  7.4 0.0 
assign (resid 14 and name HE* )   (resid 16 and name HN  )    8.1  6.3 0.0 
assign (resid 14 and name HE* )   (resid 16 and name HB1 )    6.7  4.9 0.0 
assign (resid 14 and name HE* )   (resid 16 and name HB2 )    6.7  4.9 0.0 
assign (resid 14 and name HE* )   (resid 16 and name HB* )    6.5  4.7 0.0 
assign (resid 15 and name QG2 )   (resid 21 and name HB* )    7.9  6.1 0.0 
assign (resid 15 and name QG2 )   (resid 21 and name HG* )    7.9  6.1 0.0 
assign (resid 15 and name QG2 )   (resid 40 and name HB* )    4.4  2.6 0.0 
assign (resid 16 and name HN  )   (resid 16 and name HB* )    3.7  1.9 0.0 
assign (resid 16 and name HB* )   (resid 17 and name HN  )    4.0  2.2 0.0 
assign (resid 18 and name HA  )   (resid 21 and name HB* )    5.1  3.3 0.0 
assign (resid 19 and name HN  )   (resid 19 and name HB* )    3.4  1.6 0.0 
assign (resid 19 and name HN  )   (resid 19 and name HD2*)    6.7  4.9 0.0 
assign (resid 19 and name HA  )   (resid 30 and name HA* )    4.2  2.4 0.0 
assign (resid 19 and name HB* )   (resid 20 and name HN  )    3.2  1.4 0.0 
assign (resid 19 and name HB* )   (resid 30 and name HN  )    5.2  3.4 0.0 
assign (resid 19 and name HD21)   (resid 23 and name HD* )    7.4  5.6 0.0 
assign (resid 19 and name HD22)   (resid 23 and name HD* )    7.4  5.6 0.0 
assign (resid 19 and name HD2*)   (resid 23 and name HD* )    6.8  5.0 0.0 
assign (resid 20 and name HA1 )   (resid 23 and name HD* )    6.9  5.1 0.0 
assign (resid 20 and name HA2 )   (resid 23 and name HD* )    6.9  5.1 0.0 
assign (resid 20 and name HA* )   (resid 21 and name HN  )    3.0  0.5 0.5 
assign (resid 20 and name HA* )   (resid 22 and name HN  )    5.6  3.8 0.0 
assign (resid 20 and name HA* )   (resid 23 and name HN  )    4.7  2.9 0.0 
assign (resid 20 and name HA* )   (resid 23 and name HB1 )    4.3  2.5 0.0 
assign (resid 20 and name HA* )   (resid 23 and name HB2 )    5.6  3.8 0.0 
assign (resid 20 and name HA* )   (resid 23 and name HD* )    6.3  4.5 0.0 
assign (resid 21 and name HN  )   (resid 21 and name HB* )    3.5  1.7 0.0 
assign (resid 21 and name HN  )   (resid 21 and name HG* )    5.3  3.5 0.0 
assign (resid 21 and name HA  )   (resid 21 and name HG* )    3.9  2.1 0.0 
assign (resid 21 and name HA  )   (resid 24 and name HB* )    4.4  2.6 0.0 
assign (resid 21 and name HA  )   (resid 24 and name HD* )    6.0  4.2 0.0 
assign (resid 21 and name HB* )   (resid 22 and name HN  )    3.2  1.5 0.0 
assign (resid 21 and name HG* )   (resid 25 and name HE  )    4.2  2.4 0.0 
assign (resid 22 and name HN  )   (resid 23 and name HD* )    8.1  6.3 0.0 
assign (resid 22 and name HB1 )   (resid 30 and name HA* )    6.9  5.1 0.0 
assign (resid 22 and name HB2 )   (resid 27 and name HB* )    6.9  5.1 0.0 
assign (resid 22 and name HB2 )   (resid 30 and name HA* )    6.9  5.1 0.0 
assign (resid 23 and name HN  )   (resid 23 and name HD* )    6.7  4.9 0.0 
assign (resid 23 and name HG  )   (resid 29 and name HA* )    4.9  3.1 0.0 
assign (resid 23 and name HD* )   (resid 29 and name HN  )    8.1  6.3 0.0 
assign (resid 24 and name HN  )   (resid 24 and name HB* )    2.7  0.9 0.0 
assign (resid 24 and name HN  )   (resid 24 and name HD* )    6.6  4.8 0.0 
assign (resid 24 and name HB* )   (resid 25 and name HN  )    4.5  2.7 0.0 
assign (resid 25 and name HN  )   (resid 25 and name HB* )    3.7  1.9 0.0 
assign (resid 25 and name HN  )   (resid 25 and name HG* )    4.7  2.9 0.0 
assign (resid 25 and name HN  )   (resid 25 and name HD* )    6.9  5.1 0.0 
assign (resid 25 and name HN  )   (resid 27 and name HD* )    7.7  5.9 0.0 
assign (resid 25 and name HA  )   (resid 25 and name HG* )    3.7  1.9 0.0 
assign (resid 25 and name HA  )   (resid 25 and name HD* )    4.7  2.9 0.0 
assign (resid 25 and name HA  )   (resid 27 and name HD* )    8.1  6.3 0.0 
assign (resid 25 and name HA  )   (resid 27 and name HE* )    8.0  6.2 0.0 
assign (resid 25 and name HB1 )   (resid 27 and name HD* )    6.7  4.9 0.0 
assign (resid 25 and name HB1 )   (resid 27 and name HE* )    6.2  4.4 0.0 
assign (resid 25 and name HB2 )   (resid 27 and name HD* )    6.7  4.9 0.0 
assign (resid 25 and name HB2 )   (resid 27 and name HE* )    6.2  4.4 0.0 
assign (resid 25 and name HB* )   (resid 25 and name HD* )    3.6  1.8 0.0 
assign (resid 25 and name HB* )   (resid 25 and name HE  )    4.0  2.2 0.0 
assign (resid 25 and name HB* )   (resid 27 and name HD* )    6.2  4.4 0.0 
assign (resid 25 and name HB* )   (resid 27 and name HE* )    6.1  4.3 0.0 
assign (resid 25 and name HG* )   (resid 25 and name HE  )    3.7  1.9 0.0 
assign (resid 25 and name HG* )   (resid 27 and name HD* )    6.6  4.8 0.0 
assign (resid 25 and name HG* )   (resid 27 and name HE* )    7.1  5.3 0.0 
assign (resid 25 and name HD1 )   (resid 27 and name HE* )    7.4  5.6 0.0 
assign (resid 25 and name HD2 )   (resid 27 and name HE* )    7.4  5.6 0.0 
assign (resid 25 and name HD* )   (resid 27 and name HD* )    9.0  7.2 0.0 
assign (resid 26 and name HN  )   (resid 27 and name HD* )    8.1  6.3 0.0 
assign (resid 27 and name HN  )   (resid 27 and name HE* )    6.1  4.3 0.0 
assign (resid 27 and name HB* )   (resid 28 and name HG* )    7.8  6.0 0.0 
assign (resid 27 and name HB* )   (resid 42 and name HB2 )    4.8  3.0 0.0 
assign (resid 27 and name HB* )   (resid 43 and name HN  )    6.9  5.1 0.0 
assign (resid 27 and name HD* )   (resid 42 and name HA  )    5.6  3.8 0.0 
assign (resid 27 and name HD* )   (resid 42 and name HB2 )    6.6  4.8 0.0 
assign (resid 27 and name HD* )   (resid 44 and name HA  )    6.8  5.0 0.0 
assign (resid 27 and name HD* )   (resid 44 and name QG2 )    9.2  7.4 0.0 
assign (resid 27 and name HE* )   (resid 28 and name HG* )    9.0  7.2 0.0 
assign (resid 27 and name HE* )   (resid 42 and name HB2 )    8.1  6.3 0.0 
assign (resid 27 and name HE* )   (resid 44 and name HA  )    8.1  6.3 0.0 
assign (resid 27 and name HE* )   (resid 44 and name HB  )    8.1  6.3 0.0 
assign (resid 27 and name HE* )   (resid 44 and name QG2 )    7.0  5.2 0.0 
assign (resid 28 and name HN  )   (resid 28 and name HB* )    3.6  1.8 0.0 
assign (resid 28 and name HN  )   (resid 28 and name HG* )    6.9  5.1 0.0 
assign (resid 28 and name HB* )   (resid 29 and name HN  )    3.7  1.9 0.0 
assign (resid 28 and name HG* )   (resid 29 and name HN  )    6.4  4.6 0.0 
assign (resid 29 and name HA* )   (resid 30 and name HN  )    3.2  1.4 0.0 
assign (resid 30 and name HA* )   (resid 31 and name HN  )    2.8  1.0 0.0 
assign (resid 30 and name HA* )   (resid 43 and name HN  )    4.2  2.4 0.0 
assign (resid 30 and name HA* )   (resid 43 and name HG* )    6.3  4.5 0.0 
assign (resid 31 and name HN  )   (resid 41 and name HB* )    5.7  3.9 0.0 
assign (resid 31 and name HD2 )   (resid 33 and name HA* )    4.4  2.6 0.0 
assign (resid 31 and name HD2 )   (resid 41 and name HB* )    6.9  5.1 0.0 
assign (resid 31 and name HE1 )   (resid 41 and name HB* )    6.9  5.1 0.0 
assign (resid 31 and name HE1 )   (resid 43 and name HG* )    4.8  3.0 0.0 
assign (resid 32 and name HB2 )   (resid 37 and name HB* )    4.9  3.1 0.0 
assign (resid 33 and name HN  )   (resid 33 and name HA* )    2.5  0.7 0.0 
assign (resid 33 and name HA* )   (resid 37 and name HA  )    5.2  3.4 0.0 
assign (resid 33 and name HA* )   (resid 41 and name HD1 )    4.2  2.4 0.0 
assign (resid 34 and name HN  )   (resid 34 and name HB* )    3.7  1.9 0.0 
assign (resid 35 and name HB* )   (resid 36 and name HN  )    4.5  2.7 0.0 
assign (resid 35 and name HD* )   (resid 36 and name HN  )    8.1  6.3 0.0 
assign (resid 35 and name HD* )   (resid 36 and name QB  )    9.1  7.3 0.0 
assign (resid 35 and name HE* )   (resid 36 and name QB  )    8.4  6.6 0.0 
assign (resid 36 and name QB  )   (resid 38 and name HG* )    7.8  6.0 0.0 
assign (resid 37 and name HN  )   (resid 37 and name HB* )    3.0  0.5 0.5 
assign (resid 38 and name HG* )   (resid 39 and name HD2*)    8.0  6.2 0.0 
assign (resid 39 and name HN  )   (resid 39 and name HB* )    3.2  1.4 0.0 
assign (resid 39 and name HB* )   (resid 41 and name HD1 )    6.9  5.1 0.0 
assign (resid 39 and name HD2*)   (resid 41 and name HE1 )    6.9  5.1 0.0 
assign (resid 39 and name HD2*)   (resid 41 and name HZ2 )    6.9  5.1 0.0 
assign (resid 40 and name HN  )   (resid 40 and name HB* )    3.0  0.5 0.5 
assign (resid 40 and name HN  )   (resid 41 and name HB* )    6.9  5.1 0.0 
assign (resid 40 and name HB* )   (resid 41 and name HN  )    5.3  3.5 0.0 
assign (resid 41 and name HN  )   (resid 41 and name HB* )    3.5  1.7 0.0 
assign (resid 41 and name HA  )   (resid 41 and name HB* )    2.6  0.8 0.0 
assign (resid 41 and name HB* )   (resid 42 and name HN  )    4.0  2.2 0.0 
assign (resid 42 and name HA  )   (resid 43 and name HG* )    6.9  5.1 0.0 
assign (resid 43 and name HN  )   (resid 43 and name HB* )    3.7  1.9 0.0 
assign (resid 43 and name HN  )   (resid 43 and name HG* )    4.7  2.9 0.0 
assign (resid 43 and name HB* )   (resid 44 and name HN  )    4.4  2.6 0.0 
assign (resid 43 and name HG* )   (resid 44 and name HN  )    4.9  3.1 0.0 


  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H    ASP   1          HT1       ASP   1   0.034   0.087  -0.198
    2   2H    ASP   1          HT2       ASP   1   0.774  -1.414   0.205
    3   3H    ASP   1          HT3       ASP   1   1.253   0.058   0.950
    4    HA   ASP   1           HA       ASP   1   1.468   0.358  -1.820
    5   1HB   ASP   1          HB1       ASP   1   3.717   0.014   0.233
    6   2HB   ASP   1          HB2       ASP   1   3.748   0.998  -1.216
    7    H    LYS   2           HN       LYS   2   3.095  -0.755  -3.156
    8    HA   LYS   2           HA       LYS   2   3.547  -3.586  -2.497
    9   1HB   LYS   2          HB1       LYS   2   1.871  -2.370  -4.609
   10   2HB   LYS   2          HB2       LYS   2   3.163  -3.276  -5.273
   11   1HG   LYS   2          HG1       LYS   2   0.960  -4.607  -4.803
   12   2HG   LYS   2          HG2       LYS   2   2.434  -5.330  -4.188
   13   1HD   LYS   2          HD1       LYS   2   1.994  -4.526  -1.947
   14   2HD   LYS   2          HD2       LYS   2   0.631  -3.562  -2.479
   15   1HE   LYS   2          HE1       LYS   2  -0.594  -5.642  -2.942
   16   2HE   LYS   2          HE2       LYS   2   0.852  -6.596  -2.612
   17   1HZ   LYS   2          HZ1       LYS   2   0.369  -6.501  -0.442
   18   2HZ   LYS   2          HZ2       LYS   2   0.473  -4.808  -0.477
   19   3HZ   LYS   2          HZ3       LYS   2  -1.013  -5.582  -0.772
   20    H    LEU   3           HN       LEU   3   5.544  -3.317  -1.985
   21    HA   LEU   3           HA       LEU   3   7.507  -1.756  -3.273
   22   1HB   LEU   3          HB1       LEU   3   7.705  -2.932  -1.019
   23   2HB   LEU   3          HB2       LEU   3   7.872  -4.451  -1.863
   24    HG   LEU   3           HG       LEU   3   9.878  -2.235  -2.510
   25   1HD1  LEU   3          HD1       LEU   3  11.292  -2.969  -0.664
   26   2HD1  LEU   3          HD1       LEU   3   9.758  -2.269  -0.083
   27   3HD1  LEU   3          HD1       LEU   3   9.982  -4.040  -0.070
   28   1HD2  LEU   3          HD2       LEU   3  11.424  -4.092  -2.693
   29   2HD2  LEU   3          HD2       LEU   3  10.188  -5.235  -2.062
   30   3HD2  LEU   3          HD2       LEU   3   9.979  -4.501  -3.661
   31    H    ILE   4           HN       ILE   4   9.259  -2.552  -4.558
   32    HA   ILE   4           HA       ILE   4   8.587  -4.777  -6.408
   33    HB   ILE   4           HB       ILE   4   9.470  -3.108  -8.253
   34   1HG1  ILE   4          HG1       ILE   4   8.855  -1.183  -5.978
   35   2HG1  ILE   4          HG1       ILE   4  10.282  -1.316  -6.999
   36   1HG2  ILE   4          HG2       ILE   4   6.782  -2.740  -6.906
   37   2HG2  ILE   4          HG2       ILE   4   7.162  -2.354  -8.622
   38   3HG2  ILE   4          HG2       ILE   4   7.228  -4.035  -8.057
   39   1HD1  ILE   4          HD1       ILE   4   8.939  -0.620  -8.945
   40   2HD1  ILE   4          HD2       ILE   4   7.505  -0.506  -7.852
   41   3HD1  ILE   4          HD3       ILE   4   8.868   0.601  -7.640
   42    H    GLY   5           HN       GLY   5  11.062  -2.503  -5.274
   43   1HA   GLY   5          HA1       GLY   5  12.975  -4.468  -4.705
   44   2HA   GLY   5          HA2       GLY   5  13.264  -3.953  -6.370
   45    H    SER   6           HN       SER   6  15.265  -2.994  -5.828
   46    HA   SER   6           HA       SER   6  15.186  -0.765  -3.949
   47   1HB   SER   6          HB1       SER   6  17.330  -2.488  -5.262
   48   2HB   SER   6          HB2       SER   6  17.682  -1.040  -4.352
   49    HG   SER   6           HG       SER   6  16.044  -2.014  -2.742
   50    H    CYS   7           HN       CYS   7  16.505   1.113  -4.705
   51    HA   CYS   7           HA       CYS   7  16.179   1.814  -7.555
   52   1HB   CYS   7          HB1       CYS   7  14.117   2.661  -6.494
   53   2HB   CYS   7          HB2       CYS   7  15.033   3.399  -5.198
   54    H    VAL   8           HN       VAL   8  18.474   1.080  -6.279
   55    HA   VAL   8           HA       VAL   8  19.954   3.659  -6.019
   56    HB   VAL   8           HB       VAL   8  20.543   0.956  -4.698
   57   1HG1  VAL   8          HG1       VAL   8  22.632   2.159  -5.267
   58   2HG1  VAL   8          HG1       VAL   8  21.994   3.607  -4.433
   59   3HG1  VAL   8          HG1       VAL   8  22.351   2.115  -3.506
   60   1HG2  VAL   8          HG2       VAL   8  19.782   3.637  -3.514
   61   2HG2  VAL   8          HG2       VAL   8  18.718   2.207  -3.676
   62   3HG2  VAL   8          HG2       VAL   8  20.144   2.134  -2.607
   63    H    TRP   9           HN       TRP   9  21.471   3.977  -7.487
   64    HA   TRP   9           HA       TRP   9  21.880   1.968  -9.568
   65   1HB   TRP   9          HB1       TRP   9  22.285   4.880  -9.353
   66   2HB   TRP   9          HB2       TRP   9  23.760   4.130  -9.939
   67    HD1  TRP   9           HD1      TRP   9  20.367   5.217 -11.214
   68    HE1  TRP   9           HE1      TRP   9  20.091   4.195 -13.503
   69    HE3  TRP   9           HE3      TRP   9  24.191   1.950 -11.236
   70    HZ2  TRP   9           HZ2      TRP   9  21.281   2.224 -15.225
   71    HZ3  TRP   9           HZ3      TRP   9  24.624   0.491 -13.183
   72    HH2  TRP   9           HH2      TRP   9  23.169   0.629 -15.184
   73    H    GLY  10           HN       GLY  10  22.600   0.468  -8.021
   74   1HA   GLY  10          HA1       GLY  10  25.010  -0.611  -8.140
   75   2HA   GLY  10          HA2       GLY  10  25.414   0.750  -7.102
   76    H    ALA  11           HN       ALA  11  22.791  -1.641  -7.273
   77    HA   ALA  11           HA       ALA  11  23.448  -2.704  -4.647
   78   1HB   ALA  11          HB1       ALA  11  22.136  -0.694  -4.102
   79   2HB   ALA  11          HB2       ALA  11  20.832  -1.261  -5.190
   80   3HB   ALA  11          HB3       ALA  11  21.210  -2.171  -3.700
   81    H    VAL  12           HN       VAL  12  21.679  -4.318  -4.060
   82    HA   VAL  12           HA       VAL  12  21.335  -6.115  -6.338
   83    HB   VAL  12           HB       VAL  12  20.218  -6.554  -3.565
   84   1HG1  VAL  12          HG1       VAL  12  19.642  -8.295  -5.080
   85   2HG1  VAL  12          HG1       VAL  12  21.367  -8.483  -5.569
   86   3HG1  VAL  12          HG1       VAL  12  20.830  -8.893  -3.912
   87   1HG2  VAL  12          HG2       VAL  12  22.387  -7.546  -2.872
   88   2HG2  VAL  12          HG2       VAL  12  23.101  -6.994  -4.419
   89   3HG2  VAL  12          HG2       VAL  12  22.538  -5.803  -3.206
   90    H    ASN  13           HN       ASN  13  19.141  -7.227  -6.428
   91    HA   ASN  13           HA       ASN  13  17.012  -6.949  -7.382
   92   1HB   ASN  13          HB1       ASN  13  15.571  -5.620  -5.379
   93   2HB   ASN  13          HB2       ASN  13  15.907  -7.331  -5.371
   94   1HD2  ASN  13          HD2       ASN  13  16.669  -4.292  -3.622
   95   2HD2  ASN  13          HD2       ASN  13  17.683  -5.079  -2.546
   96    H    TYR  14           HN       TYR  14  18.952  -4.945  -7.964
   97    HA   TYR  14           HA       TYR  14  18.053  -2.316  -7.846
   98   1HB   TYR  14          HB1       TYR  14  20.288  -2.916  -8.733
   99   2HB   TYR  14          HB2       TYR  14  19.557  -3.745 -10.105
  100    HD1  TYR  14           HD1      TYR  14  19.824  -2.522 -12.064
  101    HD2  TYR  14           HD2      TYR  14  18.964  -0.408  -8.459
  102    HE1  TYR  14           HE1      TYR  14  19.735  -0.430 -13.306
  103    HE2  TYR  14           HE2      TYR  14  18.860   1.688  -9.718
  104    HH   TYR  14           HH       TYR  14  19.979   2.457 -12.037
  105    H    THR  15           HN       THR  15  16.561  -1.068  -8.955
  106    HA   THR  15           HA       THR  15  14.615  -2.585 -10.523
  107    HB   THR  15           HB       THR  15  14.618   0.130  -9.162
  108    HG1  THR  15           HG1      THR  15  13.976  -1.315  -7.777
  109   1HG2  THR  15          HG2       THR  15  13.176   0.233 -11.251
  110   2HG2  THR  15          HG2       THR  15  12.320  -1.213 -10.637
  111   3HG2  THR  15          HG2       THR  15  12.304   0.306  -9.690
  112    H    SER  16           HN       SER  16  15.811   0.736 -10.961
  113    HA   SER  16           HA       SER  16  16.866   1.727 -12.779
  114   1HB   SER  16          HB1       SER  16  17.418  -0.972 -13.537
  115   2HB   SER  16          HB2       SER  16  16.375  -0.405 -14.842
  116    HG   SER  16           HG       SER  16  18.473   1.190 -13.755
  117    H    ASP  17           HN       ASP  17  13.990  -0.198 -13.168
  118    HA   ASP  17           HA       ASP  17  12.701   2.120 -14.472
  119   1HB   ASP  17          HB1       ASP  17  11.637   0.492 -16.074
  120   2HB   ASP  17          HB2       ASP  17  13.378   0.660 -16.233
  121    H    CYS  18           HN       CYS  18  12.096   2.267 -12.165
  122    HA   CYS  18           HA       CYS  18  10.552   0.528 -10.639
  123   1HB   CYS  18          HB1       CYS  18  11.307   3.045 -10.327
  124   2HB   CYS  18          HB2       CYS  18   9.745   3.458 -10.951
  125    H    ASN  19           HN       ASN  19   8.969   2.956 -12.640
  126    HA   ASN  19           HA       ASN  19   6.437   1.894 -12.741
  127   1HB   ASN  19          HB1       ASN  19   7.477   3.967 -14.014
  128   2HB   ASN  19          HB2       ASN  19   7.654   2.844 -15.351
  129   1HD2  ASN  19          HD2       ASN  19   5.458   1.316 -15.472
  130   2HD2  ASN  19          HD2       ASN  19   4.040   2.244 -15.475
  131    H    GLY  20           HN       GLY  20   9.256   0.790 -14.366
  132   1HA   GLY  20          HA1       GLY  20   8.009  -1.089 -16.165
  133   2HA   GLY  20          HA2       GLY  20   9.704  -1.089 -15.698
  134    H    GLU  21           HN       GLU  21   9.866  -1.634 -13.259
  135    HA   GLU  21           HA       GLU  21   9.253  -4.359 -12.895
  136   1HB   GLU  21          HB1       GLU  21  10.917  -2.813 -11.591
  137   2HB   GLU  21          HB2       GLU  21   9.563  -2.434 -10.561
  138   1HG   GLU  21          HG1       GLU  21  10.548  -4.311  -9.413
  139   2HG   GLU  21          HG2       GLU  21   9.257  -5.028 -10.284
  140    H    CYS  22           HN       CYS  22   7.526  -1.523 -12.057
  141    HA   CYS  22           HA       CYS  22   5.521  -2.798 -10.411
  142   1HB   CYS  22          HB1       CYS  22   5.899  -0.093 -11.619
  143   2HB   CYS  22          HB2       CYS  22   4.300  -0.513 -11.157
  144    H    LEU  23           HN       LEU  23   5.711  -1.676 -13.803
  145    HA   LEU  23           HA       LEU  23   3.086  -2.444 -14.495
  146   1HB   LEU  23          HB1       LEU  23   5.669  -1.831 -15.916
  147   2HB   LEU  23          HB2       LEU  23   4.411  -2.584 -16.815
  148    HG   LEU  23           HG       LEU  23   4.049  -0.011 -15.230
  149   1HD1  LEU  23          HD1       LEU  23   5.676   0.221 -17.111
  150   2HD1  LEU  23          HD1       LEU  23   4.461  -0.481 -18.216
  151   3HD1  LEU  23          HD1       LEU  23   4.164   1.111 -17.456
  152   1HD2  LEU  23          HD2       LEU  23   2.351  -1.308 -17.374
  153   2HD2  LEU  23          HD2       LEU  23   1.946  -1.196 -15.634
  154   3HD2  LEU  23          HD2       LEU  23   2.039   0.286 -16.616
  155    H    LEU  24           HN       LEU  24   6.136  -4.070 -14.222
  156    HA   LEU  24           HA       LEU  24   5.515  -6.414 -15.693
  157   1HB   LEU  24          HB1       LEU  24   7.586  -5.357 -13.941
  158   2HB   LEU  24          HB2       LEU  24   7.240  -6.978 -13.474
  159    HG   LEU  24           HG       LEU  24   7.872  -6.001 -16.300
  160   1HD1  LEU  24          HD1       LEU  24   9.799  -5.725 -14.795
  161   2HD1  LEU  24          HD1       LEU  24   9.662  -7.436 -14.295
  162   3HD1  LEU  24          HD1       LEU  24  10.088  -7.026 -15.983
  163   1HD2  LEU  24          HD2       LEU  24   6.604  -8.123 -16.251
  164   2HD2  LEU  24          HD2       LEU  24   8.275  -8.384 -16.820
  165   3HD2  LEU  24          HD2       LEU  24   7.822  -8.819 -15.143
  166    H    ARG  25           HN       ARG  25   4.767  -5.353 -12.636
  167    HA   ARG  25           HA       ARG  25   3.470  -7.884 -11.747
  168   1HB   ARG  25          HB1       ARG  25   4.309  -5.357 -10.335
  169   2HB   ARG  25          HB2       ARG  25   2.959  -6.221  -9.664
  170   1HG   ARG  25          HG1       ARG  25   4.376  -7.504  -8.473
  171   2HG   ARG  25          HG2       ARG  25   4.925  -8.231  -9.964
  172   1HD   ARG  25          HD1       ARG  25   6.083  -5.593  -8.984
  173   2HD   ARG  25          HD2       ARG  25   6.808  -7.047  -8.390
  174    HE   ARG  25           HE       ARG  25   6.646  -6.134 -11.212
  175   1HH1  ARG  25          HH1       ARG  25   9.731  -7.574 -11.679
  176   2HH1  ARG  25          HH1       ARG  25   8.942  -6.099 -11.749
  177   1HH2  ARG  25          HH2       ARG  25   8.639  -9.373 -10.334
  178   2HH2  ARG  25          HH2       ARG  25   7.093  -8.963  -9.678
  179    H    GLY  26           HN       GLY  26   2.623  -5.272 -13.499
  180   1HA   GLY  26          HA1       GLY  26   0.493  -4.633 -14.305
  181   2HA   GLY  26          HA2       GLY  26  -0.234  -5.808 -13.209
  182    H    TYR  27           HN       TYR  27   1.997  -3.731 -11.746
  183    HA   TYR  27           HA       TYR  27  -0.095  -2.469 -10.181
  184   1HB   TYR  27          HB1       TYR  27   2.941  -2.168 -10.180
  185   2HB   TYR  27          HB2       TYR  27   1.920  -1.345  -9.041
  186    HD1  TYR  27           HD1      TYR  27  -0.038  -3.729  -8.471
  187    HD2  TYR  27           HD2      TYR  27   4.217  -3.479  -8.685
  188    HE1  TYR  27           HE1      TYR  27   0.162  -5.595  -6.938
  189    HE2  TYR  27           HE2      TYR  27   4.410  -5.345  -7.144
  190    HH   TYR  27           HH       TYR  27   2.373  -7.487  -6.530
  191    H    LYS  28           HN       LYS  28   0.174  -0.112  -9.699
  192    HA   LYS  28           HA       LYS  28  -0.083   1.312 -12.238
  193   1HB   LYS  28          HB1       LYS  28  -0.380   2.414  -9.398
  194   2HB   LYS  28          HB2       LYS  28  -1.034   3.107 -10.854
  195   1HG   LYS  28          HG1       LYS  28  -2.966   2.058 -10.223
  196   2HG   LYS  28          HG2       LYS  28  -2.254   0.668 -10.995
  197   1HD   LYS  28          HD1       LYS  28  -2.288  -0.504  -9.015
  198   2HD   LYS  28          HD2       LYS  28  -1.257   0.705  -8.262
  199   1HE   LYS  28          HE1       LYS  28  -3.192   2.118  -7.727
  200   2HE   LYS  28          HE2       LYS  28  -4.282   1.030  -8.558
  201   1HZ   LYS  28          HZ1       LYS  28  -2.914  -0.408  -6.407
  202   2HZ   LYS  28          HZ2       LYS  28  -3.548   1.035  -5.899
  203   3HZ   LYS  28          HZ3       LYS  28  -4.558  -0.071  -6.658
  204    H    GLY  29           HN       GLY  29   0.987   3.278 -12.618
  205   1HA   GLY  29          HA1       GLY  29   3.657   3.372 -12.769
  206   2HA   GLY  29          HA2       GLY  29   2.742   4.852 -12.487
  207    H    GLY  30           HN       GLY  30   4.962   2.659 -11.203
  208   1HA   GLY  30          HA1       GLY  30   4.630   3.458  -8.410
  209   2HA   GLY  30          HA2       GLY  30   5.892   2.395  -9.046
  210    H    HIS  31           HN       HIS  31   7.048   3.770  -7.465
  211    HA   HIS  31           HA       HIS  31   8.661   5.690  -8.925
  212   1HB   HIS  31          HB1       HIS  31   8.175   7.641  -7.314
  213   2HB   HIS  31          HB2       HIS  31   6.799   7.230  -8.329
  214    HD1  HIS  31           HD1      HIS  31   4.699   6.743  -7.001
  215    HD2  HIS  31           HD2      HIS  31   8.055   6.158  -4.584
  216    HE1  HIS  31           HE1      HIS  31   3.846   6.139  -4.789
  217    HE2  HIS  31           HE2      HIS  31   5.863   5.803  -3.371
  218    H    CYS  32           HN       CYS  32  10.239   6.779  -7.349
  219    HA   CYS  32           HA       CYS  32  11.249   4.639  -5.592
  220   1HB   CYS  32          HB1       CYS  32  12.489   7.198  -6.652
  221   2HB   CYS  32          HB2       CYS  32  13.295   6.117  -5.555
  222    H    GLY  33           HN       GLY  33  11.788   5.015  -3.462
  223   1HA   GLY  33          HA1       GLY  33  10.039   6.158  -1.772
  224   2HA   GLY  33          HA2       GLY  33  11.743   6.080  -1.395
  225    H    SER  34           HN       SER  34   9.558   8.057  -0.924
  226    HA   SER  34           HA       SER  34  10.395  10.475  -2.364
  227   1HB   SER  34          HB1       SER  34   7.964   9.899  -1.547
  228   2HB   SER  34          HB2       SER  34   8.529  10.333   0.071
  229    HG   SER  34           HG       SER  34   7.721  12.011  -1.765
  230    H    PHE  35           HN       PHE  35  10.533   9.297   0.980
  231    HA   PHE  35           HA       PHE  35  12.755  11.232   1.466
  232   1HB   PHE  35          HB1       PHE  35  10.522  11.588   2.754
  233   2HB   PHE  35          HB2       PHE  35  10.898  10.101   3.612
  234    HD1  PHE  35           HD1      PHE  35  12.530  13.329   2.626
  235    HD2  PHE  35           HD2      PHE  35  12.205  10.277   5.584
  236    HE1  PHE  35           HE1      PHE  35  14.035  14.586   4.094
  237    HE2  PHE  35           HE2      PHE  35  13.712  11.542   7.049
  238    HZ   PHE  35           HZ       PHE  35  14.633  13.696   6.307
  239    H    ALA  36           HN       ALA  36  13.049   8.650   0.325
  240    HA   ALA  36           HA       ALA  36  15.070   7.647   1.992
  241   1HB   ALA  36          HB1       ALA  36  12.588   5.932   1.537
  242   2HB   ALA  36          HB2       ALA  36  14.094   5.372   2.321
  243   3HB   ALA  36          HB3       ALA  36  13.094   6.628   3.108
  244    H    ASN  37           HN       ASN  37  15.277   8.631  -0.401
  245    HA   ASN  37           HA       ASN  37  14.930   7.152  -2.717
  246   1HB   ASN  37          HB1       ASN  37  17.056   8.408  -3.449
  247   2HB   ASN  37          HB2       ASN  37  15.794   9.442  -2.820
  248   1HD2  ASN  37          HD2       ASN  37  19.127   8.669  -2.437
  249   2HD2  ASN  37          HD2       ASN  37  19.348   9.460  -0.949
  250    H    VAL  38           HN       VAL  38  15.185   4.976  -2.281
  251    HA   VAL  38           HA       VAL  38  17.801   3.901  -2.687
  252    HB   VAL  38           HB       VAL  38  17.714   4.602  -0.186
  253   1HG1  VAL  38          HG1       VAL  38  15.531   3.659   0.414
  254   2HG1  VAL  38          HG1       VAL  38  16.162   2.014   0.087
  255   3HG1  VAL  38          HG1       VAL  38  16.846   2.992   1.419
  256   1HG2  VAL  38          HG2       VAL  38  18.623   1.864  -0.865
  257   2HG2  VAL  38          HG2       VAL  38  19.506   3.423  -0.981
  258   3HG2  VAL  38          HG2       VAL  38  19.050   2.772   0.615
  259    H    ASN  39           HN       ASN  39  14.564   3.360  -1.516
  260    HA   ASN  39           HA       ASN  39  14.466   0.828  -3.113
  261   1HB   ASN  39          HB1       ASN  39  13.233   1.450  -0.427
  262   2HB   ASN  39          HB2       ASN  39  12.363   0.379  -1.478
  263   1HD2  ASN  39          HD2       ASN  39  13.927  -0.062   1.126
  264   2HD2  ASN  39          HD2       ASN  39  14.983  -1.337   0.753
  265    H    CYS  40           HN       CYS  40  12.594   0.358  -4.258
  266    HA   CYS  40           HA       CYS  40  10.977   2.797  -4.863
  267   1HB   CYS  40          HB1       CYS  40  12.418   1.007  -6.577
  268   2HB   CYS  40          HB2       CYS  40  10.742   0.666  -6.846
  269    H    TRP  41           HN       TRP  41   8.798   2.502  -5.257
  270    HA   TRP  41           HA       TRP  41   7.527   0.031  -4.218
  271   1HB   TRP  41          HB1       TRP  41   6.731   2.799  -3.188
  272   2HB   TRP  41          HB2       TRP  41   6.118   1.253  -2.646
  273    HD1  TRP  41           HD1      TRP  41   9.556   3.201  -2.696
  274    HE1  TRP  41           HE1      TRP  41  10.802   2.356  -0.681
  275    HE3  TRP  41           HE3      TRP  41   6.314  -0.222  -1.061
  276    HZ2  TRP  41           HZ2      TRP  41  10.494   0.409   1.496
  277    HZ3  TRP  41           HZ3      TRP  41   6.725  -1.566   0.927
  278    HH2  TRP  41           HH2      TRP  41   8.818  -1.260   2.240
  279    H    CYS  42           HN       CYS  42   5.236  -0.125  -4.751
  280    HA   CYS  42           HA       CYS  42   4.760   1.389  -7.255
  281   1HB   CYS  42          HB1       CYS  42   3.390  -1.038  -6.083
  282   2HB   CYS  42          HB2       CYS  42   2.805  -0.202  -7.506
  283    H    GLU  43           HN       GLU  43   2.566   2.159  -7.604
  284    HA   GLU  43           HA       GLU  43   1.681   3.684  -5.235
  285   1HB   GLU  43          HB1       GLU  43   2.405   4.472  -7.786
  286   2HB   GLU  43          HB2       GLU  43   0.685   4.310  -7.998
  287   1HG   GLU  43          HG1       GLU  43   0.222   6.177  -6.713
  288   2HG   GLU  43          HG2       GLU  43   1.517   5.875  -5.571
  289    H    THR  44           HN       THR  44   0.982   1.309  -4.880
  290    HA   THR  44           HA       THR  44  -1.659   0.981  -6.056
  291    HB   THR  44           HB       THR  44  -0.271  -1.078  -5.969
  292    HG1  THR  44           HG1      THR  44  -2.520  -0.822  -4.299
  293   1HG2  THR  44          HG2       THR  44   0.774  -0.680  -3.685
  294   2HG2  THR  44          HG2       THR  44  -0.832  -0.986  -2.961
  295   3HG2  THR  44          HG2       THR  44  -0.032  -2.272  -3.902
  Start of MODEL    2
    1   1H    ASP   1          HT1       ASP   1   0.330   0.388  -0.563
    2   2H    ASP   1          HT2       ASP   1   1.579  -0.667  -0.014
    3   3H    ASP   1          HT3       ASP   1   1.739   1.010   0.132
    4    HA   ASP   1           HA       ASP   1   1.265   0.399  -2.563
    5   1HB   ASP   1          HB1       ASP   1   4.089   0.871  -2.075
    6   2HB   ASP   1          HB2       ASP   1   2.916   1.958  -2.786
    7    H    LYS   2           HN       LYS   2   2.549  -1.009  -3.938
    8    HA   LYS   2           HA       LYS   2   3.480  -3.457  -2.576
    9   1HB   LYS   2          HB1       LYS   2   1.966  -2.840  -5.031
   10   2HB   LYS   2          HB2       LYS   2   3.347  -3.806  -5.380
   11   1HG   LYS   2          HG1       LYS   2   1.291  -4.473  -3.189
   12   2HG   LYS   2          HG2       LYS   2   1.200  -5.129  -4.807
   13   1HD   LYS   2          HD1       LYS   2   3.547  -6.097  -4.502
   14   2HD   LYS   2          HD2       LYS   2   3.515  -5.612  -2.829
   15   1HE   LYS   2          HE1       LYS   2   1.434  -7.457  -4.104
   16   2HE   LYS   2          HE2       LYS   2   2.852  -8.044  -3.267
   17   1HZ   LYS   2          HZ1       LYS   2   0.387  -7.276  -2.140
   18   2HZ   LYS   2          HZ2       LYS   2   1.757  -7.857  -1.345
   19   3HZ   LYS   2          HZ3       LYS   2   1.569  -6.185  -1.582
   20    H    LEU   3           HN       LEU   3   5.511  -3.429  -2.202
   21    HA   LEU   3           HA       LEU   3   7.414  -1.751  -3.527
   22   1HB   LEU   3          HB1       LEU   3   7.468  -2.780  -1.143
   23   2HB   LEU   3          HB2       LEU   3   8.030  -4.258  -1.894
   24    HG   LEU   3           HG       LEU   3   9.548  -1.736  -2.599
   25   1HD1  LEU   3          HD1       LEU   3   9.095  -1.472  -0.236
   26   2HD1  LEU   3          HD1       LEU   3   9.757  -3.100   0.093
   27   3HD1  LEU   3          HD1       LEU   3  10.820  -1.803  -0.547
   28   1HD2  LEU   3          HD2       LEU   3  11.463  -3.177  -2.425
   29   2HD2  LEU   3          HD2       LEU   3  10.470  -4.486  -1.699
   30   3HD2  LEU   3          HD2       LEU   3  10.246  -4.034  -3.408
   31    H    ILE   4           HN       ILE   4   9.276  -2.531  -4.636
   32    HA   ILE   4           HA       ILE   4   8.825  -5.001  -6.245
   33    HB   ILE   4           HB       ILE   4   9.655  -3.684  -8.308
   34   1HG1  ILE   4          HG1       ILE   4   9.023  -1.224  -6.645
   35   2HG1  ILE   4          HG1       ILE   4  10.638  -1.762  -7.109
   36   1HG2  ILE   4          HG2       ILE   4   7.402  -2.788  -8.726
   37   2HG2  ILE   4          HG2       ILE   4   7.188  -4.239  -7.704
   38   3HG2  ILE   4          HG2       ILE   4   7.134  -2.631  -6.955
   39   1HD1  ILE   4          HD1       ILE   4   9.806  -0.103  -8.668
   40   2HD1  ILE   4          HD2       ILE   4  10.109  -1.682  -9.439
   41   3HD1  ILE   4          HD3       ILE   4   8.427  -1.142  -9.073
   42    H    GLY   5           HN       GLY   5  11.095  -2.480  -5.241
   43   1HA   GLY   5          HA1       GLY   5  13.105  -4.288  -4.472
   44   2HA   GLY   5          HA2       GLY   5  13.451  -3.817  -6.136
   45    H    SER   6           HN       SER   6  15.349  -2.654  -5.592
   46    HA   SER   6           HA       SER   6  14.999  -0.363  -3.797
   47   1HB   SER   6          HB1       SER   6  17.265  -2.134  -4.680
   48   2HB   SER   6          HB2       SER   6  17.643  -0.470  -4.339
   49    HG   SER   6           HG       SER   6  16.661  -0.692  -2.322
   50    H    CYS   7           HN       CYS   7  16.480   1.498  -4.579
   51    HA   CYS   7           HA       CYS   7  16.238   2.008  -7.485
   52   1HB   CYS   7          HB1       CYS   7  14.089   2.830  -6.605
   53   2HB   CYS   7          HB2       CYS   7  14.908   3.710  -5.330
   54    H    VAL   8           HN       VAL   8  18.515   1.483  -6.216
   55    HA   VAL   8           HA       VAL   8  19.923   4.051  -6.379
   56    HB   VAL   8           HB       VAL   8  19.849   2.252  -3.915
   57   1HG1  VAL   8          HG1       VAL   8  21.892   3.277  -3.056
   58   2HG1  VAL   8          HG1       VAL   8  22.209   2.277  -4.493
   59   3HG1  VAL   8          HG1       VAL   8  22.169   4.062  -4.642
   60   1HG2  VAL   8          HG2       VAL   8  18.582   4.422  -4.078
   61   2HG2  VAL   8          HG2       VAL   8  19.862   4.546  -2.832
   62   3HG2  VAL   8          HG2       VAL   8  20.117   5.252  -4.452
   63    H    TRP   9           HN       TRP   9  21.584   3.854  -7.572
   64    HA   TRP   9           HA       TRP   9  22.414   1.286  -8.673
   65   1HB   TRP   9          HB1       TRP   9  22.524   4.031  -9.522
   66   2HB   TRP   9          HB2       TRP   9  24.196   3.573  -9.316
   67    HD1  TRP   9           HD1      TRP   9  22.173   3.994 -12.080
   68    HE1  TRP   9           HE1      TRP   9  22.560   2.213 -13.812
   69    HE3  TRP   9           HE3      TRP   9  24.495   0.453  -9.306
   70    HZ2  TRP   9           HZ2      TRP   9  23.665  -0.415 -14.097
   71    HZ3  TRP   9           HZ3      TRP   9  25.204  -1.673 -10.305
   72    HH2  TRP   9           HH2      TRP   9  24.797  -2.117 -12.706
   73    H    GLY  10           HN       GLY  10  22.776   0.791  -6.271
   74   1HA   GLY  10          HA1       GLY  10  25.447   0.141  -5.788
   75   2HA   GLY  10          HA2       GLY  10  25.185   1.681  -4.979
   76    H    ALA  11           HN       ALA  11  22.858  -0.930  -5.405
   77    HA   ALA  11           HA       ALA  11  23.102  -1.821  -2.643
   78   1HB   ALA  11          HB1       ALA  11  20.594  -0.508  -3.747
   79   2HB   ALA  11          HB2       ALA  11  20.707  -1.326  -2.162
   80   3HB   ALA  11          HB3       ALA  11  21.657   0.158  -2.470
   81    H    VAL  12           HN       VAL  12  21.211  -3.420  -2.268
   82    HA   VAL  12           HA       VAL  12  21.412  -5.416  -4.388
   83    HB   VAL  12           HB       VAL  12  19.707  -5.664  -1.900
   84   1HG1  VAL  12          HG1       VAL  12  21.300  -7.712  -3.427
   85   2HG1  VAL  12          HG1       VAL  12  20.394  -8.002  -1.910
   86   3HG1  VAL  12          HG1       VAL  12  19.509  -7.538  -3.371
   87   1HG2  VAL  12          HG2       VAL  12  21.680  -6.546  -0.670
   88   2HG2  VAL  12          HG2       VAL  12  22.711  -6.107  -2.068
   89   3HG2  VAL  12          HG2       VAL  12  21.897  -4.833  -1.111
   90    H    ASN  13           HN       ASN  13  19.357  -6.600  -4.868
   91    HA   ASN  13           HA       ASN  13  17.458  -6.519  -6.270
   92   1HB   ASN  13          HB1       ASN  13  16.563  -4.941  -3.902
   93   2HB   ASN  13          HB2       ASN  13  15.466  -5.709  -5.041
   94   1HD2  ASN  13          HD2       ASN  13  15.305  -8.079  -4.954
   95   2HD2  ASN  13          HD2       ASN  13  15.961  -8.941  -3.643
   96    H    TYR  14           HN       TYR  14  19.454  -4.472  -6.604
   97    HA   TYR  14           HA       TYR  14  18.511  -1.884  -6.969
   98   1HB   TYR  14          HB1       TYR  14  20.874  -2.101  -7.354
   99   2HB   TYR  14          HB2       TYR  14  20.677  -3.562  -8.298
  100    HD1  TYR  14           HD1      TYR  14  20.108  -3.466 -10.702
  101    HD2  TYR  14           HD2      TYR  14  20.593   0.107  -8.452
  102    HE1  TYR  14           HE1      TYR  14  20.208  -2.171 -12.769
  103    HE2  TYR  14           HE2      TYR  14  20.689   1.397 -10.511
  104    HH   TYR  14           HH       TYR  14  21.015   1.200 -12.692
  105    H    THR  15           HN       THR  15  17.278  -0.850  -8.440
  106    HA   THR  15           HA       THR  15  16.234  -2.442 -10.735
  107    HB   THR  15           HB       THR  15  14.579  -1.967  -8.616
  108    HG1  THR  15           HG1      THR  15  13.407  -2.806 -10.245
  109   1HG2  THR  15          HG2       THR  15  13.144  -0.114  -9.103
  110   2HG2  THR  15          HG2       THR  15  14.774   0.616  -9.012
  111   3HG2  THR  15          HG2       THR  15  14.009   0.295 -10.603
  112    H    SER  16           HN       SER  16  15.037  -0.796 -12.131
  113    HA   SER  16           HA       SER  16  16.630   1.691 -12.555
  114   1HB   SER  16          HB1       SER  16  17.784  -0.101 -13.895
  115   2HB   SER  16          HB2       SER  16  16.270  -0.438 -14.747
  116    HG   SER  16           HG       SER  16  18.045   1.501 -15.211
  117    H    ASP  17           HN       ASP  17  14.140  -0.290 -14.071
  118    HA   ASP  17           HA       ASP  17  12.557   2.132 -14.685
  119   1HB   ASP  17          HB1       ASP  17  11.397   0.572 -16.279
  120   2HB   ASP  17          HB2       ASP  17  13.121   0.644 -16.593
  121    H    CYS  18           HN       CYS  18  12.217   2.116 -12.296
  122    HA   CYS  18           HA       CYS  18  10.843   0.283 -10.741
  123   1HB   CYS  18          HB1       CYS  18  11.621   2.709 -10.214
  124   2HB   CYS  18          HB2       CYS  18  10.134   3.276 -10.876
  125    H    ASN  19           HN       ASN  19   9.041   2.843 -12.358
  126    HA   ASN  19           HA       ASN  19   6.502   1.861 -12.373
  127   1HB   ASN  19          HB1       ASN  19   7.471   4.002 -13.371
  128   2HB   ASN  19          HB2       ASN  19   7.840   3.078 -14.804
  129   1HD2  ASN  19          HD2       ASN  19   6.282   2.950 -16.325
  130   2HD2  ASN  19          HD2       ASN  19   4.636   3.291 -16.062
  131    H    GLY  20           HN       GLY  20   9.142   0.866 -14.276
  132   1HA   GLY  20          HA1       GLY  20   7.747  -0.838 -16.149
  133   2HA   GLY  20          HA2       GLY  20   9.473  -0.888 -15.829
  134    H    GLU  21           HN       GLU  21   9.823  -1.700 -13.440
  135    HA   GLU  21           HA       GLU  21   9.104  -4.453 -13.402
  136   1HB   GLU  21          HB1       GLU  21  10.918  -2.926 -11.970
  137   2HB   GLU  21          HB2       GLU  21   9.711  -3.252 -10.740
  138   1HG   GLU  21          HG1       GLU  21   9.812  -5.742 -11.532
  139   2HG   GLU  21          HG2       GLU  21  11.215  -5.289 -12.433
  140    H    CYS  22           HN       CYS  22   7.533  -1.659 -12.114
  141    HA   CYS  22           HA       CYS  22   5.656  -3.135 -10.468
  142   1HB   CYS  22          HB1       CYS  22   5.978  -0.287 -11.357
  143   2HB   CYS  22          HB2       CYS  22   4.447  -0.756 -10.741
  144    H    LEU  23           HN       LEU  23   5.620  -1.603 -13.719
  145    HA   LEU  23           HA       LEU  23   2.930  -2.212 -14.295
  146   1HB   LEU  23          HB1       LEU  23   5.436  -1.578 -15.848
  147   2HB   LEU  23          HB2       LEU  23   4.039  -2.129 -16.694
  148    HG   LEU  23           HG       LEU  23   4.051   0.299 -14.808
  149   1HD1  LEU  23          HD1       LEU  23   5.474   0.623 -16.784
  150   2HD1  LEU  23          HD1       LEU  23   4.115   0.117 -17.836
  151   3HD1  LEU  23          HD1       LEU  23   3.994   1.627 -16.890
  152   1HD2  LEU  23          HD2       LEU  23   1.991  -0.589 -16.836
  153   2HD2  LEU  23          HD2       LEU  23   1.816  -0.667 -15.056
  154   3HD2  LEU  23          HD2       LEU  23   1.950   0.914 -15.857
  155    H    LEU  24           HN       LEU  24   5.905  -3.979 -14.378
  156    HA   LEU  24           HA       LEU  24   5.110  -6.186 -15.978
  157   1HB   LEU  24          HB1       LEU  24   7.322  -5.312 -14.318
  158   2HB   LEU  24          HB2       LEU  24   6.928  -6.920 -13.829
  159    HG   LEU  24           HG       LEU  24   7.299  -5.992 -16.686
  160   1HD1  LEU  24          HD1       LEU  24   9.557  -7.010 -16.589
  161   2HD1  LEU  24          HD1       LEU  24   9.375  -5.638 -15.462
  162   3HD1  LEU  24          HD1       LEU  24   9.327  -7.319 -14.842
  163   1HD2  LEU  24          HD2       LEU  24   6.082  -8.146 -16.396
  164   2HD2  LEU  24          HD2       LEU  24   7.682  -8.430 -17.137
  165   3HD2  LEU  24          HD2       LEU  24   7.432  -8.761 -15.396
  166    H    ARG  25           HN       ARG  25   4.695  -5.404 -12.734
  167    HA   ARG  25           HA       ARG  25   3.380  -7.932 -11.991
  168   1HB   ARG  25          HB1       ARG  25   4.343  -5.456 -10.556
  169   2HB   ARG  25          HB2       ARG  25   3.069  -6.373  -9.787
  170   1HG   ARG  25          HG1       ARG  25   4.459  -8.263  -9.383
  171   2HG   ARG  25          HG2       ARG  25   5.425  -7.989 -10.810
  172   1HD   ARG  25          HD1       ARG  25   5.670  -5.920  -8.652
  173   2HD   ARG  25          HD2       ARG  25   6.490  -7.406  -8.284
  174    HE   ARG  25           HE       ARG  25   6.927  -6.035 -10.864
  175   1HH1  ARG  25          HH1       ARG  25  10.106  -7.627 -10.130
  176   2HH1  ARG  25          HH1       ARG  25   8.692  -8.237 -10.950
  177   1HH2  ARG  25          HH2       ARG  25   9.982  -5.901  -8.778
  178   2HH2  ARG  25          HH2       ARG  25   8.462  -5.100  -8.515
  179    H    GLY  26           HN       GLY  26   2.404  -5.307 -13.621
  180   1HA   GLY  26          HA1       GLY  26   0.238  -4.843 -14.446
  181   2HA   GLY  26          HA2       GLY  26  -0.425  -5.997 -13.292
  182    H    TYR  27           HN       TYR  27   1.757  -3.795 -11.947
  183    HA   TYR  27           HA       TYR  27  -0.406  -2.570 -10.415
  184   1HB   TYR  27          HB1       TYR  27   2.598  -2.069 -10.496
  185   2HB   TYR  27          HB2       TYR  27   1.536  -1.303  -9.344
  186    HD1  TYR  27           HD1      TYR  27   3.921  -3.182  -8.852
  187    HD2  TYR  27           HD2      TYR  27  -0.270  -3.913  -8.917
  188    HE1  TYR  27           HE1      TYR  27   4.212  -5.035  -7.312
  189    HE2  TYR  27           HE2      TYR  27   0.015  -5.761  -7.406
  190    HH   TYR  27           HH       TYR  27   1.944  -7.367  -6.813
  191    H    LYS  28           HN       LYS  28  -0.964  -0.488 -10.325
  192    HA   LYS  28           HA       LYS  28  -1.435   0.874 -12.700
  193   1HB   LYS  28          HB1       LYS  28  -1.069   2.147  -9.929
  194   2HB   LYS  28          HB2       LYS  28  -1.959   2.834 -11.266
  195   1HG   LYS  28          HG1       LYS  28  -3.812   1.756 -10.537
  196   2HG   LYS  28          HG2       LYS  28  -3.104   0.257 -11.062
  197   1HD   LYS  28          HD1       LYS  28  -3.405  -0.354  -8.804
  198   2HD   LYS  28          HD2       LYS  28  -1.844   0.397  -8.657
  199   1HE   LYS  28          HE1       LYS  28  -3.397   1.264  -6.931
  200   2HE   LYS  28          HE2       LYS  28  -2.848   2.563  -7.993
  201   1HZ   LYS  28          HZ1       LYS  28  -5.406   1.712  -7.467
  202   2HZ   LYS  28          HZ2       LYS  28  -4.921   2.941  -8.536
  203   3HZ   LYS  28          HZ3       LYS  28  -5.127   1.347  -9.100
  204    H    GLY  29           HN       GLY  29   1.248   1.214 -10.474
  205   1HA   GLY  29          HA1       GLY  29   3.148   1.900 -12.442
  206   2HA   GLY  29          HA2       GLY  29   2.540   3.399 -11.742
  207    H    GLY  30           HN       GLY  30   4.900   3.479 -11.154
  208   1HA   GLY  30          HA1       GLY  30   5.161   2.855  -8.360
  209   2HA   GLY  30          HA2       GLY  30   6.275   1.907  -9.362
  210    H    HIS  31           HN       HIS  31   7.111   3.654  -7.416
  211    HA   HIS  31           HA       HIS  31   8.748   5.469  -9.002
  212   1HB   HIS  31          HB1       HIS  31   8.046   7.540  -7.974
  213   2HB   HIS  31          HB2       HIS  31   6.588   6.754  -8.507
  214    HD1  HIS  31           HD1      HIS  31   5.138   7.908  -6.830
  215    HD2  HIS  31           HD2      HIS  31   8.118   5.844  -4.817
  216    HE1  HIS  31           HE1      HIS  31   4.521   7.953  -4.429
  217    HE2  HIS  31           HE2      HIS  31   6.349   6.688  -3.282
  218    H    CYS  32           HN       CYS  32  10.323   6.634  -7.559
  219    HA   CYS  32           HA       CYS  32  11.335   4.679  -5.633
  220   1HB   CYS  32          HB1       CYS  32  12.442   7.312  -6.668
  221   2HB   CYS  32          HB2       CYS  32  13.288   6.190  -5.622
  222    H    GLY  33           HN       GLY  33  11.749   5.175  -3.479
  223   1HA   GLY  33          HA1       GLY  33   9.898   6.117  -1.839
  224   2HA   GLY  33          HA2       GLY  33  11.552   6.466  -1.465
  225    H    SER  34           HN       SER  34  12.416   8.496  -2.184
  226    HA   SER  34           HA       SER  34  10.466  10.552  -3.004
  227   1HB   SER  34          HB1       SER  34  10.520  10.412  -0.405
  228   2HB   SER  34          HB2       SER  34  12.193  10.967  -0.486
  229    HG   SER  34           HG       SER  34  10.802  12.553  -2.096
  230    H    PHE  35           HN       PHE  35  13.824  10.020  -1.941
  231    HA   PHE  35           HA       PHE  35  14.942  10.861  -4.432
  232   1HB   PHE  35          HB1       PHE  35  14.117  13.027  -3.154
  233   2HB   PHE  35          HB2       PHE  35  15.500  12.753  -2.121
  234    HD1  PHE  35           HD1      PHE  35  17.840  12.345  -3.412
  235    HD2  PHE  35           HD2      PHE  35  14.444  14.294  -5.114
  236    HE1  PHE  35           HE1      PHE  35  19.277  13.402  -5.081
  237    HE2  PHE  35           HE2      PHE  35  15.897  15.351  -6.779
  238    HZ   PHE  35           HZ       PHE  35  18.317  14.908  -6.771
  239    H    ALA  36           HN       ALA  36  15.800   8.851  -4.030
  240    HA   ALA  36           HA       ALA  36  17.704   7.579  -3.744
  241   1HB   ALA  36          HB1       ALA  36  19.603   8.326  -2.458
  242   2HB   ALA  36          HB2       ALA  36  19.080   9.656  -3.540
  243   3HB   ALA  36          HB3       ALA  36  18.703   9.696  -1.783
  244    H    ASN  37           HN       ASN  37  15.330   7.441  -2.357
  245    HA   ASN  37           HA       ASN  37  15.565   6.955   0.427
  246   1HB   ASN  37          HB1       ASN  37  13.417   7.261  -0.715
  247   2HB   ASN  37          HB2       ASN  37  13.662   5.796  -1.662
  248   1HD2  ASN  37          HD2       ASN  37  12.225   4.217  -0.884
  249   2HD2  ASN  37          HD2       ASN  37  11.887   4.019   0.783
  250    H    VAL  38           HN       VAL  38  16.244   5.091  -2.356
  251    HA   VAL  38           HA       VAL  38  17.665   3.242  -2.646
  252    HB   VAL  38           HB       VAL  38  18.422   3.873  -0.031
  253   1HG1  VAL  38          HG1       VAL  38  17.444   1.010   0.196
  254   2HG1  VAL  38          HG1       VAL  38  18.400   1.944   1.390
  255   3HG1  VAL  38          HG1       VAL  38  16.715   2.402   1.043
  256   1HG2  VAL  38          HG2       VAL  38  20.064   2.068  -0.164
  257   2HG2  VAL  38          HG2       VAL  38  19.143   1.356  -1.526
  258   3HG2  VAL  38          HG2       VAL  38  19.917   2.966  -1.688
  259    H    ASN  39           HN       ASN  39  14.598   3.505  -1.878
  260    HA   ASN  39           HA       ASN  39  14.052   0.665  -2.389
  261   1HB   ASN  39          HB1       ASN  39  12.905   2.260  -0.079
  262   2HB   ASN  39          HB2       ASN  39  12.116   0.873  -0.789
  263   1HD2  ASN  39          HD2       ASN  39  12.938  -1.228  -0.151
  264   2HD2  ASN  39          HD2       ASN  39  14.326  -1.398   0.810
  265    H    CYS  40           HN       CYS  40  12.522   0.415  -3.896
  266    HA   CYS  40           HA       CYS  40  10.977   2.829  -4.730
  267   1HB   CYS  40          HB1       CYS  40  12.582   1.026  -6.294
  268   2HB   CYS  40          HB2       CYS  40  10.930   0.621  -6.647
  269    H    TRP  41           HN       TRP  41   8.862   2.707  -4.781
  270    HA   TRP  41           HA       TRP  41   7.544   0.154  -3.984
  271   1HB   TRP  41          HB1       TRP  41   6.791   2.955  -3.067
  272   2HB   TRP  41          HB2       TRP  41   5.930   1.490  -2.683
  273    HD1  TRP  41           HD1      TRP  41   9.574   2.902  -2.212
  274    HE1  TRP  41           HE1      TRP  41  10.292   2.060   0.044
  275    HE3  TRP  41           HE3      TRP  41   5.590   0.122  -0.931
  276    HZ2  TRP  41           HZ2      TRP  41   9.370   0.407   2.224
  277    HZ3  TRP  41           HZ3      TRP  41   5.485  -1.077   1.182
  278    HH2  TRP  41           HH2      TRP  41   7.382  -0.952   2.788
  279    H    CYS  42           HN       CYS  42   5.317  -0.045  -4.746
  280    HA   CYS  42           HA       CYS  42   5.134   1.226  -7.371
  281   1HB   CYS  42          HB1       CYS  42   3.379  -0.836  -6.046
  282   2HB   CYS  42          HB2       CYS  42   3.073  -0.160  -7.632
  283    H    GLU  43           HN       GLU  43   3.143   2.288  -7.999
  284    HA   GLU  43           HA       GLU  43   2.196   4.086  -5.849
  285   1HB   GLU  43          HB1       GLU  43   2.326   4.373  -8.876
  286   2HB   GLU  43          HB2       GLU  43   1.516   5.528  -7.831
  287   1HG   GLU  43          HG1       GLU  43   3.584   5.828  -6.504
  288   2HG   GLU  43          HG2       GLU  43   4.437   4.652  -7.490
  289    H    THR  44           HN       THR  44   1.146   1.905  -5.444
  290    HA   THR  44           HA       THR  44  -1.422   1.822  -6.841
  291    HB   THR  44           HB       THR  44  -0.104  -0.302  -6.645
  292    HG1  THR  44           HG1      THR  44  -1.923  -1.348  -6.482
  293   1HG2  THR  44          HG2       THR  44   0.757  -0.007  -4.388
  294   2HG2  THR  44          HG2       THR  44  -0.896  -0.196  -3.724
  295   3HG2  THR  44          HG2       THR  44  -0.103  -1.564  -4.570
  Start of MODEL    3
    1   1H    ASP   1          HT1       ASP   1   0.219   0.943  -0.562
    2   2H    ASP   1          HT2       ASP   1   1.110  -0.359   0.147
    3   3H    ASP   1          HT3       ASP   1   1.560   1.290   0.373
    4    HA   ASP   1           HA       ASP   1   1.448   0.862  -2.330
    5   1HB   ASP   1          HB1       ASP   1   3.869   1.206  -0.492
    6   2HB   ASP   1          HB2       ASP   1   3.769   1.566  -2.206
    7    H    LYS   2           HN       LYS   2   2.814  -0.420  -3.573
    8    HA   LYS   2           HA       LYS   2   3.284  -3.143  -2.480
    9   1HB   LYS   2          HB1       LYS   2   1.814  -2.062  -4.785
   10   2HB   LYS   2          HB2       LYS   2   2.998  -3.216  -5.244
   11   1HG   LYS   2          HG1       LYS   2   0.616  -4.132  -4.712
   12   2HG   LYS   2          HG2       LYS   2   1.868  -4.942  -3.791
   13   1HD   LYS   2          HD1       LYS   2   1.328  -3.761  -1.788
   14   2HD   LYS   2          HD2       LYS   2   0.472  -2.495  -2.660
   15   1HE   LYS   2          HE1       LYS   2  -1.370  -4.077  -3.183
   16   2HE   LYS   2          HE2       LYS   2  -0.482  -5.398  -2.439
   17   1HZ   LYS   2          HZ1       LYS   2  -2.157  -3.505  -1.192
   18   2HZ   LYS   2          HZ2       LYS   2  -1.357  -4.827  -0.506
   19   3HZ   LYS   2          HZ3       LYS   2  -0.579  -3.332  -0.557
   20    H    LEU   3           HN       LEU   3   5.318  -3.148  -2.012
   21    HA   LEU   3           HA       LEU   3   7.400  -1.750  -3.295
   22   1HB   LEU   3          HB1       LEU   3   7.456  -3.024  -1.033
   23   2HB   LEU   3          HB2       LEU   3   7.743  -4.480  -1.969
   24    HG   LEU   3           HG       LEU   3   9.554  -2.166  -2.672
   25   1HD1  LEU   3          HD1       LEU   3   9.839  -3.599  -0.023
   26   2HD1  LEU   3          HD1       LEU   3  10.988  -2.437  -0.771
   27   3HD1  LEU   3          HD1       LEU   3   9.360  -1.899  -0.294
   28   1HD2  LEU   3          HD2       LEU   3  11.257  -3.842  -2.669
   29   2HD2  LEU   3          HD2       LEU   3  10.157  -5.038  -1.906
   30   3HD2  LEU   3          HD2       LEU   3   9.862  -4.506  -3.573
   31    H    ILE   4           HN       ILE   4   9.108  -2.639  -4.532
   32    HA   ILE   4           HA       ILE   4   8.349  -4.782  -6.415
   33    HB   ILE   4           HB       ILE   4   9.469  -3.138  -8.152
   34   1HG1  ILE   4          HG1       ILE   4   8.430  -1.143  -6.130
   35   2HG1  ILE   4          HG1       ILE   4  10.119  -1.492  -6.457
   36   1HG2  ILE   4          HG2       ILE   4   7.167  -3.966  -8.115
   37   2HG2  ILE   4          HG2       ILE   4   6.692  -2.679  -6.962
   38   3HG2  ILE   4          HG2       ILE   4   7.182  -2.275  -8.646
   39   1HD1  ILE   4          HD1       ILE   4   8.058  -0.539  -8.493
   40   2HD1  ILE   4          HD2       ILE   4   9.288   0.457  -7.713
   41   3HD1  ILE   4          HD3       ILE   4   9.796  -0.871  -8.813
   42    H    GLY   5           HN       GLY   5  10.925  -2.684  -5.274
   43   1HA   GLY   5          HA1       GLY   5  12.741  -4.714  -4.663
   44   2HA   GLY   5          HA2       GLY   5  13.060  -4.218  -6.332
   45    H    SER   6           HN       SER   6  15.063  -3.320  -5.852
   46    HA   SER   6           HA       SER   6  15.045  -1.007  -3.994
   47   1HB   SER   6          HB1       SER   6  17.067  -3.044  -4.588
   48   2HB   SER   6          HB2       SER   6  17.703  -1.494  -5.051
   49    HG   SER   6           HG       SER   6  16.353  -1.385  -2.610
   50    H    CYS   7           HN       CYS   7  16.052   0.911  -4.643
   51    HA   CYS   7           HA       CYS   7  16.022   1.434  -7.589
   52   1HB   CYS   7          HB1       CYS   7  14.004   2.400  -6.448
   53   2HB   CYS   7          HB2       CYS   7  15.060   3.209  -5.324
   54    H    VAL   8           HN       VAL   8  18.255   0.613  -6.385
   55    HA   VAL   8           HA       VAL   8  19.874   3.118  -6.156
   56    HB   VAL   8           HB       VAL   8  20.313   0.478  -4.692
   57   1HG1  VAL   8          HG1       VAL   8  22.076   1.673  -3.469
   58   2HG1  VAL   8          HG1       VAL   8  22.430   1.608  -5.217
   59   3HG1  VAL   8          HG1       VAL   8  21.791   3.113  -4.491
   60   1HG2  VAL   8          HG2       VAL   8  18.455   1.663  -3.766
   61   2HG2  VAL   8          HG2       VAL   8  19.840   1.721  -2.644
   62   3HG2  VAL   8          HG2       VAL   8  19.434   3.158  -3.633
   63    H    TRP   9           HN       TRP   9  21.146   3.307  -7.808
   64    HA   TRP   9           HA       TRP   9  21.671   1.149  -9.669
   65   1HB   TRP   9          HB1       TRP   9  21.776   4.018  -9.774
   66   2HB   TRP   9          HB2       TRP   9  23.435   3.521  -9.973
   67    HD1  TRP   9           HD1      TRP   9  21.148   4.741 -12.149
   68    HE1  TRP   9           HE1      TRP   9  21.112   3.506 -14.336
   69    HE3  TRP   9           HE3      TRP   9  23.458   0.402 -10.880
   70    HZ2  TRP   9           HZ2      TRP   9  21.900   1.037 -15.520
   71    HZ3  TRP   9           HZ3      TRP   9  23.804  -1.371 -12.540
   72    HH2  TRP   9           HH2      TRP   9  23.032  -1.063 -14.871
   73    H    GLY  10           HN       GLY  10  22.785  -0.396  -8.651
   74   1HA   GLY  10          HA1       GLY  10  25.299  -1.014  -8.584
   75   2HA   GLY  10          HA2       GLY  10  25.417   0.275  -7.389
   76    H    ALA  11           HN       ALA  11  22.498  -0.809  -6.733
   77    HA   ALA  11           HA       ALA  11  23.500  -2.654  -4.647
   78   1HB   ALA  11          HB1       ALA  11  22.061  -0.725  -3.997
   79   2HB   ALA  11          HB2       ALA  11  20.776  -1.409  -5.058
   80   3HB   ALA  11          HB3       ALA  11  21.293  -2.289  -3.600
   81    H    VAL  12           HN       VAL  12  21.745  -4.329  -4.098
   82    HA   VAL  12           HA       VAL  12  21.473  -6.042  -6.445
   83    HB   VAL  12           HB       VAL  12  20.331  -6.669  -3.723
   84   1HG1  VAL  12          HG1       VAL  12  21.081  -8.944  -4.148
   85   2HG1  VAL  12          HG1       VAL  12  19.919  -8.356  -5.350
   86   3HG1  VAL  12          HG1       VAL  12  21.669  -8.428  -5.759
   87   1HG2  VAL  12          HG2       VAL  12  22.520  -7.580  -2.987
   88   2HG2  VAL  12          HG2       VAL  12  23.265  -6.875  -4.457
   89   3HG2  VAL  12          HG2       VAL  12  22.566  -5.813  -3.196
   90    H    ASN  13           HN       ASN  13  19.420  -7.203  -6.672
   91    HA   ASN  13           HA       ASN  13  17.220  -7.024  -7.576
   92   1HB   ASN  13          HB1       ASN  13  16.503  -5.702  -5.008
   93   2HB   ASN  13          HB2       ASN  13  15.567  -6.877  -5.895
   94   1HD2  ASN  13          HD2       ASN  13  16.245  -9.213  -5.648
   95   2HD2  ASN  13          HD2       ASN  13  17.253  -9.645  -4.348
   96    H    TYR  14           HN       TYR  14  19.049  -4.815  -7.973
   97    HA   TYR  14           HA       TYR  14  17.912  -2.285  -7.642
   98   1HB   TYR  14          HB1       TYR  14  20.213  -2.516  -8.406
   99   2HB   TYR  14          HB2       TYR  14  19.723  -3.482  -9.791
  100    HD1  TYR  14           HD1      TYR  14  18.639  -0.119  -8.459
  101    HD2  TYR  14           HD2      TYR  14  20.098  -2.364 -11.764
  102    HE1  TYR  14           HE1      TYR  14  18.543   1.888  -9.872
  103    HE2  TYR  14           HE2      TYR  14  20.004  -0.370 -13.161
  104    HH   TYR  14           HH       TYR  14  20.136   2.260 -12.530
  105    H    THR  15           HN       THR  15  16.442  -1.076  -8.737
  106    HA   THR  15           HA       THR  15  14.586  -2.557 -10.432
  107    HB   THR  15           HB       THR  15  14.531   0.097  -8.956
  108    HG1  THR  15           HG1      THR  15  14.025  -1.615  -7.744
  109   1HG2  THR  15          HG2       THR  15  13.194   0.363 -11.079
  110   2HG2  THR  15          HG2       THR  15  12.286  -1.106 -10.609
  111   3HG2  THR  15          HG2       THR  15  12.247   0.347  -9.561
  112    H    SER  16           HN       SER  16  15.759   0.791 -10.756
  113    HA   SER  16           HA       SER  16  16.876   1.793 -12.558
  114   1HB   SER  16          HB1       SER  16  17.474  -0.818 -13.344
  115   2HB   SER  16          HB2       SER  16  16.267  -0.414 -14.567
  116    HG   SER  16           HG       SER  16  18.376   1.311 -13.807
  117    H    ASP  17           HN       ASP  17  13.995  -0.090 -13.045
  118    HA   ASP  17           HA       ASP  17  12.704   2.272 -14.284
  119   1HB   ASP  17          HB1       ASP  17  11.644   0.710 -15.952
  120   2HB   ASP  17          HB2       ASP  17  13.385   0.875 -16.087
  121    H    CYS  18           HN       CYS  18  12.039   2.351 -11.974
  122    HA   CYS  18           HA       CYS  18  10.509   0.529 -10.558
  123   1HB   CYS  18          HB1       CYS  18  11.284   3.143 -10.366
  124   2HB   CYS  18          HB2       CYS  18   9.605   3.382 -10.661
  125    H    ASN  19           HN       ASN  19   8.878   3.055 -12.453
  126    HA   ASN  19           HA       ASN  19   6.387   2.011 -12.678
  127   1HB   ASN  19          HB1       ASN  19   7.424   4.093 -13.928
  128   2HB   ASN  19          HB2       ASN  19   7.727   2.965 -15.230
  129   1HD2  ASN  19          HD2       ASN  19   5.679   1.438 -15.673
  130   2HD2  ASN  19          HD2       ASN  19   4.207   2.273 -15.754
  131    H    GLY  20           HN       GLY  20   9.235   0.923 -14.251
  132   1HA   GLY  20          HA1       GLY  20   7.994  -0.939 -16.097
  133   2HA   GLY  20          HA2       GLY  20   9.694  -0.918 -15.648
  134    H    GLU  21           HN       GLU  21   9.880  -1.510 -13.200
  135    HA   GLU  21           HA       GLU  21   9.305  -4.250 -12.889
  136   1HB   GLU  21          HB1       GLU  21  11.000  -2.905 -11.632
  137   2HB   GLU  21          HB2       GLU  21   9.719  -2.198 -10.703
  138   1HG   GLU  21          HG1       GLU  21  10.751  -4.150  -9.439
  139   2HG   GLU  21          HG2       GLU  21   9.022  -4.289  -9.720
  140    H    CYS  22           HN       CYS  22   7.569  -1.495 -12.001
  141    HA   CYS  22           HA       CYS  22   5.565  -2.829 -10.367
  142   1HB   CYS  22          HB1       CYS  22   5.915  -0.085 -11.492
  143   2HB   CYS  22          HB2       CYS  22   4.329  -0.558 -11.024
  144    H    LEU  23           HN       LEU  23   5.708  -1.573 -13.740
  145    HA   LEU  23           HA       LEU  23   3.114  -2.369 -14.465
  146   1HB   LEU  23          HB1       LEU  23   5.707  -1.747 -15.846
  147   2HB   LEU  23          HB2       LEU  23   4.486  -2.523 -16.771
  148    HG   LEU  23           HG       LEU  23   4.093   0.108 -15.290
  149   1HD1  LEU  23          HD1       LEU  23   4.230   1.108 -17.577
  150   2HD1  LEU  23          HD1       LEU  23   5.730   0.214 -17.176
  151   3HD1  LEU  23          HD1       LEU  23   4.507  -0.529 -18.243
  152   1HD2  LEU  23          HD2       LEU  23   2.400  -1.290 -17.379
  153   2HD2  LEU  23          HD2       LEU  23   1.988  -1.099 -15.649
  154   3HD2  LEU  23          HD2       LEU  23   2.084   0.338 -16.697
  155    H    LEU  24           HN       LEU  24   6.182  -3.987 -14.212
  156    HA   LEU  24           HA       LEU  24   5.599  -6.308 -15.716
  157   1HB   LEU  24          HB1       LEU  24   7.649  -5.262 -13.944
  158   2HB   LEU  24          HB2       LEU  24   7.297  -6.865 -13.439
  159    HG   LEU  24           HG       LEU  24   7.954  -5.937 -16.266
  160   1HD1  LEU  24          HD1       LEU  24  10.168  -6.999 -15.899
  161   2HD1  LEU  24          HD1       LEU  24   9.860  -5.668 -14.743
  162   3HD1  LEU  24          HD1       LEU  24   9.692  -7.363 -14.211
  163   1HD2  LEU  24          HD2       LEU  24   8.345  -8.347 -16.756
  164   2HD2  LEU  24          HD2       LEU  24   7.851  -8.744 -15.081
  165   3HD2  LEU  24          HD2       LEU  24   6.666  -8.050 -16.229
  166    H    ARG  25           HN       ARG  25   4.891  -5.348 -12.616
  167    HA   ARG  25           HA       ARG  25   3.628  -7.887 -11.772
  168   1HB   ARG  25          HB1       ARG  25   4.148  -5.241 -10.354
  169   2HB   ARG  25          HB2       ARG  25   3.432  -6.626  -9.547
  170   1HG   ARG  25          HG1       ARG  25   5.496  -7.877  -9.885
  171   2HG   ARG  25          HG2       ARG  25   6.147  -6.609 -10.916
  172   1HD   ARG  25          HD1       ARG  25   5.833  -4.992  -9.030
  173   2HD   ARG  25          HD2       ARG  25   5.399  -6.321  -7.961
  174    HE   ARG  25           HE       ARG  25   8.011  -6.063  -9.398
  175   1HH1  ARG  25          HH1       ARG  25   9.383  -8.130  -6.968
  176   2HH1  ARG  25          HH1       ARG  25   9.366  -7.645  -8.630
  177   1HH2  ARG  25          HH2       ARG  25   7.623  -7.113  -5.572
  178   2HH2  ARG  25          HH2       ARG  25   6.569  -6.009  -6.360
  179    H    GLY  26           HN       GLY  26   2.708  -5.246 -13.474
  180   1HA   GLY  26          HA1       GLY  26   0.563  -4.750 -14.356
  181   2HA   GLY  26          HA2       GLY  26  -0.136  -5.913 -13.228
  182    H    TYR  27           HN       TYR  27   2.019  -3.767 -11.774
  183    HA   TYR  27           HA       TYR  27  -0.214  -2.463 -10.380
  184   1HB   TYR  27          HB1       TYR  27   2.832  -2.509 -10.083
  185   2HB   TYR  27          HB2       TYR  27   1.867  -1.433  -9.104
  186    HD1  TYR  27           HD1      TYR  27   3.463  -3.380  -7.696
  187    HD2  TYR  27           HD2      TYR  27  -0.441  -4.005  -9.327
  188    HE1  TYR  27           HE1      TYR  27   3.016  -5.175  -6.086
  189    HE2  TYR  27           HE2      TYR  27  -0.839  -5.740  -7.737
  190    HH   TYR  27           HH       TYR  27   0.722  -7.394  -6.338
  191    H    LYS  28           HN       LYS  28  -0.255  -0.211  -9.987
  192    HA   LYS  28           HA       LYS  28  -0.227   1.156 -12.554
  193   1HB   LYS  28          HB1       LYS  28  -0.989   2.154  -9.760
  194   2HB   LYS  28          HB2       LYS  28  -1.297   3.029 -11.236
  195   1HG   LYS  28          HG1       LYS  28  -3.277   1.904 -11.475
  196   2HG   LYS  28          HG2       LYS  28  -2.374   0.447 -11.775
  197   1HD   LYS  28          HD1       LYS  28  -3.708  -0.228  -9.981
  198   2HD   LYS  28          HD2       LYS  28  -2.255   0.258  -9.138
  199   1HE   LYS  28          HE1       LYS  28  -3.283   2.537  -8.704
  200   2HE   LYS  28          HE2       LYS  28  -4.739   1.999  -9.519
  201   1HZ   LYS  28          HZ1       LYS  28  -4.055   1.641  -6.859
  202   2HZ   LYS  28          HZ2       LYS  28  -5.422   1.070  -7.638
  203   3HZ   LYS  28          HZ3       LYS  28  -4.010   0.119  -7.437
  204    H    GLY  29           HN       GLY  29   0.616   3.299 -12.752
  205   1HA   GLY  29          HA1       GLY  29   3.282   3.612 -12.844
  206   2HA   GLY  29          HA2       GLY  29   2.255   4.984 -12.443
  207    H    GLY  30           HN       GLY  30   4.662   2.876 -11.307
  208   1HA   GLY  30          HA1       GLY  30   4.177   3.575  -8.472
  209   2HA   GLY  30          HA2       GLY  30   5.409   2.453  -9.078
  210    H    HIS  31           HN       HIS  31   6.760   3.704  -7.526
  211    HA   HIS  31           HA       HIS  31   8.318   5.614  -8.998
  212   1HB   HIS  31          HB1       HIS  31   7.999   7.580  -7.688
  213   2HB   HIS  31          HB2       HIS  31   6.417   7.075  -8.136
  214    HD1  HIS  31           HD1      HIS  31   5.120   7.957  -6.188
  215    HD2  HIS  31           HD2      HIS  31   8.375   5.836  -4.777
  216    HE1  HIS  31           HE1      HIS  31   4.886   7.905  -3.729
  217    HE2  HIS  31           HE2      HIS  31   6.902   6.605  -2.942
  218    H    CYS  32           HN       CYS  32  10.033   6.554  -7.476
  219    HA   CYS  32           HA       CYS  32  11.061   4.294  -5.877
  220   1HB   CYS  32          HB1       CYS  32  12.385   6.744  -7.058
  221   2HB   CYS  32          HB2       CYS  32  13.186   5.736  -5.891
  222    H    GLY  33           HN       GLY  33  11.723   4.567  -3.809
  223   1HA   GLY  33          HA1       GLY  33  11.003   5.311  -1.624
  224   2HA   GLY  33          HA2       GLY  33  12.189   6.509  -2.145
  225    H    SER  34           HN       SER  34  11.590   8.430  -1.643
  226    HA   SER  34           HA       SER  34   9.087   9.510  -2.657
  227   1HB   SER  34          HB1       SER  34   8.441   8.348  -0.437
  228   2HB   SER  34          HB2       SER  34   9.452   9.540   0.401
  229    HG   SER  34           HG       SER  34   7.749  10.817   0.158
  230    H    PHE  35           HN       PHE  35  11.843   9.999  -0.452
  231    HA   PHE  35           HA       PHE  35  12.851  12.215  -1.876
  232   1HB   PHE  35          HB1       PHE  35  10.727  13.072  -0.572
  233   2HB   PHE  35          HB2       PHE  35  11.709  12.923   0.862
  234    HD1  PHE  35           HD1      PHE  35  11.597  14.575  -2.470
  235    HD2  PHE  35           HD2      PHE  35  13.352  14.587   1.412
  236    HE1  PHE  35           HE1      PHE  35  12.650  16.742  -2.954
  237    HE2  PHE  35           HE2      PHE  35  14.403  16.751   0.928
  238    HZ   PHE  35           HZ       PHE  35  14.056  17.834  -1.255
  239    H    ALA  36           HN       ALA  36  14.571  10.920  -1.701
  240    HA   ALA  36           HA       ALA  36  16.765  10.617  -0.946
  241   1HB   ALA  36          HB1       ALA  36  17.487  11.250   1.258
  242   2HB   ALA  36          HB2       ALA  36  16.569  12.611   0.540
  243   3HB   ALA  36          HB3       ALA  36  15.828  11.565   1.798
  244    H    ASN  37           HN       ASN  37  15.204   8.623  -1.283
  245    HA   ASN  37           HA       ASN  37  15.356   6.938   1.099
  246   1HB   ASN  37          HB1       ASN  37  13.089   7.223  -0.166
  247   2HB   ASN  37          HB2       ASN  37  13.912   6.316  -1.454
  248   1HD2  ASN  37          HD2       ASN  37  13.432   5.860   2.155
  249   2HD2  ASN  37          HD2       ASN  37  13.105   4.203   1.959
  250    H    VAL  38           HN       VAL  38  15.192   4.481  -0.532
  251    HA   VAL  38           HA       VAL  38  17.447   4.363  -2.280
  252    HB   VAL  38           HB       VAL  38  18.672   2.683  -0.799
  253   1HG1  VAL  38          HG1       VAL  38  19.535   5.009  -0.928
  254   2HG1  VAL  38          HG1       VAL  38  18.553   5.430   0.511
  255   3HG1  VAL  38          HG1       VAL  38  19.856   4.230   0.652
  256   1HG2  VAL  38          HG2       VAL  38  18.299   2.751   1.627
  257   2HG2  VAL  38          HG2       VAL  38  16.905   3.837   1.370
  258   3HG2  VAL  38          HG2       VAL  38  16.876   2.162   0.728
  259    H    ASN  39           HN       ASN  39  14.568   3.650  -2.193
  260    HA   ASN  39           HA       ASN  39  14.833   0.923  -3.141
  261   1HB   ASN  39          HB1       ASN  39  13.275   1.645  -0.644
  262   2HB   ASN  39          HB2       ASN  39  12.623   0.457  -1.738
  263   1HD2  ASN  39          HD2       ASN  39  14.284   0.386   1.076
  264   2HD2  ASN  39          HD2       ASN  39  15.316  -0.912   0.718
  265    H    CYS  40           HN       CYS  40  12.555   0.149  -3.938
  266    HA   CYS  40           HA       CYS  40  11.188   2.493  -5.132
  267   1HB   CYS  40          HB1       CYS  40  12.693   0.380  -6.384
  268   2HB   CYS  40          HB2       CYS  40  11.052   0.144  -6.797
  269    H    TRP  41           HN       TRP  41   8.972   2.331  -5.359
  270    HA   TRP  41           HA       TRP  41   7.618  -0.035  -4.272
  271   1HB   TRP  41          HB1       TRP  41   7.055   2.775  -3.202
  272   2HB   TRP  41          HB2       TRP  41   6.229   1.312  -2.764
  273    HD1  TRP  41           HD1      TRP  41   9.917   2.722  -2.570
  274    HE1  TRP  41           HE1      TRP  41  10.830   1.801  -0.417
  275    HE3  TRP  41           HE3      TRP  41   6.039  -0.112  -1.067
  276    HZ2  TRP  41           HZ2      TRP  41  10.093   0.064   1.766
  277    HZ3  TRP  41           HZ3      TRP  41   6.129  -1.386   1.038
  278    HH2  TRP  41           HH2      TRP  41   8.151  -1.305   2.464
  279    H    CYS  42           HN       CYS  42   5.286   0.037  -4.730
  280    HA   CYS  42           HA       CYS  42   4.885   1.501  -7.270
  281   1HB   CYS  42          HB1       CYS  42   3.331  -0.735  -5.964
  282   2HB   CYS  42          HB2       CYS  42   2.782   0.077  -7.410
  283    H    GLU  43           HN       GLU  43   2.334   2.059  -7.408
  284    HA   GLU  43           HA       GLU  43   1.509   3.542  -4.991
  285   1HB   GLU  43          HB1       GLU  43   1.825   4.842  -7.722
  286   2HB   GLU  43          HB2       GLU  43   1.183   5.600  -6.281
  287   1HG   GLU  43          HG1       GLU  43   3.348   5.201  -5.097
  288   2HG   GLU  43          HG2       GLU  43   4.017   4.507  -6.562
  289    H    THR  44           HN       THR  44   0.083   1.746  -5.087
  290    HA   THR  44           HA       THR  44  -1.967   1.834  -7.173
  291    HB   THR  44           HB       THR  44  -1.399  -0.458  -6.618
  292    HG1  THR  44           HG1      THR  44  -3.576   0.308  -5.036
  293   1HG2  THR  44          HG2       THR  44  -0.317  -0.030  -4.405
  294   2HG2  THR  44          HG2       THR  44  -1.939   0.169  -3.678
  295   3HG2  THR  44          HG2       THR  44  -1.471  -1.398  -4.401
  Start of MODEL    4
    1   1H    ASP   1          HT1       ASP   1   0.817   0.508  -0.063
    2   2H    ASP   1          HT2       ASP   1   2.037  -0.635   0.350
    3   3H    ASP   1          HT3       ASP   1   2.332   1.046   0.455
    4    HA   ASP   1           HA       ASP   1   1.510   0.536  -2.137
    5   1HB   ASP   1          HB1       ASP   1   4.413   0.738  -1.197
    6   2HB   ASP   1          HB2       ASP   1   3.810   1.218  -2.750
    7    H    LYS   2           HN       LYS   2   2.904  -0.772  -3.719
    8    HA   LYS   2           HA       LYS   2   3.516  -3.425  -2.624
    9   1HB   LYS   2          HB1       LYS   2   2.223  -2.324  -5.105
   10   2HB   LYS   2          HB2       LYS   2   3.249  -3.671  -5.300
   11   1HG   LYS   2          HG1       LYS   2   0.921  -3.535  -3.273
   12   2HG   LYS   2          HG2       LYS   2   0.734  -4.196  -4.884
   13   1HD   LYS   2          HD1       LYS   2   2.499  -5.926  -4.286
   14   2HD   LYS   2          HD2       LYS   2   2.530  -5.276  -2.662
   15   1HE   LYS   2          HE1       LYS   2   0.194  -5.854  -2.256
   16   2HE   LYS   2          HE2       LYS   2  -0.043  -6.304  -3.932
   17   1HZ   LYS   2          HZ1       LYS   2   0.917  -7.938  -1.812
   18   2HZ   LYS   2          HZ2       LYS   2   0.569  -8.372  -3.401
   19   3HZ   LYS   2          HZ3       LYS   2   2.111  -7.808  -3.016
   20    H    LEU   3           HN       LEU   3   5.580  -3.367  -2.200
   21    HA   LEU   3           HA       LEU   3   7.560  -1.754  -3.463
   22   1HB   LEU   3          HB1       LEU   3   7.673  -2.975  -1.182
   23   2HB   LEU   3          HB2       LEU   3   8.046  -4.435  -2.077
   24    HG   LEU   3           HG       LEU   3   9.769  -2.078  -2.795
   25   1HD1  LEU   3          HD1       LEU   3  10.021  -3.422  -0.090
   26   2HD1  LEU   3          HD1       LEU   3  11.153  -2.249  -0.843
   27   3HD1  LEU   3          HD1       LEU   3   9.506  -1.735  -0.416
   28   1HD2  LEU   3          HD2       LEU   3  10.163  -4.405  -3.621
   29   2HD2  LEU   3          HD2       LEU   3  11.525  -3.711  -2.700
   30   3HD2  LEU   3          HD2       LEU   3  10.434  -4.910  -1.932
   31    H    ILE   4           HN       ILE   4   9.338  -2.512  -4.708
   32    HA   ILE   4           HA       ILE   4   8.732  -4.795  -6.529
   33    HB   ILE   4           HB       ILE   4   9.559  -3.357  -8.455
   34   1HG1  ILE   4          HG1       ILE   4   8.911  -0.977  -6.640
   35   2HG1  ILE   4          HG1       ILE   4  10.550  -1.522  -7.004
   36   1HG2  ILE   4          HG2       ILE   4   7.206  -3.928  -7.990
   37   2HG2  ILE   4          HG2       ILE   4   7.057  -2.473  -6.961
   38   3HG2  ILE   4          HG2       ILE   4   7.313  -2.312  -8.730
   39   1HD1  ILE   4          HD1       ILE   4   9.826   0.270  -8.551
   40   2HD1  ILE   4          HD2       ILE   4  10.209  -1.281  -9.349
   41   3HD1  ILE   4          HD3       ILE   4   8.498  -0.766  -9.110
   42    H    GLY   5           HN       GLY   5  11.141  -2.480  -5.363
   43   1HA   GLY   5          HA1       GLY   5  13.076  -4.412  -4.779
   44   2HA   GLY   5          HA2       GLY   5  13.357  -3.918  -6.455
   45    H    SER   6           HN       SER   6  15.291  -2.901  -6.050
   46    HA   SER   6           HA       SER   6  15.344  -0.715  -4.097
   47   1HB   SER   6          HB1       SER   6  17.347  -2.494  -5.424
   48   2HB   SER   6          HB2       SER   6  17.862  -0.842  -5.314
   49    HG   SER   6           HG       SER   6  17.036  -0.933  -3.101
   50    H    CYS   7           HN       CYS   7  16.927   1.105  -5.092
   51    HA   CYS   7           HA       CYS   7  16.096   1.876  -7.814
   52   1HB   CYS   7          HB1       CYS   7  14.243   2.794  -6.542
   53   2HB   CYS   7          HB2       CYS   7  15.309   3.442  -5.314
   54    H    VAL   8           HN       VAL   8  18.530   1.135  -7.232
   55    HA   VAL   8           HA       VAL   8  20.076   3.617  -7.428
   56    HB   VAL   8           HB       VAL   8  20.333   1.573  -5.197
   57   1HG1  VAL   8          HG1       VAL   8  22.691   3.164  -6.245
   58   2HG1  VAL   8          HG1       VAL   8  22.632   2.223  -4.723
   59   3HG1  VAL   8          HG1       VAL   8  22.516   1.380  -6.285
   60   1HG2  VAL   8          HG2       VAL   8  19.375   3.840  -4.867
   61   2HG2  VAL   8          HG2       VAL   8  20.906   3.667  -3.949
   62   3HG2  VAL   8          HG2       VAL   8  20.882   4.568  -5.489
   63    H    TRP   9           HN       TRP   9  21.522   3.486  -8.947
   64    HA   TRP   9           HA       TRP   9  21.785   0.987 -10.449
   65   1HB   TRP   9          HB1       TRP   9  21.880   3.657 -11.219
   66   2HB   TRP   9          HB2       TRP   9  23.593   3.291 -11.156
   67    HD1  TRP   9           HD1      TRP   9  21.185   3.566 -13.652
   68    HE1  TRP   9           HE1      TRP   9  21.495   1.880 -15.469
   69    HE3  TRP   9           HE3      TRP   9  24.257   0.192 -11.382
   70    HZ2  TRP   9           HZ2      TRP   9  22.809  -0.575 -16.034
   71    HZ3  TRP   9           HZ3      TRP   9  25.006  -1.799 -12.574
   72    HH2  TRP   9           HH2      TRP   9  24.292  -2.202 -14.908
   73    H    GLY  10           HN       GLY  10  22.572   0.088  -8.406
   74   1HA   GLY  10          HA1       GLY  10  25.147  -0.878  -8.475
   75   2HA   GLY  10          HA2       GLY  10  25.329   0.631  -7.589
   76    H    ALA  11           HN       ALA  11  22.641  -1.661  -7.526
   77    HA   ALA  11           HA       ALA  11  23.362  -2.614  -4.862
   78   1HB   ALA  11          HB1       ALA  11  22.128  -0.533  -4.432
   79   2HB   ALA  11          HB2       ALA  11  20.804  -1.106  -5.494
   80   3HB   ALA  11          HB3       ALA  11  21.136  -1.943  -3.951
   81    H    VAL  12           HN       VAL  12  21.528  -4.112  -4.133
   82    HA   VAL  12           HA       VAL  12  21.144  -6.083  -6.249
   83    HB   VAL  12           HB       VAL  12  19.948  -6.304  -3.478
   84   1HG1  VAL  12          HG1       VAL  12  21.269  -8.325  -5.288
   85   2HG1  VAL  12          HG1       VAL  12  20.604  -8.659  -3.657
   86   3HG1  VAL  12          HG1       VAL  12  19.509  -8.168  -4.962
   87   1HG2  VAL  12          HG2       VAL  12  22.222  -5.498  -3.046
   88   2HG2  VAL  12          HG2       VAL  12  22.074  -7.219  -2.610
   89   3HG2  VAL  12          HG2       VAL  12  22.873  -6.753  -4.145
   90    H    ASN  13           HN       ASN  13  18.929  -7.140  -6.295
   91    HA   ASN  13           HA       ASN  13  16.791  -6.900  -7.241
   92   1HB   ASN  13          HB1       ASN  13  16.593  -5.340  -4.701
   93   2HB   ASN  13          HB2       ASN  13  15.190  -5.835  -5.634
   94   1HD2  ASN  13          HD2       ASN  13  14.266  -7.706  -4.692
   95   2HD2  ASN  13          HD2       ASN  13  15.183  -8.968  -4.012
   96    H    TYR  14           HN       TYR  14  18.825  -4.999  -8.013
   97    HA   TYR  14           HA       TYR  14  18.057  -2.355  -8.153
   98   1HB   TYR  14          HB1       TYR  14  20.229  -3.176  -9.105
   99   2HB   TYR  14          HB2       TYR  14  19.360  -4.056 -10.363
  100    HD1  TYR  14           HD1      TYR  14  19.884  -2.966 -12.408
  101    HD2  TYR  14           HD2      TYR  14  18.841  -0.570  -9.037
  102    HE1  TYR  14           HE1      TYR  14  19.867  -0.962 -13.820
  103    HE2  TYR  14           HE2      TYR  14  18.817   1.412 -10.463
  104    HH   TYR  14           HH       TYR  14  18.742   1.264 -13.761
  105    H    THR  15           HN       THR  15  16.590  -1.156  -9.250
  106    HA   THR  15           HA       THR  15  14.532  -2.636 -10.723
  107    HB   THR  15           HB       THR  15  14.666   0.065  -9.343
  108    HG1  THR  15           HG1      THR  15  13.228  -2.361  -8.897
  109   1HG2  THR  15          HG2       THR  15  12.298   0.239  -9.594
  110   2HG2  THR  15          HG2       THR  15  12.991   0.160 -11.247
  111   3HG2  THR  15          HG2       THR  15  12.208  -1.279 -10.531
  112    H    SER  16           HN       SER  16  15.725   0.692 -11.113
  113    HA   SER  16           HA       SER  16  16.771   1.695 -12.961
  114   1HB   SER  16          HB1       SER  16  17.378  -0.861 -13.772
  115   2HB   SER  16          HB2       SER  16  16.047  -0.558 -14.881
  116    HG   SER  16           HG       SER  16  17.254   0.800 -15.909
  117    H    ASP  17           HN       ASP  17  13.857  -0.186 -13.313
  118    HA   ASP  17           HA       ASP  17  12.505   2.168 -14.498
  119   1HB   ASP  17          HB1       ASP  17  11.344   0.563 -16.065
  120   2HB   ASP  17          HB2       ASP  17  13.064   0.803 -16.314
  121    H    CYS  18           HN       CYS  18  11.929   2.337 -12.220
  122    HA   CYS  18           HA       CYS  18  10.462   0.547 -10.678
  123   1HB   CYS  18          HB1       CYS  18  11.242   3.027 -10.370
  124   2HB   CYS  18          HB2       CYS  18   9.637   3.511 -10.854
  125    H    ASN  19           HN       ASN  19   9.048   2.879 -12.893
  126    HA   ASN  19           HA       ASN  19   6.409   1.946 -12.917
  127   1HB   ASN  19          HB1       ASN  19   7.454   3.952 -14.198
  128   2HB   ASN  19          HB2       ASN  19   7.786   2.810 -15.482
  129   1HD2  ASN  19          HD2       ASN  19   5.717   1.275 -15.918
  130   2HD2  ASN  19          HD2       ASN  19   4.262   2.135 -16.059
  131    H    GLY  20           HN       GLY  20   9.213   0.747 -14.494
  132   1HA   GLY  20          HA1       GLY  20   7.896  -1.152 -16.243
  133   2HA   GLY  20          HA2       GLY  20   9.596  -1.151 -15.833
  134    H    GLU  21           HN       GLU  21   9.903  -1.747 -13.428
  135    HA   GLU  21           HA       GLU  21   9.223  -4.452 -13.036
  136   1HB   GLU  21          HB1       GLU  21  10.962  -2.814 -11.754
  137   2HB   GLU  21          HB2       GLU  21   9.642  -2.702 -10.624
  138   1HG   GLU  21          HG1       GLU  21   9.583  -5.062 -10.165
  139   2HG   GLU  21          HG2       GLU  21  10.678  -5.416 -11.506
  140    H    CYS  22           HN       CYS  22   7.551  -1.560 -12.161
  141    HA   CYS  22           HA       CYS  22   5.604  -2.813 -10.436
  142   1HB   CYS  22          HB1       CYS  22   5.961  -0.111 -11.676
  143   2HB   CYS  22          HB2       CYS  22   4.399  -0.512 -11.089
  144    H    LEU  23           HN       LEU  23   5.717  -1.715 -13.842
  145    HA   LEU  23           HA       LEU  23   3.058  -2.436 -14.463
  146   1HB   LEU  23          HB1       LEU  23   5.616  -1.896 -15.941
  147   2HB   LEU  23          HB2       LEU  23   4.373  -2.707 -16.808
  148    HG   LEU  23           HG       LEU  23   4.021  -0.020 -15.418
  149   1HD1  LEU  23          HD1       LEU  23   5.593   0.010 -17.372
  150   2HD1  LEU  23          HD1       LEU  23   4.330  -0.779 -18.355
  151   3HD1  LEU  23          HD1       LEU  23   4.072   0.881 -17.745
  152   1HD2  LEU  23          HD2       LEU  23   1.914  -1.274 -15.666
  153   2HD2  LEU  23          HD2       LEU  23   1.964   0.134 -16.755
  154   3HD2  LEU  23          HD2       LEU  23   2.272  -1.508 -17.403
  155    H    LEU  24           HN       LEU  24   6.069  -4.121 -14.251
  156    HA   LEU  24           HA       LEU  24   5.358  -6.477 -15.669
  157   1HB   LEU  24          HB1       LEU  24   7.485  -5.433 -13.966
  158   2HB   LEU  24          HB2       LEU  24   7.135  -7.062 -13.540
  159    HG   LEU  24           HG       LEU  24   7.733  -6.051 -16.364
  160   1HD1  LEU  24          HD1       LEU  24   9.673  -5.777 -14.893
  161   2HD1  LEU  24          HD1       LEU  24   9.543  -7.495 -14.394
  162   3HD1  LEU  24          HD1       LEU  24   9.941  -7.075 -16.085
  163   1HD2  LEU  24          HD2       LEU  24   7.682  -8.876 -15.233
  164   2HD2  LEU  24          HD2       LEU  24   6.453  -8.157 -16.316
  165   3HD2  LEU  24          HD2       LEU  24   8.113  -8.421 -16.911
  166    H    ARG  25           HN       ARG  25   4.718  -5.359 -12.598
  167    HA   ARG  25           HA       ARG  25   3.421  -7.880 -11.679
  168   1HB   ARG  25          HB1       ARG  25   4.204  -5.332 -10.252
  169   2HB   ARG  25          HB2       ARG  25   2.925  -6.303  -9.588
  170   1HG   ARG  25          HG1       ARG  25   4.622  -7.246  -8.361
  171   2HG   ARG  25          HG2       ARG  25   4.820  -8.253  -9.771
  172   1HD   ARG  25          HD1       ARG  25   6.345  -5.639  -9.358
  173   2HD   ARG  25          HD2       ARG  25   7.019  -7.174  -8.868
  174    HE   ARG  25           HE       ARG  25   6.200  -6.496 -11.660
  175   1HH1  ARG  25          HH1       ARG  25   9.671  -7.421 -11.881
  176   2HH1  ARG  25          HH1       ARG  25   8.761  -5.966 -11.566
  177   1HH2  ARG  25          HH2       ARG  25   8.458  -9.526 -11.395
  178   2HH2  ARG  25          HH2       ARG  25   6.816  -9.339 -10.919
  179    H    GLY  26           HN       GLY  26   2.567  -5.222 -13.399
  180   1HA   GLY  26          HA1       GLY  26   0.404  -4.678 -14.214
  181   2HA   GLY  26          HA2       GLY  26  -0.299  -5.736 -12.994
  182    H    TYR  27           HN       TYR  27   2.011  -3.698 -11.700
  183    HA   TYR  27           HA       TYR  27  -0.037  -2.184 -10.280
  184   1HB   TYR  27          HB1       TYR  27   3.000  -1.943 -10.178
  185   2HB   TYR  27          HB2       TYR  27   1.903  -1.214  -9.036
  186    HD1  TYR  27           HD1      TYR  27  -0.015  -3.676  -8.737
  187    HD2  TYR  27           HD2      TYR  27   4.232  -3.302  -8.658
  188    HE1  TYR  27           HE1      TYR  27   0.139  -5.631  -7.316
  189    HE2  TYR  27           HE2      TYR  27   4.376  -5.251  -7.224
  190    HH   TYR  27           HH       TYR  27   2.317  -7.452  -6.959
  191    H    LYS  28           HN       LYS  28   0.249   0.192  -9.998
  192    HA   LYS  28           HA       LYS  28   0.371   1.344 -12.693
  193   1HB   LYS  28          HB1       LYS  28  -0.455   3.465 -11.455
  194   2HB   LYS  28          HB2       LYS  28  -1.559   2.113 -11.505
  195   1HG   LYS  28          HG1       LYS  28   0.322   2.367  -9.163
  196   2HG   LYS  28          HG2       LYS  28  -0.996   3.489  -9.230
  197   1HD   LYS  28          HD1       LYS  28  -1.937   0.712  -9.778
  198   2HD   LYS  28          HD2       LYS  28  -1.063   0.802  -8.275
  199   1HE   LYS  28          HE1       LYS  28  -3.573   1.239  -8.044
  200   2HE   LYS  28          HE2       LYS  28  -2.601   2.529  -7.379
  201   1HZ   LYS  28          HZ1       LYS  28  -3.484   3.924  -8.722
  202   2HZ   LYS  28          HZ2       LYS  28  -2.936   3.086 -10.071
  203   3HZ   LYS  28          HZ3       LYS  28  -4.492   2.741  -9.426
  204    H    GLY  29           HN       GLY  29   1.358   3.451 -12.915
  205   1HA   GLY  29          HA1       GLY  29   4.032   3.523 -12.925
  206   2HA   GLY  29          HA2       GLY  29   3.121   5.004 -12.652
  207    H    GLY  30           HN       GLY  30   5.159   2.636 -11.294
  208   1HA   GLY  30          HA1       GLY  30   4.733   3.318  -8.521
  209   2HA   GLY  30          HA2       GLY  30   6.087   2.364  -9.165
  210    H    HIS  31           HN       HIS  31   7.208   3.625  -7.500
  211    HA   HIS  31           HA       HIS  31   8.622   5.794  -8.761
  212   1HB   HIS  31          HB1       HIS  31   8.055   7.467  -6.853
  213   2HB   HIS  31          HB2       HIS  31   6.610   7.016  -7.752
  214    HD1  HIS  31           HD1      HIS  31   5.161   5.145  -6.632
  215    HD2  HIS  31           HD2      HIS  31   8.079   6.519  -4.045
  216    HE1  HIS  31           HE1      HIS  31   4.515   4.299  -4.361
  217    HE2  HIS  31           HE2      HIS  31   6.272   5.156  -2.859
  218    H    CYS  32           HN       CYS  32  10.262   6.750  -7.154
  219    HA   CYS  32           HA       CYS  32  11.460   4.454  -5.753
  220   1HB   CYS  32          HB1       CYS  32  12.503   7.182  -6.554
  221   2HB   CYS  32          HB2       CYS  32  13.405   6.090  -5.536
  222    H    GLY  33           HN       GLY  33  12.042   4.575  -3.607
  223   1HA   GLY  33          HA1       GLY  33  10.272   5.421  -1.745
  224   2HA   GLY  33          HA2       GLY  33  11.971   5.288  -1.442
  225    H    SER  34           HN       SER  34  13.268   7.242  -1.758
  226    HA   SER  34           HA       SER  34  11.952   9.789  -2.168
  227   1HB   SER  34          HB1       SER  34  12.557  10.551   0.258
  228   2HB   SER  34          HB2       SER  34  11.217   9.408   0.151
  229    HG   SER  34           HG       SER  34  13.159   9.027   1.626
  230    H    PHE  35           HN       PHE  35  14.596   8.860  -0.199
  231    HA   PHE  35           HA       PHE  35  16.581   9.956  -2.169
  232   1HB   PHE  35          HB1       PHE  35  16.183  11.670  -0.470
  233   2HB   PHE  35          HB2       PHE  35  16.408  10.541   0.842
  234    HD1  PHE  35           HD1      PHE  35  18.367  11.371  -2.291
  235    HD2  PHE  35           HD2      PHE  35  18.450  10.879   1.955
  236    HE1  PHE  35           HE1      PHE  35  20.767  11.827  -2.274
  237    HE2  PHE  35           HE2      PHE  35  20.847  11.336   1.952
  238    HZ   PHE  35           HZ       PHE  35  22.017  11.811  -0.157
  239    H    ALA  36           HN       ALA  36  17.422   8.805   0.998
  240    HA   ALA  36           HA       ALA  36  19.154   6.978  -0.256
  241   1HB   ALA  36          HB1       ALA  36  19.854   8.202   1.765
  242   2HB   ALA  36          HB2       ALA  36  18.516   7.451   2.693
  243   3HB   ALA  36          HB3       ALA  36  19.860   6.442   2.092
  244    H    ASN  37           HN       ASN  37  16.135   6.892   0.280
  245    HA   ASN  37           HA       ASN  37  15.228   4.599   1.584
  246   1HB   ASN  37          HB1       ASN  37  14.025   6.512  -0.037
  247   2HB   ASN  37          HB2       ASN  37  14.048   5.140  -1.121
  248   1HD2  ASN  37          HD2       ASN  37  12.377   6.713   1.260
  249   2HD2  ASN  37          HD2       ASN  37  11.293   5.465   1.710
  250    H    VAL  38           HN       VAL  38  16.585   4.954  -1.587
  251    HA   VAL  38           HA       VAL  38  17.292   3.411  -3.201
  252    HB   VAL  38           HB       VAL  38  19.050   3.447  -1.368
  253   1HG1  VAL  38          HG1       VAL  38  18.002   2.403   0.515
  254   2HG1  VAL  38          HG1       VAL  38  17.803   0.879  -0.407
  255   3HG1  VAL  38          HG1       VAL  38  19.436   1.475   0.048
  256   1HG2  VAL  38          HG2       VAL  38  20.299   1.478  -2.091
  257   2HG2  VAL  38          HG2       VAL  38  18.789   0.754  -2.718
  258   3HG2  VAL  38          HG2       VAL  38  19.417   2.253  -3.447
  259    H    ASN  39           HN       ASN  39  14.677   3.085  -1.980
  260    HA   ASN  39           HA       ASN  39  14.103   0.274  -2.782
  261   1HB   ASN  39          HB1       ASN  39  13.268   1.696  -0.256
  262   2HB   ASN  39          HB2       ASN  39  12.159   0.552  -0.991
  263   1HD2  ASN  39          HD2       ASN  39  12.420  -1.149   0.604
  264   2HD2  ASN  39          HD2       ASN  39  13.924  -1.920   0.797
  265    H    CYS  40           HN       CYS  40  12.706   0.229  -4.406
  266    HA   CYS  40           HA       CYS  40  11.083   2.658  -4.933
  267   1HB   CYS  40          HB1       CYS  40  12.568   0.906  -6.632
  268   2HB   CYS  40          HB2       CYS  40  10.905   0.530  -6.928
  269    H    TRP  41           HN       TRP  41   8.967   2.559  -5.053
  270    HA   TRP  41           HA       TRP  41   7.549   0.124  -4.102
  271   1HB   TRP  41          HB1       TRP  41   6.902   2.952  -3.220
  272   2HB   TRP  41          HB2       TRP  41   6.232   1.490  -2.578
  273    HD1  TRP  41           HD1      TRP  41   9.687   3.428  -2.642
  274    HE1  TRP  41           HE1      TRP  41  10.874   2.705  -0.546
  275    HE3  TRP  41           HE3      TRP  41   6.457   0.020  -1.084
  276    HZ2  TRP  41           HZ2      TRP  41  10.480   0.784   1.681
  277    HZ3  TRP  41           HZ3      TRP  41   6.751  -1.280   0.921
  278    HH2  TRP  41           HH2      TRP  41   8.797  -0.916   2.365
  279    H    CYS  42           HN       CYS  42   5.368  -0.064  -4.829
  280    HA   CYS  42           HA       CYS  42   4.991   1.490  -7.310
  281   1HB   CYS  42          HB1       CYS  42   3.462  -0.869  -6.188
  282   2HB   CYS  42          HB2       CYS  42   3.036  -0.025  -7.667
  283    H    GLU  43           HN       GLU  43   2.864   2.426  -7.733
  284    HA   GLU  43           HA       GLU  43   1.931   3.835  -5.300
  285   1HB   GLU  43          HB1       GLU  43   2.433   4.609  -8.112
  286   2HB   GLU  43          HB2       GLU  43   0.862   5.137  -7.578
  287   1HG   GLU  43          HG1       GLU  43   1.695   6.596  -6.024
  288   2HG   GLU  43          HG2       GLU  43   3.046   5.614  -5.555
  289    H    THR  44           HN       THR  44   1.107   1.593  -5.126
  290    HA   THR  44           HA       THR  44  -1.545   1.253  -6.342
  291    HB   THR  44           HB       THR  44  -0.214  -0.775  -6.233
  292    HG1  THR  44           HG1      THR  44  -2.422  -0.357  -4.644
  293   1HG2  THR  44          HG2       THR  44   1.170  -0.132  -4.209
  294   2HG2  THR  44          HG2       THR  44  -0.281  -0.441  -3.201
  295   3HG2  THR  44          HG2       THR  44   0.438  -1.770  -4.140
  Start of MODEL    5
    1   1H    ASP   1          HT1       ASP   1  -0.453   0.214  -0.145
    2   2H    ASP   1          HT2       ASP   1   0.413  -1.101   0.546
    3   3H    ASP   1          HT3       ASP   1   0.674   0.471   1.114
    4    HA   ASP   1           HA       ASP   1   1.178   0.405  -1.659
    5   1HB   ASP   1          HB1       ASP   1   3.596   0.842  -0.680
    6   2HB   ASP   1          HB2       ASP   1   2.362   2.024  -0.325
    7    H    LYS   2           HN       LYS   2   2.763  -0.642  -2.715
    8    HA   LYS   2           HA       LYS   2   3.304  -3.420  -1.791
    9   1HB   LYS   2          HB1       LYS   2   1.446  -3.066  -3.540
   10   2HB   LYS   2          HB2       LYS   2   2.690  -2.429  -4.565
   11   1HG   LYS   2          HG1       LYS   2   2.436  -4.551  -5.307
   12   2HG   LYS   2          HG2       LYS   2   3.938  -4.593  -4.425
   13   1HD   LYS   2          HD1       LYS   2   2.911  -6.576  -3.748
   14   2HD   LYS   2          HD2       LYS   2   2.498  -5.511  -2.422
   15   1HE   LYS   2          HE1       LYS   2   0.673  -5.937  -4.842
   16   2HE   LYS   2          HE2       LYS   2   0.609  -6.995  -3.456
   17   1HZ   LYS   2          HZ1       LYS   2  -0.604  -4.473  -3.796
   18   2HZ   LYS   2          HZ2       LYS   2  -0.774  -5.560  -2.505
   19   3HZ   LYS   2          HZ3       LYS   2   0.443  -4.379  -2.446
   20    H    LEU   3           HN       LEU   3   5.388  -3.912  -1.806
   21    HA   LEU   3           HA       LEU   3   7.322  -1.971  -2.744
   22   1HB   LEU   3          HB1       LEU   3   7.533  -3.638  -0.727
   23   2HB   LEU   3          HB2       LEU   3   7.873  -4.869  -1.915
   24    HG   LEU   3           HG       LEU   3   9.842  -3.651  -0.645
   25   1HD1  LEU   3          HD1       LEU   3  10.078  -4.165  -3.580
   26   2HD1  LEU   3          HD1       LEU   3  11.412  -3.912  -2.412
   27   3HD1  LEU   3          HD1       LEU   3  10.299  -5.309  -2.239
   28   1HD2  LEU   3          HD2       LEU   3   9.234  -1.462  -0.982
   29   2HD2  LEU   3          HD2       LEU   3  10.820  -1.765  -1.743
   30   3HD2  LEU   3          HD2       LEU   3   9.356  -1.595  -2.759
   31    H    ILE   4           HN       ILE   4   9.037  -2.548  -4.230
   32    HA   ILE   4           HA       ILE   4   8.233  -4.464  -6.342
   33    HB   ILE   4           HB       ILE   4   8.405  -2.894  -8.138
   34   1HG1  ILE   4          HG1       ILE   4   9.501  -0.754  -6.281
   35   2HG1  ILE   4          HG1       ILE   4  10.449  -1.629  -7.468
   36   1HG2  ILE   4          HG2       ILE   4   7.063  -1.485  -5.829
   37   2HG2  ILE   4          HG2       ILE   4   6.758  -1.193  -7.561
   38   3HG2  ILE   4          HG2       ILE   4   6.375  -2.785  -6.857
   39   1HD1  ILE   4          HD1       ILE   4   9.792   0.495  -8.452
   40   2HD1  ILE   4          HD2       ILE   4   8.952  -0.834  -9.266
   41   3HD1  ILE   4          HD3       ILE   4   8.083   0.174  -8.054
   42    H    GLY   5           HN       GLY   5  10.786  -2.414  -4.942
   43   1HA   GLY   5          HA1       GLY   5  12.746  -4.366  -4.835
   44   2HA   GLY   5          HA2       GLY   5  12.910  -3.673  -6.444
   45    H    SER   6           HN       SER   6  15.020  -2.959  -5.759
   46    HA   SER   6           HA       SER   6  14.999  -0.774  -3.780
   47   1HB   SER   6          HB1       SER   6  17.025  -2.722  -4.535
   48   2HB   SER   6          HB2       SER   6  17.649  -1.127  -4.879
   49    HG   SER   6           HG       SER   6  17.061  -0.462  -2.744
   50    H    CYS   7           HN       CYS   7  16.342   1.121  -4.345
   51    HA   CYS   7           HA       CYS   7  16.183   1.885  -7.226
   52   1HB   CYS   7          HB1       CYS   7  14.144   2.844  -6.154
   53   2HB   CYS   7          HB2       CYS   7  15.120   3.557  -4.878
   54    H    VAL   8           HN       VAL   8  18.411   0.996  -6.022
   55    HA   VAL   8           HA       VAL   8  20.002   3.486  -5.570
   56    HB   VAL   8           HB       VAL   8  20.383   0.678  -4.437
   57   1HG1  VAL   8          HG1       VAL   8  22.212   3.093  -4.153
   58   2HG1  VAL   8          HG1       VAL   8  22.392   1.519  -3.320
   59   3HG1  VAL   8          HG1       VAL   8  22.593   1.609  -5.087
   60   1HG2  VAL   8          HG2       VAL   8  20.293   1.826  -2.318
   61   2HG2  VAL   8          HG2       VAL   8  20.060   3.399  -3.145
   62   3HG2  VAL   8          HG2       VAL   8  18.817   2.114  -3.279
   63    H    TRP   9           HN       TRP   9  21.457   3.884  -7.034
   64    HA   TRP   9           HA       TRP   9  21.848   2.079  -9.285
   65   1HB   TRP   9          HB1       TRP   9  22.953   4.847  -8.576
   66   2HB   TRP   9          HB2       TRP   9  23.386   3.988 -10.046
   67    HD1  TRP   9           HD1      TRP   9  20.117   5.199  -8.183
   68    HE1  TRP   9           HE1      TRP   9  18.425   5.508  -9.998
   69    HE3  TRP   9           HE3      TRP   9  22.781   3.647 -12.153
   70    HZ2  TRP   9           HZ2      TRP   9  18.136   5.176 -12.865
   71    HZ3  TRP   9           HZ3      TRP   9  21.815   3.641 -14.427
   72    HH2  TRP   9           HH2      TRP   9  19.494   4.406 -14.785
   73    H    GLY  10           HN       GLY  10  22.554   0.459  -7.741
   74   1HA   GLY  10          HA1       GLY  10  24.933  -0.641  -7.986
   75   2HA   GLY  10          HA2       GLY  10  25.393   0.668  -6.903
   76    H    ALA  11           HN       ALA  11  22.705  -1.642  -7.093
   77    HA   ALA  11           HA       ALA  11  23.409  -2.832  -4.526
   78   1HB   ALA  11          HB1       ALA  11  22.117  -0.835  -3.884
   79   2HB   ALA  11          HB2       ALA  11  20.802  -1.357  -4.988
   80   3HB   ALA  11          HB3       ALA  11  21.182  -2.317  -3.530
   81    H    VAL  12           HN       VAL  12  21.639  -4.437  -3.973
   82    HA   VAL  12           HA       VAL  12  21.230  -6.164  -6.297
   83    HB   VAL  12           HB       VAL  12  20.148  -6.680  -3.525
   84   1HG1  VAL  12          HG1       VAL  12  21.312  -8.547  -5.575
   85   2HG1  VAL  12          HG1       VAL  12  20.751  -9.004  -3.938
   86   3HG1  VAL  12          HG1       VAL  12  19.579  -8.389  -5.118
   87   1HG2  VAL  12          HG2       VAL  12  22.453  -5.933  -3.131
   88   2HG2  VAL  12          HG2       VAL  12  22.308  -7.686  -2.860
   89   3HG2  VAL  12          HG2       VAL  12  23.023  -7.075  -4.387
   90    H    ASN  13           HN       ASN  13  19.031  -7.250  -6.389
   91    HA   ASN  13           HA       ASN  13  16.841  -6.958  -7.184
   92   1HB   ASN  13          HB1       ASN  13  16.524  -5.466  -4.616
   93   2HB   ASN  13          HB2       ASN  13  15.280  -6.341  -5.462
   94   1HD2  ASN  13          HD2       ASN  13  16.582  -6.723  -2.636
   95   2HD2  ASN  13          HD2       ASN  13  16.924  -8.393  -2.638
   96    H    TYR  14           HN       TYR  14  18.821  -4.921  -7.807
   97    HA   TYR  14           HA       TYR  14  17.920  -2.289  -7.650
   98   1HB   TYR  14          HB1       TYR  14  20.158  -2.841  -8.503
   99   2HB   TYR  14          HB2       TYR  14  19.485  -3.789  -9.810
  100    HD1  TYR  14           HD1      TYR  14  19.183  -0.218  -8.580
  101    HD2  TYR  14           HD2      TYR  14  19.649  -2.853 -11.900
  102    HE1  TYR  14           HE1      TYR  14  19.321   1.703 -10.096
  103    HE2  TYR  14           HE2      TYR  14  19.801  -0.936 -13.397
  104    HH   TYR  14           HH       TYR  14  20.086   2.327 -12.329
  105    H    THR  15           HN       THR  15  16.496  -1.022  -8.773
  106    HA   THR  15           HA       THR  15  14.462  -2.471 -10.302
  107    HB   THR  15           HB       THR  15  14.642   0.280  -9.022
  108    HG1  THR  15           HG1      THR  15  14.122  -1.315  -7.677
  109   1HG2  THR  15          HG2       THR  15  13.181   0.398 -11.133
  110   2HG2  THR  15          HG2       THR  15  12.237  -0.949 -10.430
  111   3HG2  THR  15          HG2       THR  15  12.356   0.621  -9.569
  112    H    SER  16           HN       SER  16  15.803   0.768 -10.831
  113    HA   SER  16           HA       SER  16  16.886   1.685 -12.707
  114   1HB   SER  16          HB1       SER  16  18.001   0.248 -14.073
  115   2HB   SER  16          HB2       SER  16  17.182  -1.170 -13.489
  116    HG   SER  16           HG       SER  16  15.635  -0.879 -15.114
  117    H    ASP  17           HN       ASP  17  13.957  -0.161 -13.022
  118    HA   ASP  17           HA       ASP  17  12.688   2.124 -14.427
  119   1HB   ASP  17          HB1       ASP  17  11.643   0.409 -15.957
  120   2HB   ASP  17          HB2       ASP  17  13.378   0.591 -16.109
  121    H    CYS  18           HN       CYS  18  12.052   2.428 -12.136
  122    HA   CYS  18           HA       CYS  18  10.518   0.744 -10.543
  123   1HB   CYS  18          HB1       CYS  18  11.279   3.290 -10.354
  124   2HB   CYS  18          HB2       CYS  18   9.696   3.647 -10.972
  125    H    ASN  19           HN       ASN  19   8.891   3.105 -12.620
  126    HA   ASN  19           HA       ASN  19   6.396   1.934 -12.648
  127   1HB   ASN  19          HB1       ASN  19   7.389   4.065 -13.952
  128   2HB   ASN  19          HB2       ASN  19   7.406   2.949 -15.300
  129   1HD2  ASN  19          HD2       ASN  19   4.917   1.454 -14.197
  130   2HD2  ASN  19          HD2       ASN  19   3.639   2.510 -14.560
  131    H    GLY  20           HN       GLY  20   9.248   0.926 -14.228
  132   1HA   GLY  20          HA1       GLY  20   8.127  -0.913 -16.145
  133   2HA   GLY  20          HA2       GLY  20   9.784  -0.940 -15.548
  134    H    GLU  21           HN       GLU  21   9.842  -1.581 -13.164
  135    HA   GLU  21           HA       GLU  21   9.203  -4.312 -12.874
  136   1HB   GLU  21          HB1       GLU  21  10.770  -2.937 -11.435
  137   2HB   GLU  21          HB2       GLU  21   9.388  -2.356 -10.572
  138   1HG   GLU  21          HG1       GLU  21   9.911  -4.256  -9.183
  139   2HG   GLU  21          HG2       GLU  21   8.722  -4.871 -10.292
  140    H    CYS  22           HN       CYS  22   7.421  -1.495 -11.977
  141    HA   CYS  22           HA       CYS  22   5.285  -2.914 -10.623
  142   1HB   CYS  22          HB1       CYS  22   5.797  -0.117 -11.476
  143   2HB   CYS  22          HB2       CYS  22   4.137  -0.550 -11.315
  144    H    LEU  23           HN       LEU  23   5.725  -1.576 -13.913
  145    HA   LEU  23           HA       LEU  23   3.178  -2.281 -14.889
  146   1HB   LEU  23          HB1       LEU  23   5.899  -1.651 -15.989
  147   2HB   LEU  23          HB2       LEU  23   4.804  -2.431 -17.064
  148    HG   LEU  23           HG       LEU  23   4.123   0.143 -15.564
  149   1HD1  LEU  23          HD1       LEU  23   5.123  -0.240 -18.412
  150   2HD1  LEU  23          HD1       LEU  23   4.643   1.312 -17.655
  151   3HD1  LEU  23          HD1       LEU  23   6.077   0.437 -17.057
  152   1HD2  LEU  23          HD2       LEU  23   2.933  -1.160 -18.038
  153   2HD2  LEU  23          HD2       LEU  23   2.194  -1.150 -16.408
  154   3HD2  LEU  23          HD2       LEU  23   2.406   0.383 -17.292
  155    H    LEU  24           HN       LEU  24   6.150  -3.972 -14.346
  156    HA   LEU  24           HA       LEU  24   5.646  -6.286 -15.923
  157   1HB   LEU  24          HB1       LEU  24   7.564  -5.258 -14.012
  158   2HB   LEU  24          HB2       LEU  24   7.168  -6.860 -13.511
  159    HG   LEU  24           HG       LEU  24   7.946  -5.986 -16.330
  160   1HD1  LEU  24          HD1       LEU  24   9.689  -7.251 -14.179
  161   2HD1  LEU  24          HD1       LEU  24  10.188  -6.932 -15.866
  162   3HD1  LEU  24          HD1       LEU  24   9.813  -5.569 -14.780
  163   1HD2  LEU  24          HD2       LEU  24   6.760  -8.136 -16.245
  164   2HD2  LEU  24          HD2       LEU  24   8.468  -8.391 -16.695
  165   3HD2  LEU  24          HD2       LEU  24   7.922  -8.742 -15.027
  166    H    ARG  25           HN       ARG  25   4.735  -5.344 -12.817
  167    HA   ARG  25           HA       ARG  25   3.211  -7.857 -12.293
  168   1HB   ARG  25          HB1       ARG  25   3.641  -5.447 -10.502
  169   2HB   ARG  25          HB2       ARG  25   2.619  -6.767 -10.040
  170   1HG   ARG  25          HG1       ARG  25   4.356  -7.757  -9.112
  171   2HG   ARG  25          HG2       ARG  25   4.992  -8.014 -10.732
  172   1HD   ARG  25          HD1       ARG  25   6.368  -6.201 -10.693
  173   2HD   ARG  25          HD2       ARG  25   5.445  -5.258  -9.533
  174    HE   ARG  25           HE       ARG  25   6.313  -6.831  -7.783
  175   1HH1  ARG  25          HH1       ARG  25   9.805  -6.648  -8.708
  176   2HH1  ARG  25          HH1       ARG  25   8.696  -5.657  -7.860
  177   1HH2  ARG  25          HH2       ARG  25   8.958  -8.168 -10.213
  178   2HH2  ARG  25          HH2       ARG  25   7.236  -8.584 -10.142
  179    H    GLY  26           HN       GLY  26   2.553  -5.462 -14.125
  180   1HA   GLY  26          HA1       GLY  26   0.584  -4.413 -14.864
  181   2HA   GLY  26          HA2       GLY  26  -0.250  -5.776 -14.115
  182    H    TYR  27           HN       TYR  27   1.785  -3.650 -12.317
  183    HA   TYR  27           HA       TYR  27  -0.442  -2.988 -10.558
  184   1HB   TYR  27          HB1       TYR  27   2.486  -2.180 -10.642
  185   2HB   TYR  27          HB2       TYR  27   1.428  -1.465  -9.467
  186    HD1  TYR  27           HD1      TYR  27  -0.228  -4.161  -8.977
  187    HD2  TYR  27           HD2      TYR  27   3.943  -3.235  -9.027
  188    HE1  TYR  27           HE1      TYR  27   0.206  -5.997  -7.470
  189    HE2  TYR  27           HE2      TYR  27   4.355  -5.077  -7.488
  190    HH   TYR  27           HH       TYR  27   2.970  -7.383  -6.948
  191    H    LYS  28           HN       LYS  28  -0.442  -0.650  -9.771
  192    HA   LYS  28           HA       LYS  28  -1.553   0.925 -11.939
  193   1HB   LYS  28          HB1       LYS  28  -1.070   1.464  -8.947
  194   2HB   LYS  28          HB2       LYS  28  -1.904   2.606  -9.985
  195   1HG   LYS  28          HG1       LYS  28  -3.854   1.438  -9.889
  196   2HG   LYS  28          HG2       LYS  28  -3.086  -0.034 -10.391
  197   1HD   LYS  28          HD1       LYS  28  -3.800  -0.799  -8.374
  198   2HD   LYS  28          HD2       LYS  28  -2.319  -0.111  -7.787
  199   1HE   LYS  28          HE1       LYS  28  -5.082   1.254  -7.776
  200   2HE   LYS  28          HE2       LYS  28  -4.327   0.503  -6.387
  201   1HZ   LYS  28          HZ1       LYS  28  -2.480   2.363  -7.374
  202   2HZ   LYS  28          HZ2       LYS  28  -3.964   3.160  -7.272
  203   3HZ   LYS  28          HZ3       LYS  28  -3.305   2.357  -5.937
  204    H    GLY  29           HN       GLY  29   1.407   0.886 -10.113
  205   1HA   GLY  29          HA1       GLY  29   3.113   1.974 -11.930
  206   2HA   GLY  29          HA2       GLY  29   2.392   3.407 -11.194
  207    H    GLY  30           HN       GLY  30   4.957   3.385 -10.797
  208   1HA   GLY  30          HA1       GLY  30   5.231   2.921  -7.963
  209   2HA   GLY  30          HA2       GLY  30   6.309   1.913  -8.943
  210    H    HIS  31           HN       HIS  31   7.099   3.797  -7.119
  211    HA   HIS  31           HA       HIS  31   8.748   5.558  -8.800
  212   1HB   HIS  31          HB1       HIS  31   8.028   7.671  -7.753
  213   2HB   HIS  31          HB2       HIS  31   6.584   6.845  -8.310
  214    HD1  HIS  31           HD1      HIS  31   4.808   7.168  -6.554
  215    HD2  HIS  31           HD2      HIS  31   8.448   6.566  -4.688
  216    HE1  HIS  31           HE1      HIS  31   4.363   7.191  -4.130
  217    HE2  HIS  31           HE2      HIS  31   6.596   6.827  -3.055
  218    H    CYS  32           HN       CYS  32  10.512   6.536  -7.628
  219    HA   CYS  32           HA       CYS  32  11.461   4.797  -5.500
  220   1HB   CYS  32          HB1       CYS  32  12.628   7.290  -6.774
  221   2HB   CYS  32          HB2       CYS  32  13.439   6.320  -5.576
  222    H    GLY  33           HN       GLY  33  11.906   5.417  -3.427
  223   1HA   GLY  33          HA1       GLY  33  10.008   6.852  -2.046
  224   2HA   GLY  33          HA2       GLY  33  11.614   6.543  -1.404
  225    H    SER  34           HN       SER  34  10.038   8.901  -0.959
  226    HA   SER  34           HA       SER  34  11.446  10.982  -2.550
  227   1HB   SER  34          HB1       SER  34   8.927  11.229  -2.223
  228   2HB   SER  34          HB2       SER  34   9.184  11.401  -0.479
  229    HG   SER  34           HG       SER  34   9.853  13.392  -0.872
  230    H    PHE  35           HN       PHE  35  10.563  10.666   0.899
  231    HA   PHE  35           HA       PHE  35  13.166  11.949   1.552
  232   1HB   PHE  35          HB1       PHE  35  10.946  12.865   2.530
  233   2HB   PHE  35          HB2       PHE  35  10.804  11.359   3.422
  234    HD1  PHE  35           HD1      PHE  35  13.561  13.835   2.738
  235    HD2  PHE  35           HD2      PHE  35  11.468  11.558   5.681
  236    HE1  PHE  35           HE1      PHE  35  15.004  14.753   4.483
  237    HE2  PHE  35           HE2      PHE  35  12.917  12.487   7.419
  238    HZ   PHE  35           HZ       PHE  35  14.689  14.083   6.831
  239    H    ALA  36           HN       ALA  36  12.675   9.112   0.728
  240    HA   ALA  36           HA       ALA  36  14.552   7.964   2.464
  241   1HB   ALA  36          HB1       ALA  36  13.090   6.089   3.265
  242   2HB   ALA  36          HB2       ALA  36  12.522   7.673   3.872
  243   3HB   ALA  36          HB3       ALA  36  11.695   6.886   2.489
  244    H    ASN  37           HN       ASN  37  14.873   8.354  -0.084
  245    HA   ASN  37           HA       ASN  37  13.853   6.425  -1.870
  246   1HB   ASN  37          HB1       ASN  37  15.720   7.273  -3.337
  247   2HB   ASN  37          HB2       ASN  37  14.890   8.598  -2.566
  248   1HD2  ASN  37          HD2       ASN  37  16.213  10.045  -1.409
  249   2HD2  ASN  37          HD2       ASN  37  17.803   9.669  -0.948
  250    H    VAL  38           HN       VAL  38  16.349   5.548  -2.913
  251    HA   VAL  38           HA       VAL  38  18.038   3.934  -2.634
  252    HB   VAL  38           HB       VAL  38  17.813   4.656   0.008
  253   1HG1  VAL  38          HG1       VAL  38  17.447   2.707   1.451
  254   2HG1  VAL  38          HG1       VAL  38  15.960   2.949   0.496
  255   3HG1  VAL  38          HG1       VAL  38  17.131   1.695   0.009
  256   1HG2  VAL  38          HG2       VAL  38  19.327   2.242  -0.725
  257   2HG2  VAL  38          HG2       VAL  38  19.850   3.961  -0.927
  258   3HG2  VAL  38          HG2       VAL  38  19.562   3.276   0.694
  259    H    ASN  39           HN       ASN  39  14.693   3.722  -2.146
  260    HA   ASN  39           HA       ASN  39  14.619   1.097  -3.401
  261   1HB   ASN  39          HB1       ASN  39  13.381   1.676  -0.670
  262   2HB   ASN  39          HB2       ASN  39  12.601   0.618  -1.794
  263   1HD2  ASN  39          HD2       ASN  39  13.480  -1.476  -2.103
  264   2HD2  ASN  39          HD2       ASN  39  14.911  -1.974  -1.315
  265    H    CYS  40           HN       CYS  40  12.595   0.545  -4.303
  266    HA   CYS  40           HA       CYS  40  10.964   2.973  -4.923
  267   1HB   CYS  40          HB1       CYS  40  12.447   1.228  -6.660
  268   2HB   CYS  40          HB2       CYS  40  10.763   0.904  -6.903
  269    H    TRP  41           HN       TRP  41   8.799   2.697  -5.113
  270    HA   TRP  41           HA       TRP  41   7.669   0.124  -4.104
  271   1HB   TRP  41          HB1       TRP  41   6.845   2.895  -3.108
  272   2HB   TRP  41          HB2       TRP  41   6.094   1.364  -2.687
  273    HD1  TRP  41           HD1      TRP  41   9.728   2.879  -2.567
  274    HE1  TRP  41           HE1      TRP  41  10.746   1.908  -0.478
  275    HE3  TRP  41           HE3      TRP  41   5.953  -0.017  -0.969
  276    HZ2  TRP  41           HZ2      TRP  41  10.127   0.127   1.679
  277    HZ3  TRP  41           HZ3      TRP  41   6.145  -1.349   1.088
  278    HH2  TRP  41           HH2      TRP  41   8.231  -1.289   2.424
  279    H    CYS  42           HN       CYS  42   5.266   0.085  -4.465
  280    HA   CYS  42           HA       CYS  42   4.743   1.191  -7.151
  281   1HB   CYS  42          HB1       CYS  42   4.528  -1.352  -6.153
  282   2HB   CYS  42          HB2       CYS  42   2.906  -0.794  -5.983
  283    H    GLU  43           HN       GLU  43   2.560   1.980  -7.466
  284    HA   GLU  43           HA       GLU  43   1.603   3.707  -5.305
  285   1HB   GLU  43          HB1       GLU  43   2.240   4.127  -8.057
  286   2HB   GLU  43          HB2       GLU  43   0.506   4.115  -8.050
  287   1HG   GLU  43          HG1       GLU  43   0.808   6.364  -7.668
  288   2HG   GLU  43          HG2       GLU  43   0.860   5.798  -6.006
  289    H    THR  44           HN       THR  44   0.895   1.354  -4.759
  290    HA   THR  44           HA       THR  44  -1.713   0.679  -5.983
  291    HB   THR  44           HB       THR  44  -1.639  -1.325  -4.449
  292    HG1  THR  44           HG1      THR  44  -0.257   0.277  -3.112
  293   1HG2  THR  44          HG2       THR  44  -0.292  -1.361  -6.622
  294   2HG2  THR  44          HG2       THR  44   1.045  -0.643  -5.687
  295   3HG2  THR  44          HG2       THR  44   0.477  -2.305  -5.317
  Start of MODEL    6
    1   1H    ASP   1          HT1       ASP   1   0.703   0.564  -0.133
    2   2H    ASP   1          HT2       ASP   1   2.047  -0.393   0.341
    3   3H    ASP   1          HT3       ASP   1   2.136   1.303   0.382
    4    HA   ASP   1           HA       ASP   1   1.438   0.533  -2.223
    5   1HB   ASP   1          HB1       ASP   1   3.988   1.302  -2.515
    6   2HB   ASP   1          HB2       ASP   1   2.809   2.471  -1.963
    7    H    LYS   2           HN       LYS   2   2.565  -0.718  -3.660
    8    HA   LYS   2           HA       LYS   2   3.404  -3.259  -2.503
    9   1HB   LYS   2          HB1       LYS   2   1.822  -2.428  -4.839
   10   2HB   LYS   2          HB2       LYS   2   3.131  -3.439  -5.338
   11   1HG   LYS   2          HG1       LYS   2   1.028  -4.060  -3.207
   12   2HG   LYS   2          HG2       LYS   2   1.057  -4.715  -4.822
   13   1HD   LYS   2          HD1       LYS   2   3.383  -5.731  -4.318
   14   2HD   LYS   2          HD2       LYS   2   3.283  -5.152  -2.675
   15   1HE   LYS   2          HE1       LYS   2   1.254  -6.575  -2.306
   16   2HE   LYS   2          HE2       LYS   2   1.525  -7.282  -3.895
   17   1HZ   LYS   2          HZ1       LYS   2   2.797  -7.995  -1.482
   18   2HZ   LYS   2          HZ2       LYS   2   3.075  -8.604  -3.046
   19   3HZ   LYS   2          HZ3       LYS   2   3.957  -7.275  -2.490
   20    H    LEU   3           HN       LEU   3   5.434  -3.317  -2.152
   21    HA   LEU   3           HA       LEU   3   7.459  -1.810  -3.402
   22   1HB   LEU   3          HB1       LEU   3   7.626  -3.108  -1.191
   23   2HB   LEU   3          HB2       LEU   3   7.798  -4.576  -2.115
   24    HG   LEU   3           HG       LEU   3   9.753  -2.296  -2.704
   25   1HD1  LEU   3          HD1       LEU   3   9.742  -2.425  -0.299
   26   2HD1  LEU   3          HD1       LEU   3  10.025  -4.190  -0.344
   27   3HD1  LEU   3          HD1       LEU   3  11.266  -3.048  -0.969
   28   1HD2  LEU   3          HD2       LEU   3   9.871  -4.533  -3.940
   29   2HD2  LEU   3          HD2       LEU   3  11.326  -4.070  -3.013
   30   3HD2  LEU   3          HD2       LEU   3  10.167  -5.291  -2.368
   31    H    ILE   4           HN       ILE   4   9.149  -2.614  -4.748
   32    HA   ILE   4           HA       ILE   4   8.377  -4.804  -6.613
   33    HB   ILE   4           HB       ILE   4   8.696  -3.356  -8.557
   34   1HG1  ILE   4          HG1       ILE   4   9.370  -1.153  -6.544
   35   2HG1  ILE   4          HG1       ILE   4  10.453  -1.760  -7.788
   36   1HG2  ILE   4          HG2       ILE   4   6.836  -1.990  -8.407
   37   2HG2  ILE   4          HG2       ILE   4   6.556  -3.519  -7.544
   38   3HG2  ILE   4          HG2       ILE   4   6.865  -2.013  -6.618
   39   1HD1  ILE   4          HD1       ILE   4   7.871  -0.234  -8.137
   40   2HD1  ILE   4          HD2       ILE   4   9.510   0.278  -8.612
   41   3HD1  ILE   4          HD3       ILE   4   8.711  -1.048  -9.495
   42    H    GLY   5           HN       GLY   5  10.933  -2.585  -5.480
   43   1HA   GLY   5          HA1       GLY   5  12.828  -4.638  -5.088
   44   2HA   GLY   5          HA2       GLY   5  13.093  -3.967  -6.698
   45    H    SER   6           HN       SER   6  15.172  -3.098  -6.058
   46    HA   SER   6           HA       SER   6  15.166  -1.104  -3.976
   47   1HB   SER   6          HB1       SER   6  17.494  -1.966  -5.698
   48   2HB   SER   6          HB2       SER   6  17.420  -1.436  -4.028
   49    HG   SER   6           HG       SER   6  17.476  -3.793  -4.874
   50    H    CYS   7           HN       CYS   7  16.352   0.930  -4.542
   51    HA   CYS   7           HA       CYS   7  15.993   1.831  -7.370
   52   1HB   CYS   7          HB1       CYS   7  13.992   2.672  -6.179
   53   2HB   CYS   7          HB2       CYS   7  14.982   3.309  -4.878
   54    H    VAL   8           HN       VAL   8  18.312   0.976  -6.347
   55    HA   VAL   8           HA       VAL   8  19.880   3.465  -5.848
   56    HB   VAL   8           HB       VAL   8  20.509   0.626  -4.925
   57   1HG1  VAL   8          HG1       VAL   8  22.335   1.636  -3.646
   58   2HG1  VAL   8          HG1       VAL   8  22.542   1.923  -5.394
   59   3HG1  VAL   8          HG1       VAL   8  21.929   3.235  -4.339
   60   1HG2  VAL   8          HG2       VAL   8  19.697   3.070  -3.360
   61   2HG2  VAL   8          HG2       VAL   8  18.675   1.630  -3.673
   62   3HG2  VAL   8          HG2       VAL   8  20.131   1.482  -2.655
   63    H    TRP   9           HN       TRP   9  21.282   3.924  -7.366
   64    HA   TRP   9           HA       TRP   9  21.639   2.176  -9.679
   65   1HB   TRP   9          HB1       TRP   9  22.317   5.019  -8.948
   66   2HB   TRP   9          HB2       TRP   9  23.462   4.244 -10.017
   67    HD1  TRP   9           HD1      TRP   9  22.986   5.111 -12.360
   68    HE1  TRP   9           HE1      TRP   9  20.896   5.278 -13.726
   69    HE3  TRP   9           HE3      TRP   9  19.507   3.689  -8.976
   70    HZ2  TRP   9           HZ2      TRP   9  18.074   4.884 -13.542
   71    HZ3  TRP   9           HZ3      TRP   9  17.128   3.580  -9.577
   72    HH2  TRP   9           HH2      TRP   9  16.399   4.179 -11.865
   73    H    GLY  10           HN       GLY  10  22.410   0.528  -8.123
   74   1HA   GLY  10          HA1       GLY  10  24.812  -0.528  -8.447
   75   2HA   GLY  10          HA2       GLY  10  25.275   0.791  -7.379
   76    H    ALA  11           HN       ALA  11  22.690  -1.635  -7.500
   77    HA   ALA  11           HA       ALA  11  23.508  -2.786  -4.952
   78   1HB   ALA  11          HB1       ALA  11  22.159  -0.844  -4.255
   79   2HB   ALA  11          HB2       ALA  11  20.828  -1.418  -5.312
   80   3HB   ALA  11          HB3       ALA  11  21.301  -2.365  -3.874
   81    H    VAL  12           HN       VAL  12  21.719  -4.414  -4.325
   82    HA   VAL  12           HA       VAL  12  21.356  -6.177  -6.624
   83    HB   VAL  12           HB       VAL  12  20.271  -6.692  -3.854
   84   1HG1  VAL  12          HG1       VAL  12  19.757  -8.415  -5.424
   85   2HG1  VAL  12          HG1       VAL  12  21.493  -8.545  -5.887
   86   3HG1  VAL  12          HG1       VAL  12  20.943  -9.002  -4.246
   87   1HG2  VAL  12          HG2       VAL  12  23.168  -7.026  -4.697
   88   2HG2  VAL  12          HG2       VAL  12  22.564  -5.881  -3.459
   89   3HG2  VAL  12          HG2       VAL  12  22.458  -7.633  -3.168
   90    H    ASN  13           HN       ASN  13  19.201  -7.296  -6.733
   91    HA   ASN  13           HA       ASN  13  17.024  -7.049  -7.608
   92   1HB   ASN  13          HB1       ASN  13  15.863  -5.559  -5.390
   93   2HB   ASN  13          HB2       ASN  13  15.682  -7.251  -5.761
   94   1HD2  ASN  13          HD2       ASN  13  17.022  -5.067  -3.476
   95   2HD2  ASN  13          HD2       ASN  13  17.816  -6.252  -2.538
   96    H    TYR  14           HN       TYR  14  18.931  -4.998  -8.163
   97    HA   TYR  14           HA       TYR  14  18.020  -2.376  -8.008
   98   1HB   TYR  14          HB1       TYR  14  20.251  -2.948  -8.850
   99   2HB   TYR  14          HB2       TYR  14  19.568  -3.911 -10.151
  100    HD1  TYR  14           HD1      TYR  14  19.700  -2.971 -12.238
  101    HD2  TYR  14           HD2      TYR  14  19.220  -0.387  -8.883
  102    HE1  TYR  14           HE1      TYR  14  19.771  -1.026 -13.719
  103    HE2  TYR  14           HE2      TYR  14  19.285   1.542 -10.376
  104    HH   TYR  14           HH       TYR  14  18.971   1.257 -13.691
  105    H    THR  15           HN       THR  15  16.579  -1.120  -9.120
  106    HA   THR  15           HA       THR  15  14.577  -2.594 -10.684
  107    HB   THR  15           HB       THR  15  14.708   0.076  -9.246
  108    HG1  THR  15           HG1      THR  15  13.428  -2.435  -9.047
  109   1HG2  THR  15          HG2       THR  15  13.231   0.388 -11.269
  110   2HG2  THR  15          HG2       THR  15  12.303  -1.044 -10.722
  111   3HG2  THR  15          HG2       THR  15  12.383   0.418  -9.693
  112    H    SER  16           HN       SER  16  15.840   0.698 -11.089
  113    HA   SER  16           HA       SER  16  16.931   1.662 -12.933
  114   1HB   SER  16          HB1       SER  16  17.446  -0.953 -13.736
  115   2HB   SER  16          HB2       SER  16  16.206  -0.524 -14.907
  116    HG   SER  16           HG       SER  16  17.627   0.737 -15.835
  117    H    ASP  17           HN       ASP  17  13.981  -0.157 -13.309
  118    HA   ASP  17           HA       ASP  17  12.716   2.214 -14.555
  119   1HB   ASP  17          HB1       ASP  17  11.563   0.621 -16.138
  120   2HB   ASP  17          HB2       ASP  17  13.299   0.798 -16.349
  121    H    CYS  18           HN       CYS  18  12.067   2.396 -12.254
  122    HA   CYS  18           HA       CYS  18  10.556   0.624 -10.744
  123   1HB   CYS  18          HB1       CYS  18  11.273   3.163 -10.446
  124   2HB   CYS  18          HB2       CYS  18   9.681   3.542 -11.002
  125    H    ASN  19           HN       ASN  19   8.965   3.044 -12.758
  126    HA   ASN  19           HA       ASN  19   6.429   2.030 -12.878
  127   1HB   ASN  19          HB1       ASN  19   7.463   4.008 -14.224
  128   2HB   ASN  19          HB2       ASN  19   7.745   2.826 -15.492
  129   1HD2  ASN  19          HD2       ASN  19   5.664   1.270 -15.782
  130   2HD2  ASN  19          HD2       ASN  19   4.197   2.111 -15.868
  131    H    GLY  20           HN       GLY  20   9.228   0.804 -14.449
  132   1HA   GLY  20          HA1       GLY  20   7.922  -1.165 -16.122
  133   2HA   GLY  20          HA2       GLY  20   9.629  -1.125 -15.729
  134    H    GLU  21           HN       GLU  21   9.814  -1.471 -13.239
  135    HA   GLU  21           HA       GLU  21   9.367  -4.197 -12.675
  136   1HB   GLU  21          HB1       GLU  21  11.014  -2.532 -11.791
  137   2HB   GLU  21          HB2       GLU  21   9.793  -1.830 -10.827
  138   1HG   GLU  21          HG1       GLU  21  10.620  -3.166  -9.207
  139   2HG   GLU  21          HG2       GLU  21   9.679  -4.415  -9.857
  140    H    CYS  22           HN       CYS  22   7.523  -1.400 -11.985
  141    HA   CYS  22           HA       CYS  22   5.557  -2.679 -10.271
  142   1HB   CYS  22          HB1       CYS  22   5.884   0.006 -11.526
  143   2HB   CYS  22          HB2       CYS  22   4.271  -0.433 -11.138
  144    H    LEU  23           HN       LEU  23   5.679  -1.634 -13.699
  145    HA   LEU  23           HA       LEU  23   3.107  -2.513 -14.398
  146   1HB   LEU  23          HB1       LEU  23   5.708  -1.950 -15.800
  147   2HB   LEU  23          HB2       LEU  23   4.499  -2.800 -16.675
  148    HG   LEU  23           HG       LEU  23   4.069  -0.080 -15.359
  149   1HD1  LEU  23          HD1       LEU  23   5.744  -0.065 -17.213
  150   2HD1  LEU  23          HD1       LEU  23   4.546  -0.871 -18.262
  151   3HD1  LEU  23          HD1       LEU  23   4.245   0.795 -17.686
  152   1HD2  LEU  23          HD2       LEU  23   1.984  -1.338 -15.696
  153   2HD2  LEU  23          HD2       LEU  23   2.086   0.045 -16.812
  154   3HD2  LEU  23          HD2       LEU  23   2.436  -1.610 -17.406
  155    H    LEU  24           HN       LEU  24   6.200  -4.082 -14.006
  156    HA   LEU  24           HA       LEU  24   5.665  -6.497 -15.357
  157   1HB   LEU  24          HB1       LEU  24   7.675  -5.328 -13.616
  158   2HB   LEU  24          HB2       LEU  24   7.283  -6.890 -12.988
  159    HG   LEU  24           HG       LEU  24   7.966  -6.235 -15.873
  160   1HD1  LEU  24          HD1       LEU  24   9.730  -7.407 -13.682
  161   2HD1  LEU  24          HD1       LEU  24  10.180  -7.266 -15.409
  162   3HD1  LEU  24          HD1       LEU  24   9.887  -5.795 -14.446
  163   1HD2  LEU  24          HD2       LEU  24   6.692  -8.344 -15.609
  164   2HD2  LEU  24          HD2       LEU  24   8.369  -8.684 -16.115
  165   3HD2  LEU  24          HD2       LEU  24   7.890  -8.907 -14.404
  166    H    ARG  25           HN       ARG  25   4.933  -5.385 -12.282
  167    HA   ARG  25           HA       ARG  25   3.614  -7.906 -11.439
  168   1HB   ARG  25          HB1       ARG  25   4.472  -5.376 -10.036
  169   2HB   ARG  25          HB2       ARG  25   3.150  -6.293  -9.355
  170   1HG   ARG  25          HG1       ARG  25   4.521  -7.866  -8.448
  171   2HG   ARG  25          HG2       ARG  25   5.352  -8.123  -9.966
  172   1HD   ARG  25          HD1       ARG  25   5.986  -5.644  -8.364
  173   2HD   ARG  25          HD2       ARG  25   6.790  -7.081  -7.841
  174    HE   ARG  25           HE       ARG  25   6.993  -5.803 -10.513
  175   1HH1  ARG  25          HH1       ARG  25  10.285  -6.780 -10.692
  176   2HH1  ARG  25          HH1       ARG  25   9.173  -5.542 -10.950
  177   1HH2  ARG  25          HH2       ARG  25   9.331  -8.793  -9.501
  178   2HH2  ARG  25          HH2       ARG  25   7.665  -8.667  -9.021
  179    H    GLY  26           HN       GLY  26   2.729  -5.401 -13.275
  180   1HA   GLY  26          HA1       GLY  26   0.599  -4.901 -14.144
  181   2HA   GLY  26          HA2       GLY  26  -0.117  -5.970 -12.939
  182    H    TYR  27           HN       TYR  27   2.075  -3.779 -11.673
  183    HA   TYR  27           HA       TYR  27  -0.077  -2.330 -10.306
  184   1HB   TYR  27          HB1       TYR  27   2.945  -2.032 -10.140
  185   2HB   TYR  27          HB2       TYR  27   1.830  -1.240  -9.057
  186    HD1  TYR  27           HD1      TYR  27  -0.101  -3.693  -8.708
  187    HD2  TYR  27           HD2      TYR  27   4.142  -3.304  -8.527
  188    HE1  TYR  27           HE1      TYR  27   0.016  -5.580  -7.198
  189    HE2  TYR  27           HE2      TYR  27   4.246  -5.186  -6.995
  190    HH   TYR  27           HH       TYR  27   1.715  -7.287  -6.564
  191    H    LYS  28           HN       LYS  28   0.173   0.035 -10.042
  192    HA   LYS  28           HA       LYS  28   0.262   1.192 -12.733
  193   1HB   LYS  28          HB1       LYS  28  -0.573   2.355 -10.033
  194   2HB   LYS  28          HB2       LYS  28  -0.912   3.068 -11.599
  195   1HG   LYS  28          HG1       LYS  28  -2.753   1.707 -11.864
  196   2HG   LYS  28          HG2       LYS  28  -1.754   0.296 -11.828
  197   1HD   LYS  28          HD1       LYS  28  -3.246  -0.117 -10.052
  198   2HD   LYS  28          HD2       LYS  28  -1.831   0.472  -9.204
  199   1HE   LYS  28          HE1       LYS  28  -2.772   2.744  -9.087
  200   2HE   LYS  28          HE2       LYS  28  -4.108   2.312 -10.145
  201   1HZ   LYS  28          HZ1       LYS  28  -5.244   1.605  -8.380
  202   2HZ   LYS  28          HZ2       LYS  28  -4.005   0.562  -7.874
  203   3HZ   LYS  28          HZ3       LYS  28  -3.999   2.176  -7.429
  204    H    GLY  29           HN       GLY  29   1.266   3.250 -13.035
  205   1HA   GLY  29          HA1       GLY  29   3.938   3.331 -12.974
  206   2HA   GLY  29          HA2       GLY  29   3.019   4.823 -12.787
  207    H    GLY  30           HN       GLY  30   5.121   2.614 -11.331
  208   1HA   GLY  30          HA1       GLY  30   4.635   3.427  -8.578
  209   2HA   GLY  30          HA2       GLY  30   5.942   2.379  -9.139
  210    H    HIS  31           HN       HIS  31   7.041   3.702  -7.509
  211    HA   HIS  31           HA       HIS  31   8.648   5.708  -8.848
  212   1HB   HIS  31          HB1       HIS  31   8.024   7.610  -7.278
  213   2HB   HIS  31          HB2       HIS  31   6.549   7.006  -8.034
  214    HD1  HIS  31           HD1      HIS  31   5.353   5.065  -6.600
  215    HD2  HIS  31           HD2      HIS  31   7.918   7.361  -4.319
  216    HE1  HIS  31           HE1      HIS  31   4.754   4.600  -4.236
  217    HE2  HIS  31           HE2      HIS  31   6.333   6.032  -2.917
  218    H    CYS  32           HN       CYS  32  10.123   6.788  -7.075
  219    HA   CYS  32           HA       CYS  32  11.131   4.564  -5.398
  220   1HB   CYS  32          HB1       CYS  32  12.401   7.160  -6.311
  221   2HB   CYS  32          HB2       CYS  32  13.145   6.013  -5.222
  222    H    GLY  33           HN       GLY  33  11.548   4.890  -3.246
  223   1HA   GLY  33          HA1       GLY  33   9.657   6.214  -1.740
  224   2HA   GLY  33          HA2       GLY  33  11.209   5.749  -1.103
  225    H    SER  34           HN       SER  34   9.539   8.140  -0.639
  226    HA   SER  34           HA       SER  34  11.191  10.301  -1.800
  227   1HB   SER  34          HB1       SER  34   8.617  10.476  -1.680
  228   2HB   SER  34          HB2       SER  34   8.752  10.611   0.075
  229    HG   SER  34           HG       SER  34  10.544  12.270  -1.080
  230    H    PHE  35           HN       PHE  35   9.986   9.594   1.491
  231    HA   PHE  35           HA       PHE  35  12.478  10.824   2.564
  232   1HB   PHE  35          HB1       PHE  35   9.960  11.330   3.333
  233   2HB   PHE  35          HB2       PHE  35  10.140   9.840   4.240
  234    HD1  PHE  35           HD1      PHE  35  11.898   9.701   6.085
  235    HD2  PHE  35           HD2      PHE  35  11.088  13.338   4.009
  236    HE1  PHE  35           HE1      PHE  35  13.050  10.964   7.836
  237    HE2  PHE  35           HE2      PHE  35  12.242  14.592   5.768
  238    HZ   PHE  35           HZ       PHE  35  13.228  13.412   7.687
  239    H    ALA  36           HN       ALA  36  12.155   8.129   1.287
  240    HA   ALA  36           HA       ALA  36  13.930   6.776   2.987
  241   1HB   ALA  36          HB1       ALA  36  11.804   6.213   4.150
  242   2HB   ALA  36          HB2       ALA  36  11.127   5.634   2.596
  243   3HB   ALA  36          HB3       ALA  36  12.481   4.757   3.358
  244    H    ASN  37           HN       ASN  37  14.428   7.550   0.616
  245    HA   ASN  37           HA       ASN  37  13.681   5.959  -1.586
  246   1HB   ASN  37          HB1       ASN  37  14.810   8.319  -1.502
  247   2HB   ASN  37          HB2       ASN  37  16.326   7.477  -1.211
  248   1HD2  ASN  37          HD2       ASN  37  13.687   7.895  -3.508
  249   2HD2  ASN  37          HD2       ASN  37  14.596   7.417  -4.881
  250    H    VAL  38           HN       VAL  38  16.280   5.278  -2.498
  251    HA   VAL  38           HA       VAL  38  17.844   3.584  -2.541
  252    HB   VAL  38           HB       VAL  38  18.711   2.603  -0.687
  253   1HG1  VAL  38          HG1       VAL  38  19.086   4.864  -0.373
  254   2HG1  VAL  38          HG1       VAL  38  17.557   5.063   0.541
  255   3HG1  VAL  38          HG1       VAL  38  18.890   4.099   1.232
  256   1HG2  VAL  38          HG2       VAL  38  16.200   2.486   0.918
  257   2HG2  VAL  38          HG2       VAL  38  17.126   1.184   0.114
  258   3HG2  VAL  38          HG2       VAL  38  17.839   2.083   1.485
  259    H    ASN  39           HN       ASN  39  14.621   3.354  -2.216
  260    HA   ASN  39           HA       ASN  39  14.559   0.663  -3.320
  261   1HB   ASN  39          HB1       ASN  39  13.291   1.387  -0.659
  262   2HB   ASN  39          HB2       ASN  39  12.457   0.320  -1.709
  263   1HD2  ASN  39          HD2       ASN  39  14.744   0.404   0.787
  264   2HD2  ASN  39          HD2       ASN  39  15.422  -1.130   0.495
  265    H    CYS  40           HN       CYS  40  12.575   0.176  -4.400
  266    HA   CYS  40           HA       CYS  40  11.047   2.644  -5.070
  267   1HB   CYS  40          HB1       CYS  40  12.397   0.732  -6.768
  268   2HB   CYS  40          HB2       CYS  40  10.684   0.546  -6.983
  269    H    TRP  41           HN       TRP  41   8.839   2.422  -5.306
  270    HA   TRP  41           HA       TRP  41   7.564  -0.039  -4.312
  271   1HB   TRP  41          HB1       TRP  41   6.938   2.688  -3.111
  272   2HB   TRP  41          HB2       TRP  41   6.279   1.156  -2.627
  273    HD1  TRP  41           HD1      TRP  41   9.751   3.030  -2.519
  274    HE1  TRP  41           HE1      TRP  41  10.898   2.070  -0.491
  275    HE3  TRP  41           HE3      TRP  41   6.474  -0.488  -1.283
  276    HZ2  TRP  41           HZ2      TRP  41  10.475  -0.030   1.560
  277    HZ3  TRP  41           HZ3      TRP  41   6.713  -1.931   0.617
  278    HH2  TRP  41           HH2      TRP  41   8.763  -1.728   2.099
  279    H    CYS  42           HN       CYS  42   5.244  -0.067  -4.741
  280    HA   CYS  42           HA       CYS  42   4.700   1.567  -7.150
  281   1HB   CYS  42          HB1       CYS  42   3.250  -0.831  -5.996
  282   2HB   CYS  42          HB2       CYS  42   2.684   0.058  -7.388
  283    H    GLU  43           HN       GLU  43   2.119   1.950  -7.206
  284    HA   GLU  43           HA       GLU  43   1.240   3.160  -4.672
  285   1HB   GLU  43          HB1       GLU  43   0.822   5.343  -5.968
  286   2HB   GLU  43          HB2       GLU  43   2.489   4.993  -5.597
  287   1HG   GLU  43          HG1       GLU  43   2.497   3.903  -8.047
  288   2HG   GLU  43          HG2       GLU  43   1.065   4.884  -8.261
  289    H    THR  44           HN       THR  44  -0.083   1.337  -4.911
  290    HA   THR  44           HA       THR  44  -2.139   1.266  -6.929
  291    HB   THR  44           HB       THR  44  -2.691  -0.874  -5.517
  292    HG1  THR  44           HG1      THR  44  -1.968   0.411  -3.684
  293   1HG2  THR  44          HG2       THR  44  -0.541  -1.987  -5.756
  294   2HG2  THR  44          HG2       THR  44  -0.658  -0.914  -7.178
  295   3HG2  THR  44          HG2       THR  44   0.341  -0.432  -5.775
  Start of MODEL    7
    1   1H    ASP   1          HT1       ASP   1   0.538   0.807  -0.362
    2   2H    ASP   1          HT2       ASP   1   1.699  -0.347   0.165
    3   3H    ASP   1          HT3       ASP   1   2.012   1.336   0.247
    4    HA   ASP   1           HA       ASP   1   1.369   0.740  -2.388
    5   1HB   ASP   1          HB1       ASP   1   4.105   1.228  -1.101
    6   2HB   ASP   1          HB2       ASP   1   3.693   1.524  -2.776
    7    H    LYS   2           HN       LYS   2   2.711  -0.670  -3.826
    8    HA   LYS   2           HA       LYS   2   3.432  -3.215  -2.477
    9   1HB   LYS   2          HB1       LYS   2   1.793  -2.582  -4.813
   10   2HB   LYS   2          HB2       LYS   2   3.174  -3.505  -5.283
   11   1HG   LYS   2          HG1       LYS   2   1.388  -4.284  -2.898
   12   2HG   LYS   2          HG2       LYS   2   1.060  -4.856  -4.523
   13   1HD   LYS   2          HD1       LYS   2   2.732  -6.437  -4.460
   14   2HD   LYS   2          HD2       LYS   2   3.900  -5.329  -3.817
   15   1HE   LYS   2          HE1       LYS   2   3.474  -7.281  -2.343
   16   2HE   LYS   2          HE2       LYS   2   3.085  -5.774  -1.536
   17   1HZ   LYS   2          HZ1       LYS   2   1.392  -7.981  -2.070
   18   2HZ   LYS   2          HZ2       LYS   2   1.046  -6.600  -1.151
   19   3HZ   LYS   2          HZ3       LYS   2   0.762  -6.621  -2.834
   20    H    LEU   3           HN       LEU   3   5.450  -3.289  -2.176
   21    HA   LEU   3           HA       LEU   3   7.470  -1.749  -3.467
   22   1HB   LEU   3          HB1       LEU   3   7.570  -2.800  -1.158
   23   2HB   LEU   3          HB2       LEU   3   7.778  -4.364  -1.908
   24    HG   LEU   3           HG       LEU   3   9.777  -2.188  -2.648
   25   1HD1  LEU   3          HD1       LEU   3  11.122  -2.733  -0.695
   26   2HD1  LEU   3          HD1       LEU   3   9.560  -2.014  -0.243
   27   3HD1  LEU   3          HD1       LEU   3   9.802  -3.776  -0.058
   28   1HD2  LEU   3          HD2       LEU   3   9.910  -4.522  -3.616
   29   2HD2  LEU   3          HD2       LEU   3  11.324  -4.026  -2.646
   30   3HD2  LEU   3          HD2       LEU   3  10.086  -5.131  -1.955
   31    H    ILE   4           HN       ILE   4   9.208  -2.578  -4.676
   32    HA   ILE   4           HA       ILE   4   8.570  -4.923  -6.421
   33    HB   ILE   4           HB       ILE   4   9.454  -3.639  -8.406
   34   1HG1  ILE   4          HG1       ILE   4   9.030  -1.082  -6.774
   35   2HG1  ILE   4          HG1       ILE   4  10.620  -1.790  -6.957
   36   1HG2  ILE   4          HG2       ILE   4   7.069  -2.427  -6.984
   37   2HG2  ILE   4          HG2       ILE   4   7.380  -2.336  -8.746
   38   3HG2  ILE   4          HG2       ILE   4   7.056  -3.914  -7.972
   39   1HD1  ILE   4          HD1       ILE   4   8.870  -1.034  -9.290
   40   2HD1  ILE   4          HD2       ILE   4  10.237  -0.111  -8.637
   41   3HD1  ILE   4          HD3       ILE   4  10.538  -1.728  -9.316
   42    H    GLY   5           HN       GLY   5  11.010  -2.618  -5.365
   43   1HA   GLY   5          HA1       GLY   5  12.942  -4.597  -4.744
   44   2HA   GLY   5          HA2       GLY   5  13.284  -3.986  -6.362
   45    H    SER   6           HN       SER   6  15.258  -2.965  -5.734
   46    HA   SER   6           HA       SER   6  15.100  -0.879  -3.723
   47   1HB   SER   6          HB1       SER   6  17.497  -1.939  -5.227
   48   2HB   SER   6          HB2       SER   6  17.381  -1.172  -3.654
   49    HG   SER   6           HG       SER   6  17.430  -3.591  -4.070
   50    H    CYS   7           HN       CYS   7  16.417   1.072  -4.324
   51    HA   CYS   7           HA       CYS   7  16.187   1.878  -7.187
   52   1HB   CYS   7          HB1       CYS   7  14.183   2.823  -6.168
   53   2HB   CYS   7          HB2       CYS   7  15.054   3.357  -4.751
   54    H    VAL   8           HN       VAL   8  18.486   1.009  -6.175
   55    HA   VAL   8           HA       VAL   8  20.067   3.494  -5.753
   56    HB   VAL   8           HB       VAL   8  20.718   0.796  -4.515
   57   1HG1  VAL   8          HG1       VAL   8  21.775   3.561  -3.912
   58   2HG1  VAL   8          HG1       VAL   8  22.231   2.051  -3.068
   59   3HG1  VAL   8          HG1       VAL   8  22.645   2.265  -4.790
   60   1HG2  VAL   8          HG2       VAL   8  20.003   1.705  -2.379
   61   2HG2  VAL   8          HG2       VAL   8  19.344   3.140  -3.239
   62   3HG2  VAL   8          HG2       VAL   8  18.663   1.511  -3.540
   63    H    TRP   9           HN       TRP   9  21.636   3.693  -7.181
   64    HA   TRP   9           HA       TRP   9  22.096   1.625  -9.202
   65   1HB   TRP   9          HB1       TRP   9  22.916   4.527  -8.805
   66   2HB   TRP   9          HB2       TRP   9  23.955   3.533  -9.808
   67    HD1  TRP   9           HD1      TRP   9  23.254   3.360 -12.304
   68    HE1  TRP   9           HE1      TRP   9  21.062   3.693 -13.464
   69    HE3  TRP   9           HE3      TRP   9  20.295   4.264  -8.359
   70    HZ2  TRP   9           HZ2      TRP   9  18.264   4.252 -12.850
   71    HZ3  TRP   9           HZ3      TRP   9  17.881   4.689  -8.602
   72    HH2  TRP   9           HH2      TRP   9  16.866   4.680 -10.871
   73    H    GLY  10           HN       GLY  10  22.642   0.329  -7.168
   74   1HA   GLY  10          HA1       GLY  10  25.097  -0.768  -7.236
   75   2HA   GLY  10          HA2       GLY  10  25.387   0.653  -6.232
   76    H    ALA  11           HN       ALA  11  22.997  -1.958  -6.507
   77    HA   ALA  11           HA       ALA  11  23.441  -2.903  -3.826
   78   1HB   ALA  11          HB1       ALA  11  20.870  -1.421  -4.458
   79   2HB   ALA  11          HB2       ALA  11  21.198  -2.310  -2.943
   80   3HB   ALA  11          HB3       ALA  11  22.152  -0.853  -3.343
   81    H    VAL  12           HN       VAL  12  21.437  -4.347  -3.273
   82    HA   VAL  12           HA       VAL  12  21.227  -6.262  -5.472
   83    HB   VAL  12           HB       VAL  12  19.724  -6.512  -2.879
   84   1HG1  VAL  12          HG1       VAL  12  21.160  -8.552  -4.555
   85   2HG1  VAL  12          HG1       VAL  12  20.317  -8.871  -3.010
   86   3HG1  VAL  12          HG1       VAL  12  19.385  -8.312  -4.413
   87   1HG2  VAL  12          HG2       VAL  12  21.712  -7.492  -1.769
   88   2HG2  VAL  12          HG2       VAL  12  22.701  -7.011  -3.182
   89   3HG2  VAL  12          HG2       VAL  12  21.939  -5.766  -2.142
   90    H    ASN  13           HN       ASN  13  19.073  -7.214  -5.872
   91    HA   ASN  13           HA       ASN  13  17.029  -6.872  -7.028
   92   1HB   ASN  13          HB1       ASN  13  16.032  -5.240  -4.773
   93   2HB   ASN  13          HB2       ASN  13  15.331  -6.675  -5.473
   94   1HD2  ASN  13          HD2       ASN  13  17.129  -5.484  -2.897
   95   2HD2  ASN  13          HD2       ASN  13  17.553  -6.966  -2.155
   96    H    TYR  14           HN       TYR  14  19.130  -4.917  -7.358
   97    HA   TYR  14           HA       TYR  14  18.256  -2.243  -7.389
   98   1HB   TYR  14          HB1       TYR  14  20.577  -2.687  -7.672
   99   2HB   TYR  14          HB2       TYR  14  20.299  -3.865  -8.932
  100    HD1  TYR  14           HD1      TYR  14  19.292  -0.232  -8.565
  101    HD2  TYR  14           HD2      TYR  14  21.299  -3.198 -10.868
  102    HE1  TYR  14           HE1      TYR  14  19.792   1.431 -10.262
  103    HE2  TYR  14           HE2      TYR  14  21.813  -1.516 -12.570
  104    HH   TYR  14           HH       TYR  14  20.962   1.862 -12.106
  105    H    THR  15           HN       THR  15  17.004  -1.110  -8.705
  106    HA   THR  15           HA       THR  15  15.815  -2.476 -11.064
  107    HB   THR  15           HB       THR  15  14.645  -1.400  -8.607
  108    HG1  THR  15           HG1      THR  15  13.532  -2.531 -10.928
  109   1HG2  THR  15          HG2       THR  15  13.338  -0.275 -11.108
  110   2HG2  THR  15          HG2       THR  15  12.749  -0.229  -9.423
  111   3HG2  THR  15          HG2       THR  15  14.205   0.698  -9.870
  112    H    SER  16           HN       SER  16  14.719  -0.740 -12.459
  113    HA   SER  16           HA       SER  16  16.455   1.667 -12.795
  114   1HB   SER  16          HB1       SER  16  17.339  -0.337 -14.235
  115   2HB   SER  16          HB2       SER  16  15.850  -0.167 -15.174
  116    HG   SER  16           HG       SER  16  18.057   1.332 -15.278
  117    H    ASP  17           HN       ASP  17  13.728  -0.162 -14.111
  118    HA   ASP  17           HA       ASP  17  12.300   2.407 -14.608
  119   1HB   ASP  17          HB1       ASP  17  10.977   0.979 -16.222
  120   2HB   ASP  17          HB2       ASP  17  12.654   1.229 -16.668
  121    H    CYS  18           HN       CYS  18  11.991   2.263 -12.273
  122    HA   CYS  18           HA       CYS  18  10.574   0.412 -10.798
  123   1HB   CYS  18          HB1       CYS  18  11.362   2.890 -10.237
  124   2HB   CYS  18          HB2       CYS  18   9.775   3.349 -10.746
  125    H    ASN  19           HN       ASN  19   9.302   2.673 -13.141
  126    HA   ASN  19           HA       ASN  19   6.542   2.009 -12.886
  127   1HB   ASN  19          HB1       ASN  19   7.427   3.958 -14.216
  128   2HB   ASN  19          HB2       ASN  19   7.988   2.839 -15.441
  129   1HD2  ASN  19          HD2       ASN  19   5.132   1.342 -14.499
  130   2HD2  ASN  19          HD2       ASN  19   4.091   2.177 -15.542
  131    H    GLY  20           HN       GLY  20   9.015   0.800 -15.090
  132   1HA   GLY  20          HA1       GLY  20   7.350  -1.136 -16.379
  133   2HA   GLY  20          HA2       GLY  20   9.094  -1.194 -16.381
  134    H    GLU  21           HN       GLU  21   9.776  -1.579 -13.903
  135    HA   GLU  21           HA       GLU  21   9.330  -4.271 -13.270
  136   1HB   GLU  21          HB1       GLU  21  10.497  -1.953 -11.865
  137   2HB   GLU  21          HB2       GLU  21   9.679  -2.991 -10.731
  138   1HG   GLU  21          HG1       GLU  21  11.793  -3.908 -10.726
  139   2HG   GLU  21          HG2       GLU  21  11.039  -4.907 -11.934
  140    H    CYS  22           HN       CYS  22   7.470  -1.454 -12.365
  141    HA   CYS  22           HA       CYS  22   5.813  -2.845 -10.457
  142   1HB   CYS  22          HB1       CYS  22   5.841  -0.116 -11.705
  143   2HB   CYS  22          HB2       CYS  22   4.343  -0.659 -11.063
  144    H    LEU  23           HN       LEU  23   5.547  -1.785 -13.846
  145    HA   LEU  23           HA       LEU  23   2.916  -2.705 -14.249
  146   1HB   LEU  23          HB1       LEU  23   5.340  -2.158 -15.957
  147   2HB   LEU  23          HB2       LEU  23   3.902  -2.793 -16.655
  148    HG   LEU  23           HG       LEU  23   3.995  -0.232 -14.984
  149   1HD1  LEU  23          HD1       LEU  23   5.367  -0.006 -17.012
  150   2HD1  LEU  23          HD1       LEU  23   4.001  -0.600 -18.007
  151   3HD1  LEU  23          HD1       LEU  23   3.882   0.973 -17.164
  152   1HD2  LEU  23          HD2       LEU  23   1.913  -1.263 -16.922
  153   2HD2  LEU  23          HD2       LEU  23   1.754  -1.207 -15.142
  154   3HD2  LEU  23          HD2       LEU  23   1.850   0.312 -16.071
  155    H    LEU  24           HN       LEU  24   6.038  -4.213 -14.233
  156    HA   LEU  24           HA       LEU  24   5.368  -6.642 -15.535
  157   1HB   LEU  24          HB1       LEU  24   7.548  -5.438 -14.047
  158   2HB   LEU  24          HB2       LEU  24   7.320  -7.033 -13.451
  159    HG   LEU  24           HG       LEU  24   7.654  -6.192 -16.371
  160   1HD1  LEU  24          HD1       LEU  24   9.633  -7.490 -14.461
  161   2HD1  LEU  24          HD1       LEU  24   9.923  -7.167 -16.196
  162   3HD1  LEU  24          HD1       LEU  24   9.695  -5.806 -15.068
  163   1HD2  LEU  24          HD2       LEU  24   8.078  -8.585 -16.837
  164   2HD2  LEU  24          HD2       LEU  24   7.781  -8.961 -15.111
  165   3HD2  LEU  24          HD2       LEU  24   6.454  -8.345 -16.142
  166    H    ARG  25           HN       ARG  25   4.976  -5.516 -12.421
  167    HA   ARG  25           HA       ARG  25   3.851  -8.047 -11.356
  168   1HB   ARG  25          HB1       ARG  25   4.992  -5.508 -10.221
  169   2HB   ARG  25          HB2       ARG  25   3.699  -6.216  -9.273
  170   1HG   ARG  25          HG1       ARG  25   4.956  -8.063  -8.650
  171   2HG   ARG  25          HG2       ARG  25   5.724  -8.192 -10.210
  172   1HD   ARG  25          HD1       ARG  25   6.474  -6.006  -8.226
  173   2HD   ARG  25          HD2       ARG  25   7.360  -7.505  -8.193
  174    HE   ARG  25           HE       ARG  25   7.412  -5.494 -10.344
  175   1HH1  ARG  25          HH1       ARG  25  10.324  -6.919 -11.412
  176   2HH1  ARG  25          HH1       ARG  25   9.623  -5.458 -10.817
  177   1HH2  ARG  25          HH2       ARG  25   9.108  -8.967 -10.997
  178   2HH2  ARG  25          HH2       ARG  25   7.579  -8.794 -10.223
  179    H    GLY  26           HN       GLY  26   2.706  -5.561 -13.098
  180   1HA   GLY  26          HA1       GLY  26   0.454  -5.224 -13.769
  181   2HA   GLY  26          HA2       GLY  26  -0.088  -6.171 -12.384
  182    H    TYR  27           HN       TYR  27   2.198  -3.976 -11.435
  183    HA   TYR  27           HA       TYR  27   0.142  -2.311 -10.159
  184   1HB   TYR  27          HB1       TYR  27   3.186  -2.395  -9.914
  185   2HB   TYR  27          HB2       TYR  27   2.117  -1.485  -8.863
  186    HD1  TYR  27           HD1      TYR  27   3.887  -3.501  -7.688
  187    HD2  TYR  27           HD2      TYR  27  -0.036  -4.070  -9.272
  188    HE1  TYR  27           HE1      TYR  27   3.564  -5.473  -6.291
  189    HE2  TYR  27           HE2      TYR  27  -0.337  -5.987  -7.896
  190    HH   TYR  27           HH       TYR  27   1.264  -7.731  -6.804
  191    H    LYS  28           HN       LYS  28   0.417   0.014 -10.072
  192    HA   LYS  28           HA       LYS  28   0.699   0.955 -12.832
  193   1HB   LYS  28          HB1       LYS  28  -0.187   3.152 -11.776
  194   2HB   LYS  28          HB2       LYS  28  -1.277   1.787 -11.821
  195   1HG   LYS  28          HG1       LYS  28   0.475   2.146  -9.395
  196   2HG   LYS  28          HG2       LYS  28  -0.805   3.296  -9.599
  197   1HD   LYS  28          HD1       LYS  28  -1.760   0.489  -9.990
  198   2HD   LYS  28          HD2       LYS  28  -1.026   0.708  -8.430
  199   1HE   LYS  28          HE1       LYS  28  -3.498   1.239  -8.390
  200   2HE   LYS  28          HE2       LYS  28  -2.543   2.642  -7.943
  201   1HZ   LYS  28          HZ1       LYS  28  -3.374   3.745  -9.576
  202   2HZ   LYS  28          HZ2       LYS  28  -2.752   2.668 -10.703
  203   3HZ   LYS  28          HZ3       LYS  28  -4.336   2.434 -10.092
  204    H    GLY  29           HN       GLY  29   1.705   3.000 -13.197
  205   1HA   GLY  29          HA1       GLY  29   4.380   3.126 -13.080
  206   2HA   GLY  29          HA2       GLY  29   3.432   4.606 -12.955
  207    H    GLY  30           HN       GLY  30   5.416   2.337 -11.294
  208   1HA   GLY  30          HA1       GLY  30   4.839   3.316  -8.624
  209   2HA   GLY  30          HA2       GLY  30   6.168   2.239  -9.097
  210    H    HIS  31           HN       HIS  31   7.232   3.644  -7.482
  211    HA   HIS  31           HA       HIS  31   8.886   5.566  -8.878
  212   1HB   HIS  31          HB1       HIS  31   8.303   7.456  -7.207
  213   2HB   HIS  31          HB2       HIS  31   7.011   7.080  -8.342
  214    HD1  HIS  31           HD1      HIS  31   4.846   6.652  -7.223
  215    HD2  HIS  31           HD2      HIS  31   7.901   5.777  -4.532
  216    HE1  HIS  31           HE1      HIS  31   3.734   5.977  -5.124
  217    HE2  HIS  31           HE2      HIS  31   5.563   5.456  -3.546
  218    H    CYS  32           HN       CYS  32  10.453   6.608  -7.244
  219    HA   CYS  32           HA       CYS  32  11.461   4.437  -5.585
  220   1HB   CYS  32          HB1       CYS  32  12.486   7.215  -6.274
  221   2HB   CYS  32          HB2       CYS  32  13.298   6.139  -5.165
  222    H    GLY  33           HN       GLY  33  11.777   4.621  -3.346
  223   1HA   GLY  33          HA1       GLY  33   9.813   5.309  -1.710
  224   2HA   GLY  33          HA2       GLY  33  11.439   5.542  -1.194
  225    H    SER  34           HN       SER  34  12.338   7.651  -1.381
  226    HA   SER  34           HA       SER  34  10.525   9.874  -2.031
  227   1HB   SER  34          HB1       SER  34  11.071  10.831   0.325
  228   2HB   SER  34          HB2       SER  34  10.020   9.400   0.336
  229    HG   SER  34           HG       SER  34  12.288   9.532   1.520
  230    H    PHE  35           HN       PHE  35  13.558   9.160  -0.443
  231    HA   PHE  35           HA       PHE  35  15.230  10.324  -2.445
  232   1HB   PHE  35          HB1       PHE  35  14.022  12.300  -1.237
  233   2HB   PHE  35          HB2       PHE  35  15.071  11.943   0.109
  234    HD1  PHE  35           HD1      PHE  35  17.654  11.891  -0.328
  235    HD2  PHE  35           HD2      PHE  35  14.857  13.612  -3.050
  236    HE1  PHE  35           HE1      PHE  35  19.462  13.141  -1.401
  237    HE2  PHE  35           HE2      PHE  35  16.677  14.868  -4.117
  238    HZ   PHE  35           HZ       PHE  35  18.983  14.634  -3.295
  239    H    ALA  36           HN       ALA  36  16.131   8.383  -2.091
  240    HA   ALA  36           HA       ALA  36  18.086   7.211  -1.494
  241   1HB   ALA  36          HB1       ALA  36  19.356   7.703   0.491
  242   2HB   ALA  36          HB2       ALA  36  19.045   9.232  -0.392
  243   3HB   ALA  36          HB3       ALA  36  18.125   8.824   1.098
  244    H    ASN  37           HN       ASN  37  15.357   6.662  -1.000
  245    HA   ASN  37           HA       ASN  37  15.133   5.380   1.564
  246   1HB   ASN  37          HB1       ASN  37  13.196   6.384   0.294
  247   2HB   ASN  37          HB2       ASN  37  13.385   5.083  -0.893
  248   1HD2  ASN  37          HD2       ASN  37  11.869   3.430  -0.489
  249   2HD2  ASN  37          HD2       ASN  37  11.332   3.046   1.091
  250    H    VAL  38           HN       VAL  38  16.651   4.711  -1.258
  251    HA   VAL  38           HA       VAL  38  17.376   2.842  -2.370
  252    HB   VAL  38           HB       VAL  38  18.598   1.303  -0.892
  253   1HG1  VAL  38          HG1       VAL  38  19.967   2.943   0.426
  254   2HG1  VAL  38          HG1       VAL  38  19.591   3.564  -1.205
  255   3HG1  VAL  38          HG1       VAL  38  18.657   4.141   0.204
  256   1HG2  VAL  38          HG2       VAL  38  17.245   2.557   1.491
  257   2HG2  VAL  38          HG2       VAL  38  17.009   0.896   0.852
  258   3HG2  VAL  38          HG2       VAL  38  18.591   1.381   1.515
  259    H    ASN  39           HN       ASN  39  14.549   2.912  -1.831
  260    HA   ASN  39           HA       ASN  39  13.934   0.127  -2.420
  261   1HB   ASN  39          HB1       ASN  39  12.680   1.531  -0.013
  262   2HB   ASN  39          HB2       ASN  39  12.074   0.172  -0.883
  263   1HD2  ASN  39          HD2       ASN  39  14.676   1.184   1.263
  264   2HD2  ASN  39          HD2       ASN  39  15.174  -0.400   1.642
  265    H    CYS  40           HN       CYS  40  12.504   0.082  -4.025
  266    HA   CYS  40           HA       CYS  40  11.051   2.603  -4.667
  267   1HB   CYS  40          HB1       CYS  40  12.581   0.898  -6.326
  268   2HB   CYS  40          HB2       CYS  40  10.950   0.416  -6.675
  269    H    TRP  41           HN       TRP  41   8.931   2.619  -4.745
  270    HA   TRP  41           HA       TRP  41   7.444   0.139  -4.032
  271   1HB   TRP  41          HB1       TRP  41   7.033   2.928  -2.898
  272   2HB   TRP  41          HB2       TRP  41   5.902   1.612  -2.737
  273    HD1  TRP  41           HD1      TRP  41   9.621   2.482  -1.792
  274    HE1  TRP  41           HE1      TRP  41  10.083   1.098   0.246
  275    HE3  TRP  41           HE3      TRP  41   5.395  -0.160  -1.546
  276    HZ2  TRP  41           HZ2      TRP  41   8.820  -0.942   1.916
  277    HZ3  TRP  41           HZ3      TRP  41   4.979  -1.801   0.226
  278    HH2  TRP  41           HH2      TRP  41   6.703  -2.206   1.973
  279    H    CYS  42           HN       CYS  42   5.321  -0.012  -4.885
  280    HA   CYS  42           HA       CYS  42   5.112   1.455  -7.388
  281   1HB   CYS  42          HB1       CYS  42   3.450  -0.760  -6.193
  282   2HB   CYS  42          HB2       CYS  42   3.028   0.058  -7.687
  283    H    GLU  43           HN       GLU  43   3.055   2.446  -7.972
  284    HA   GLU  43           HA       GLU  43   2.111   4.172  -5.757
  285   1HB   GLU  43          HB1       GLU  43   3.220   4.937  -8.061
  286   2HB   GLU  43          HB2       GLU  43   1.681   4.542  -8.757
  287   1HG   GLU  43          HG1       GLU  43   0.578   6.344  -7.677
  288   2HG   GLU  43          HG2       GLU  43   1.835   6.533  -6.469
  289    H    THR  44           HN       THR  44   1.168   1.880  -5.394
  290    HA   THR  44           HA       THR  44  -1.485   1.599  -6.662
  291    HB   THR  44           HB       THR  44  -0.278  -0.554  -6.479
  292    HG1  THR  44           HG1      THR  44  -2.540   0.085  -5.021
  293   1HG2  THR  44          HG2       THR  44   1.030  -0.005  -4.388
  294   2HG2  THR  44          HG2       THR  44  -0.503  -0.127  -3.472
  295   3HG2  THR  44          HG2       THR  44   0.138  -1.564  -4.305
  Start of MODEL    8
    1   1H    ASP   1          HT1       ASP   1   0.506   0.294  -0.019
    2   2H    ASP   1          HT2       ASP   1   1.881  -0.633   0.449
    3   3H    ASP   1          HT3       ASP   1   1.954   1.036   0.505
    4    HA   ASP   1           HA       ASP   1   1.329   0.308  -2.119
    5   1HB   ASP   1          HB1       ASP   1   3.811   1.126  -2.410
    6   2HB   ASP   1          HB2       ASP   1   2.617   2.257  -1.862
    7    H    LYS   2           HN       LYS   2   2.584  -0.964  -3.539
    8    HA   LYS   2           HA       LYS   2   3.578  -3.453  -2.325
    9   1HB   LYS   2          HB1       LYS   2   2.271  -2.584  -4.833
   10   2HB   LYS   2          HB2       LYS   2   3.437  -3.796  -5.055
   11   1HG   LYS   2          HG1       LYS   2   0.957  -3.879  -3.251
   12   2HG   LYS   2          HG2       LYS   2   1.151  -4.774  -4.742
   13   1HD   LYS   2          HD1       LYS   2   3.212  -5.925  -3.568
   14   2HD   LYS   2          HD2       LYS   2   2.598  -5.235  -2.083
   15   1HE   LYS   2          HE1       LYS   2   1.739  -7.477  -2.263
   16   2HE   LYS   2          HE2       LYS   2   0.410  -6.338  -2.433
   17   1HZ   LYS   2          HZ1       LYS   2   1.535  -6.849  -4.996
   18   2HZ   LYS   2          HZ2       LYS   2   1.254  -8.310  -4.227
   19   3HZ   LYS   2          HZ3       LYS   2  -0.036  -7.250  -4.432
   20    H    LEU   3           HN       LEU   3   5.616  -3.190  -1.851
   21    HA   LEU   3           HA       LEU   3   7.527  -1.599  -3.199
   22   1HB   LEU   3          HB1       LEU   3   7.685  -2.550  -0.882
   23   2HB   LEU   3          HB2       LEU   3   7.940  -4.136  -1.563
   24    HG   LEU   3           HG       LEU   3   9.883  -1.890  -2.289
   25   1HD1  LEU   3          HD1       LEU   3   9.568  -1.829   0.129
   26   2HD1  LEU   3          HD1       LEU   3   9.883  -3.583   0.238
   27   3HD1  LEU   3          HD1       LEU   3  11.179  -2.464  -0.297
   28   1HD2  LEU   3          HD2       LEU   3  11.489  -3.677  -2.331
   29   2HD2  LEU   3          HD2       LEU   3  10.295  -4.843  -1.662
   30   3HD2  LEU   3          HD2       LEU   3  10.105  -4.225  -3.316
   31    H    ILE   4           HN       ILE   4   9.341  -2.371  -4.397
   32    HA   ILE   4           HA       ILE   4   8.860  -4.809  -6.052
   33    HB   ILE   4           HB       ILE   4   9.745  -3.536  -8.097
   34   1HG1  ILE   4          HG1       ILE   4   9.028  -1.037  -6.511
   35   2HG1  ILE   4          HG1       ILE   4  10.689  -1.551  -6.800
   36   1HG2  ILE   4          HG2       ILE   4   7.181  -2.506  -6.872
   37   2HG2  ILE   4          HG2       ILE   4   7.540  -2.608  -8.630
   38   3HG2  ILE   4          HG2       ILE   4   7.325  -4.091  -7.652
   39   1HD1  ILE   4          HD1       ILE   4  10.051   0.057  -8.467
   40   2HD1  ILE   4          HD2       ILE   4  10.262  -1.547  -9.230
   41   3HD1  ILE   4          HD3       ILE   4   8.619  -0.898  -8.912
   42    H    GLY   5           HN       GLY   5  11.173  -2.302  -5.058
   43   1HA   GLY   5          HA1       GLY   5  13.184  -4.187  -4.421
   44   2HA   GLY   5          HA2       GLY   5  13.503  -3.523  -6.023
   45    H    SER   6           HN       SER   6  15.395  -2.646  -5.123
   46    HA   SER   6           HA       SER   6  15.126  -0.434  -3.181
   47   1HB   SER   6          HB1       SER   6  17.072  -1.968  -2.826
   48   2HB   SER   6          HB2       SER   6  17.604  -1.702  -4.480
   49    HG   SER   6           HG       SER   6  17.302   0.518  -2.687
   50    H    CYS   7           HN       CYS   7  16.285   1.536  -3.745
   51    HA   CYS   7           HA       CYS   7  16.265   2.316  -6.596
   52   1HB   CYS   7          HB1       CYS   7  14.180   3.168  -5.485
   53   2HB   CYS   7          HB2       CYS   7  15.149   3.908  -4.232
   54    H    VAL   8           HN       VAL   8  18.412   1.415  -4.978
   55    HA   VAL   8           HA       VAL   8  19.983   3.929  -4.570
   56    HB   VAL   8           HB       VAL   8  20.533   1.103  -3.524
   57   1HG1  VAL   8          HG1       VAL   8  22.279   2.137  -2.151
   58   2HG1  VAL   8          HG1       VAL   8  22.598   2.369  -3.886
   59   3HG1  VAL   8          HG1       VAL   8  21.934   3.720  -2.916
   60   1HG2  VAL   8          HG2       VAL   8  18.655   2.135  -2.419
   61   2HG2  VAL   8          HG2       VAL   8  20.036   1.992  -1.306
   62   3HG2  VAL   8          HG2       VAL   8  19.651   3.580  -2.048
   63    H    TRP   9           HN       TRP   9  21.459   4.351  -6.030
   64    HA   TRP   9           HA       TRP   9  22.031   2.464  -8.193
   65   1HB   TRP   9          HB1       TRP   9  22.949   5.319  -7.580
   66   2HB   TRP   9          HB2       TRP   9  23.353   4.448  -9.059
   67    HD1  TRP   9           HD1      TRP   9  20.120   5.606  -7.065
   68    HE1  TRP   9           HE1      TRP   9  18.330   5.763  -8.777
   69    HE3  TRP   9           HE3      TRP   9  22.610   3.943 -11.103
   70    HZ2  TRP   9           HZ2      TRP   9  17.876   5.266 -11.608
   71    HZ3  TRP   9           HZ3      TRP   9  21.510   3.774 -13.310
   72    HH2  TRP   9           HH2      TRP   9  19.139   4.436 -13.562
   73    H    GLY  10           HN       GLY  10  22.751   1.000  -6.513
   74   1HA   GLY  10          HA1       GLY  10  25.226   0.047  -6.618
   75   2HA   GLY  10          HA2       GLY  10  25.522   1.405  -5.538
   76    H    ALA  11           HN       ALA  11  23.082  -1.151  -5.860
   77    HA   ALA  11           HA       ALA  11  23.698  -2.271  -3.258
   78   1HB   ALA  11          HB1       ALA  11  22.258  -0.339  -2.660
   79   2HB   ALA  11          HB2       ALA  11  21.015  -0.955  -3.797
   80   3HB   ALA  11          HB3       ALA  11  21.420  -1.883  -2.328
   81    H    VAL  12           HN       VAL  12  21.816  -3.860  -2.764
   82    HA   VAL  12           HA       VAL  12  21.663  -5.681  -5.043
   83    HB   VAL  12           HB       VAL  12  20.235  -6.118  -2.421
   84   1HG1  VAL  12          HG1       VAL  12  21.763  -8.000  -4.213
   85   2HG1  VAL  12          HG1       VAL  12  20.965  -8.440  -2.675
   86   3HG1  VAL  12          HG1       VAL  12  19.977  -7.882  -4.042
   87   1HG2  VAL  12          HG2       VAL  12  22.418  -5.279  -1.706
   88   2HG2  VAL  12          HG2       VAL  12  22.295  -7.027  -1.403
   89   3HG2  VAL  12          HG2       VAL  12  23.219  -6.430  -2.820
   90    H    ASN  13           HN       ASN  13  19.527  -6.753  -5.397
   91    HA   ASN  13           HA       ASN  13  17.445  -6.479  -6.484
   92   1HB   ASN  13          HB1       ASN  13  16.946  -5.163  -3.855
   93   2HB   ASN  13          HB2       ASN  13  15.675  -5.701  -4.934
   94   1HD2  ASN  13          HD2       ASN  13  17.362  -6.659  -2.229
   95   2HD2  ASN  13          HD2       ASN  13  17.192  -8.342  -2.395
   96    H    TYR  14           HN       TYR  14  19.460  -4.394  -6.865
   97    HA   TYR  14           HA       TYR  14  18.359  -1.802  -6.792
   98   1HB   TYR  14          HB1       TYR  14  20.689  -1.768  -7.199
   99   2HB   TYR  14          HB2       TYR  14  20.642  -3.147  -8.271
  100    HD1  TYR  14           HD1      TYR  14  19.913  -2.939 -10.588
  101    HD2  TYR  14           HD2      TYR  14  20.334   0.535  -8.172
  102    HE1  TYR  14           HE1      TYR  14  19.837  -1.543 -12.581
  103    HE2  TYR  14           HE2      TYR  14  20.257   1.937 -10.185
  104    HH   TYR  14           HH       TYR  14  19.101   0.713 -12.994
  105    H    THR  15           HN       THR  15  16.945  -0.714  -8.091
  106    HA   THR  15           HA       THR  15  15.984  -2.149 -10.489
  107    HB   THR  15           HB       THR  15  14.588  -0.711  -8.227
  108    HG1  THR  15           HG1      THR  15  13.405  -2.968  -9.391
  109   1HG2  THR  15          HG2       THR  15  13.653   0.397 -10.277
  110   2HG2  THR  15          HG2       THR  15  13.241  -1.230 -10.918
  111   3HG2  THR  15          HG2       THR  15  12.505  -0.648  -9.398
  112    H    SER  16           HN       SER  16  14.956  -0.616 -11.997
  113    HA   SER  16           HA       SER  16  16.335   2.007 -12.219
  114   1HB   SER  16          HB1       SER  16  16.201   0.194 -14.663
  115   2HB   SER  16          HB2       SER  16  17.310   1.534 -14.327
  116    HG   SER  16           HG       SER  16  17.430  -1.092 -13.525
  117    H    ASP  17           HN       ASP  17  14.053  -0.225 -13.715
  118    HA   ASP  17           HA       ASP  17  12.404   2.056 -14.633
  119   1HB   ASP  17          HB1       ASP  17  11.511   0.365 -16.239
  120   2HB   ASP  17          HB2       ASP  17  13.261   0.439 -16.347
  121    H    CYS  18           HN       CYS  18  12.012   2.106 -12.238
  122    HA   CYS  18           HA       CYS  18  10.583   0.274 -10.714
  123   1HB   CYS  18          HB1       CYS  18  11.451   2.610 -10.171
  124   2HB   CYS  18          HB2       CYS  18  10.003   3.292 -10.858
  125    H    ASN  19           HN       ASN  19   9.000   2.815 -12.626
  126    HA   ASN  19           HA       ASN  19   6.415   1.789 -12.604
  127   1HB   ASN  19          HB1       ASN  19   7.543   3.960 -13.848
  128   2HB   ASN  19          HB2       ASN  19   7.300   2.921 -15.257
  129   1HD2  ASN  19          HD2       ASN  19   5.152   3.078 -16.113
  130   2HD2  ASN  19          HD2       ASN  19   3.815   3.524 -15.169
  131    H    GLY  20           HN       GLY  20   9.132   0.761 -14.404
  132   1HA   GLY  20          HA1       GLY  20   7.776  -0.939 -16.302
  133   2HA   GLY  20          HA2       GLY  20   9.493  -1.025 -15.894
  134    H    GLU  21           HN       GLU  21   9.818  -1.846 -13.590
  135    HA   GLU  21           HA       GLU  21   9.035  -4.548 -13.415
  136   1HB   GLU  21          HB1       GLU  21  10.730  -2.866 -11.885
  137   2HB   GLU  21          HB2       GLU  21   9.513  -3.351 -10.733
  138   1HG   GLU  21          HG1       GLU  21   9.962  -5.813 -11.706
  139   2HG   GLU  21          HG2       GLU  21  11.382  -5.081 -12.378
  140    H    CYS  22           HN       CYS  22   7.443  -1.678 -12.241
  141    HA   CYS  22           HA       CYS  22   5.520  -3.116 -10.641
  142   1HB   CYS  22          HB1       CYS  22   5.855  -0.271 -11.555
  143   2HB   CYS  22          HB2       CYS  22   4.363  -0.767 -10.873
  144    H    LEU  23           HN       LEU  23   5.624  -1.680 -13.929
  145    HA   LEU  23           HA       LEU  23   2.917  -2.213 -14.572
  146   1HB   LEU  23          HB1       LEU  23   5.491  -1.666 -16.047
  147   2HB   LEU  23          HB2       LEU  23   4.126  -2.223 -16.939
  148    HG   LEU  23           HG       LEU  23   4.037   0.254 -15.117
  149   1HD1  LEU  23          HD1       LEU  23   5.672   0.514 -16.945
  150   2HD1  LEU  23          HD1       LEU  23   4.418   0.037 -18.131
  151   3HD1  LEU  23          HD1       LEU  23   4.243   1.556 -17.202
  152   1HD2  LEU  23          HD2       LEU  23   2.206  -0.640 -17.352
  153   2HD2  LEU  23          HD2       LEU  23   1.837  -0.708 -15.604
  154   3HD2  LEU  23          HD2       LEU  23   2.067   0.871 -16.397
  155    H    LEU  24           HN       LEU  24   5.849  -4.037 -14.503
  156    HA   LEU  24           HA       LEU  24   5.100  -6.285 -16.082
  157   1HB   LEU  24          HB1       LEU  24   7.214  -5.374 -14.314
  158   2HB   LEU  24          HB2       LEU  24   6.826  -6.992 -13.873
  159    HG   LEU  24           HG       LEU  24   7.441  -6.003 -16.686
  160   1HD1  LEU  24          HD1       LEU  24   9.677  -7.002 -16.371
  161   2HD1  LEU  24          HD1       LEU  24   9.381  -5.679 -15.214
  162   3HD1  LEU  24          HD1       LEU  24   9.264  -7.386 -14.674
  163   1HD2  LEU  24          HD2       LEU  24   7.454  -8.805 -15.473
  164   2HD2  LEU  24          HD2       LEU  24   6.206  -8.151 -16.575
  165   3HD2  LEU  24          HD2       LEU  24   7.871  -8.407 -17.167
  166    H    ARG  25           HN       ARG  25   4.568  -5.389 -12.889
  167    HA   ARG  25           HA       ARG  25   3.171  -7.880 -12.126
  168   1HB   ARG  25          HB1       ARG  25   4.035  -5.367 -10.660
  169   2HB   ARG  25          HB2       ARG  25   2.915  -6.466  -9.887
  170   1HG   ARG  25          HG1       ARG  25   4.531  -8.125  -9.540
  171   2HG   ARG  25          HG2       ARG  25   5.323  -7.813 -11.063
  172   1HD   ARG  25          HD1       ARG  25   5.716  -5.527  -9.250
  173   2HD   ARG  25          HD2       ARG  25   6.312  -6.994  -8.492
  174    HE   ARG  25           HE       ARG  25   7.077  -6.299 -11.299
  175   1HH1  ARG  25          HH1       ARG  25  10.130  -7.677 -10.141
  176   2HH1  ARG  25          HH1       ARG  25   8.823  -8.242 -11.147
  177   1HH2  ARG  25          HH2       ARG  25   9.844  -5.988  -8.734
  178   2HH2  ARG  25          HH2       ARG  25   8.297  -5.199  -8.633
  179    H    GLY  26           HN       GLY  26   2.313  -5.309 -13.832
  180   1HA   GLY  26          HA1       GLY  26   0.203  -4.617 -14.616
  181   2HA   GLY  26          HA2       GLY  26  -0.527  -5.856 -13.595
  182    H    TYR  27           HN       TYR  27   1.666  -3.708 -12.070
  183    HA   TYR  27           HA       TYR  27  -0.482  -2.670 -10.407
  184   1HB   TYR  27          HB1       TYR  27   2.503  -2.054 -10.539
  185   2HB   TYR  27          HB2       TYR  27   1.473  -1.270  -9.378
  186    HD1  TYR  27           HD1      TYR  27  -0.232  -3.705  -8.549
  187    HD2  TYR  27           HD2      TYR  27   3.948  -3.258  -9.165
  188    HE1  TYR  27           HE1      TYR  27   0.174  -5.485  -6.992
  189    HE2  TYR  27           HE2      TYR  27   4.380  -5.053  -7.587
  190    HH   TYR  27           HH       TYR  27   3.340  -6.942  -6.675
  191    H    LYS  28           HN       LYS  28  -0.594  -0.334  -9.939
  192    HA   LYS  28           HA       LYS  28  -1.329   1.072 -12.308
  193   1HB   LYS  28          HB1       LYS  28  -0.791   2.262  -9.549
  194   2HB   LYS  28          HB2       LYS  28  -1.660   3.024 -10.849
  195   1HG   LYS  28          HG1       LYS  28  -3.484   2.232  -9.743
  196   2HG   LYS  28          HG2       LYS  28  -3.180   0.825 -10.743
  197   1HD   LYS  28          HD1       LYS  28  -2.775  -0.507  -9.005
  198   2HD   LYS  28          HD2       LYS  28  -1.612   0.623  -8.316
  199   1HE   LYS  28          HE1       LYS  28  -3.354   1.933  -7.265
  200   2HE   LYS  28          HE2       LYS  28  -4.630   1.049  -8.092
  201   1HZ   LYS  28          HZ1       LYS  28  -3.469   0.544  -5.661
  202   2HZ   LYS  28          HZ2       LYS  28  -4.657  -0.374  -6.427
  203   3HZ   LYS  28          HZ3       LYS  28  -3.019  -0.783  -6.635
  204    H    GLY  29           HN       GLY  29   1.501   1.122 -10.255
  205   1HA   GLY  29          HA1       GLY  29   3.311   1.916 -12.228
  206   2HA   GLY  29          HA2       GLY  29   2.739   3.405 -11.473
  207    H    GLY  30           HN       GLY  30   5.053   3.497 -10.969
  208   1HA   GLY  30          HA1       GLY  30   5.463   2.826  -8.186
  209   2HA   GLY  30          HA2       GLY  30   6.546   1.911  -9.248
  210    H    HIS  31           HN       HIS  31   7.266   3.709  -7.276
  211    HA   HIS  31           HA       HIS  31   9.042   5.469  -8.757
  212   1HB   HIS  31          HB1       HIS  31   8.312   7.625  -7.700
  213   2HB   HIS  31          HB2       HIS  31   6.985   6.956  -8.632
  214    HD1  HIS  31           HD1      HIS  31   5.123   5.764  -7.230
  215    HD2  HIS  31           HD2      HIS  31   7.784   7.809  -4.777
  216    HE1  HIS  31           HE1      HIS  31   4.066   5.904  -5.008
  217    HE2  HIS  31           HE2      HIS  31   5.726   7.153  -3.588
  218    H    CYS  32           HN       CYS  32  10.570   6.564  -7.385
  219    HA   CYS  32           HA       CYS  32  11.306   4.902  -5.132
  220   1HB   CYS  32          HB1       CYS  32  12.453   7.508  -6.182
  221   2HB   CYS  32          HB2       CYS  32  13.178   6.507  -4.939
  222    H    GLY  33           HN       GLY  33  11.380   5.510  -3.019
  223   1HA   GLY  33          HA1       GLY  33   9.353   6.448  -1.615
  224   2HA   GLY  33          HA2       GLY  33  10.950   6.975  -1.150
  225    H    SER  34           HN       SER  34  11.626   9.027  -1.610
  226    HA   SER  34           HA       SER  34  10.283  10.916  -3.244
  227   1HB   SER  34          HB1       SER  34   8.403  10.640  -1.511
  228   2HB   SER  34          HB2       SER  34   9.522  11.199  -0.263
  229    HG   SER  34           HG       SER  34   8.862  13.128  -0.962
  230    H    PHE  35           HN       PHE  35  11.602  10.998   0.054
  231    HA   PHE  35           HA       PHE  35  13.825  12.726  -0.955
  232   1HB   PHE  35          HB1       PHE  35  11.966  13.842   0.513
  233   2HB   PHE  35          HB2       PHE  35  12.620  12.904   1.841
  234    HD1  PHE  35           HD1      PHE  35  13.563  15.398  -0.768
  235    HD2  PHE  35           HD2      PHE  35  14.574  13.682   3.002
  236    HE1  PHE  35           HE1      PHE  35  15.295  17.113  -0.446
  237    HE2  PHE  35           HE2      PHE  35  16.299  15.394   3.316
  238    HZ   PHE  35           HZ       PHE  35  16.666  17.114   1.595
  239    H    ALA  36           HN       ALA  36  14.392  10.292  -1.129
  240    HA   ALA  36           HA       ALA  36  16.448   9.825   0.739
  241   1HB   ALA  36          HB1       ALA  36  14.559   8.890   2.029
  242   2HB   ALA  36          HB2       ALA  36  14.120   7.853   0.638
  243   3HB   ALA  36          HB3       ALA  36  15.657   7.579   1.515
  244    H    ASN  37           HN       ASN  37  14.458   8.536  -1.731
  245    HA   ASN  37           HA       ASN  37  14.847   7.090  -3.545
  246   1HB   ASN  37          HB1       ASN  37  15.953   9.460  -3.975
  247   2HB   ASN  37          HB2       ASN  37  17.445   8.600  -3.662
  248   1HD2  ASN  37          HD2       ASN  37  14.833   9.042  -5.985
  249   2HD2  ASN  37          HD2       ASN  37  15.513   8.028  -7.171
  250    H    VAL  38           HN       VAL  38  15.091   5.638  -1.643
  251    HA   VAL  38           HA       VAL  38  17.671   4.167  -1.791
  252    HB   VAL  38           HB       VAL  38  17.479   5.198   0.404
  253   1HG1  VAL  38          HG1       VAL  38  15.626   4.784   1.934
  254   2HG1  VAL  38          HG1       VAL  38  15.049   5.587   0.446
  255   3HG1  VAL  38          HG1       VAL  38  14.776   3.833   0.686
  256   1HG2  VAL  38          HG2       VAL  38  18.393   2.988   0.420
  257   2HG2  VAL  38          HG2       VAL  38  17.444   3.267   1.909
  258   3HG2  VAL  38          HG2       VAL  38  16.763   2.270   0.591
  259    H    ASN  39           HN       ASN  39  14.166   3.910  -1.294
  260    HA   ASN  39           HA       ASN  39  14.289   1.268  -2.612
  261   1HB   ASN  39          HB1       ASN  39  12.908   1.950   0.028
  262   2HB   ASN  39          HB2       ASN  39  12.231   0.738  -1.035
  263   1HD2  ASN  39          HD2       ASN  39  12.907  -1.282  -0.089
  264   2HD2  ASN  39          HD2       ASN  39  14.534  -1.613   0.294
  265    H    CYS  40           HN       CYS  40  12.503   0.704  -3.821
  266    HA   CYS  40           HA       CYS  40  10.819   3.052  -4.633
  267   1HB   CYS  40          HB1       CYS  40  12.509   1.419  -6.264
  268   2HB   CYS  40          HB2       CYS  40  10.911   0.818  -6.564
  269    H    TRP  41           HN       TRP  41   8.695   2.760  -4.953
  270    HA   TRP  41           HA       TRP  41   7.524   0.163  -4.108
  271   1HB   TRP  41          HB1       TRP  41   6.550   2.894  -3.116
  272   2HB   TRP  41          HB2       TRP  41   5.880   1.330  -2.710
  273    HD1  TRP  41           HD1      TRP  41   9.344   3.144  -2.401
  274    HE1  TRP  41           HE1      TRP  41  10.337   2.259  -0.271
  275    HE3  TRP  41           HE3      TRP  41   5.804  -0.132  -1.056
  276    HZ2  TRP  41           HZ2      TRP  41   9.755   0.376   1.855
  277    HZ3  TRP  41           HZ3      TRP  41   5.976  -1.459   0.989
  278    HH2  TRP  41           HH2      TRP  41   7.965  -1.219   2.469
  279    H    CYS  42           HN       CYS  42   5.298  -0.136  -4.831
  280    HA   CYS  42           HA       CYS  42   5.016   1.128  -7.454
  281   1HB   CYS  42          HB1       CYS  42   3.509  -1.106  -6.120
  282   2HB   CYS  42          HB2       CYS  42   3.054  -0.435  -7.676
  283    H    GLU  43           HN       GLU  43   2.667   1.760  -7.991
  284    HA   GLU  43           HA       GLU  43   1.775   3.638  -5.899
  285   1HB   GLU  43          HB1       GLU  43   1.410   3.672  -8.924
  286   2HB   GLU  43          HB2       GLU  43   0.894   4.932  -7.815
  287   1HG   GLU  43          HG1       GLU  43   3.424   4.758  -6.896
  288   2HG   GLU  43          HG2       GLU  43   3.730   4.043  -8.464
  289    H    THR  44           HN       THR  44   1.115   1.438  -5.179
  290    HA   THR  44           HA       THR  44  -1.530   0.725  -6.181
  291    HB   THR  44           HB       THR  44  -1.139  -1.225  -4.436
  292    HG1  THR  44           HG1      THR  44   0.359   0.563  -3.658
  293   1HG2  THR  44          HG2       THR  44   0.603  -2.258  -5.790
  294   2HG2  THR  44          HG2       THR  44  -0.358  -1.309  -6.943
  295   3HG2  THR  44          HG2       THR  44   1.194  -0.651  -6.346
  Start of MODEL    9
    1   1H    ASP   1          HT1       ASP   1  -0.814  -0.337  -0.748
    2   2H    ASP   1          HT2       ASP   1  -0.179  -1.799  -0.068
    3   3H    ASP   1          HT3       ASP   1  -0.035  -0.318   0.754
    4    HA   ASP   1           HA       ASP   1   1.028   0.029  -1.798
    5   1HB   ASP   1          HB1       ASP   1   3.255   0.068  -0.444
    6   2HB   ASP   1          HB2       ASP   1   2.040   1.212   0.047
    7    H    LYS   2           HN       LYS   2   2.740  -0.991  -2.799
    8    HA   LYS   2           HA       LYS   2   3.243  -3.816  -2.156
    9   1HB   LYS   2          HB1       LYS   2   1.812  -2.662  -4.457
   10   2HB   LYS   2          HB2       LYS   2   3.222  -3.460  -4.947
   11   1HG   LYS   2          HG1       LYS   2   1.059  -4.883  -4.853
   12   2HG   LYS   2          HG2       LYS   2   2.447  -5.611  -4.070
   13   1HD   LYS   2          HD1       LYS   2   1.571  -4.877  -1.865
   14   2HD   LYS   2          HD2       LYS   2   0.238  -4.046  -2.651
   15   1HE   LYS   2          HE1       LYS   2  -0.609  -6.204  -3.496
   16   2HE   LYS   2          HE2       LYS   2   0.813  -7.035  -2.877
   17   1HZ   LYS   2          HZ1       LYS   2  -0.326  -5.533  -0.780
   18   2HZ   LYS   2          HZ2       LYS   2  -1.561  -6.428  -1.515
   19   3HZ   LYS   2          HZ3       LYS   2  -0.184  -7.215  -0.915
   20    H    LEU   3           HN       LEU   3   5.254  -4.251  -2.153
   21    HA   LEU   3           HA       LEU   3   7.168  -2.200  -2.993
   22   1HB   LEU   3          HB1       LEU   3   7.261  -3.592  -0.805
   23   2HB   LEU   3          HB2       LEU   3   7.704  -4.968  -1.769
   24    HG   LEU   3           HG       LEU   3   9.568  -3.598  -0.534
   25   1HD1  LEU   3          HD1       LEU   3  10.185  -5.335  -1.984
   26   2HD1  LEU   3          HD1       LEU   3  10.030  -4.303  -3.418
   27   3HD1  LEU   3          HD1       LEU   3  11.255  -3.905  -2.176
   28   1HD2  LEU   3          HD2       LEU   3  10.497  -1.707  -1.650
   29   2HD2  LEU   3          HD2       LEU   3   9.182  -1.730  -2.854
   30   3HD2  LEU   3          HD2       LEU   3   8.800  -1.472  -1.130
   31    H    ILE   4           HN       ILE   4   8.993  -2.835  -4.238
   32    HA   ILE   4           HA       ILE   4   8.531  -4.978  -6.236
   33    HB   ILE   4           HB       ILE   4   9.359  -3.316  -8.035
   34   1HG1  ILE   4          HG1       ILE   4   8.733  -1.309  -5.826
   35   2HG1  ILE   4          HG1       ILE   4  10.223  -1.509  -6.736
   36   1HG2  ILE   4          HG2       ILE   4   6.682  -2.843  -6.712
   37   2HG2  ILE   4          HG2       ILE   4   7.074  -2.517  -8.437
   38   3HG2  ILE   4          HG2       ILE   4   7.093  -4.182  -7.824
   39   1HD1  ILE   4          HD1       ILE   4   9.079  -0.906  -8.817
   40   2HD1  ILE   4          HD2       ILE   4   7.548  -0.690  -7.876
   41   3HD1  ILE   4          HD3       ILE   4   8.908   0.396  -7.606
   42    H    GLY   5           HN       GLY   5  10.820  -2.670  -4.827
   43   1HA   GLY   5          HA1       GLY   5  12.845  -4.462  -4.367
   44   2HA   GLY   5          HA2       GLY   5  13.145  -3.929  -6.018
   45    H    SER   6           HN       SER   6  15.115  -3.089  -5.120
   46    HA   SER   6           HA       SER   6  14.889  -0.749  -3.355
   47   1HB   SER   6          HB1       SER   6  16.855  -2.213  -2.874
   48   2HB   SER   6          HB2       SER   6  17.378  -2.096  -4.549
   49    HG   SER   6           HG       SER   6  17.230   0.085  -2.657
   50    H    CYS   7           HN       CYS   7  16.339   1.094  -3.985
   51    HA   CYS   7           HA       CYS   7  16.229   1.727  -6.885
   52   1HB   CYS   7          HB1       CYS   7  14.155   2.675  -5.847
   53   2HB   CYS   7          HB2       CYS   7  15.130   3.515  -4.658
   54    H    VAL   8           HN       VAL   8  18.375   0.895  -5.356
   55    HA   VAL   8           HA       VAL   8  19.995   3.412  -5.117
   56    HB   VAL   8           HB       VAL   8  20.339   0.714  -3.731
   57   1HG1  VAL   8          HG1       VAL   8  22.065   3.204  -3.523
   58   2HG1  VAL   8          HG1       VAL   8  22.233   1.710  -2.550
   59   3HG1  VAL   8          HG1       VAL   8  22.545   1.665  -4.303
   60   1HG2  VAL   8          HG2       VAL   8  19.802   3.499  -2.674
   61   2HG2  VAL   8          HG2       VAL   8  18.639   2.139  -2.789
   62   3HG2  VAL   8          HG2       VAL   8  20.061   2.000  -1.722
   63    H    TRP   9           HN       TRP   9  21.485   3.677  -6.597
   64    HA   TRP   9           HA       TRP   9  22.065   1.595  -8.559
   65   1HB   TRP   9          HB1       TRP   9  22.231   4.476  -8.501
   66   2HB   TRP   9          HB2       TRP   9  23.878   3.922  -8.716
   67    HD1  TRP   9           HD1      TRP   9  20.838   4.657 -10.725
   68    HE1  TRP   9           HE1      TRP   9  21.147   3.590 -12.979
   69    HE3  TRP   9           HE3      TRP   9  24.764   1.643  -9.790
   70    HZ2  TRP   9           HZ2      TRP   9  22.801   1.657 -14.329
   71    HZ3  TRP   9           HZ3      TRP   9  25.698   0.183 -11.545
   72    HH2  TRP   9           HH2      TRP   9  24.723   0.189 -13.819
   73    H    GLY  10           HN       GLY  10  22.684   0.323  -6.560
   74   1HA   GLY  10          HA1       GLY  10  25.166  -0.692  -6.588
   75   2HA   GLY  10          HA2       GLY  10  25.412   0.727  -5.574
   76    H    ALA  11           HN       ALA  11  22.961  -1.834  -5.890
   77    HA   ALA  11           HA       ALA  11  23.436  -2.822  -3.215
   78   1HB   ALA  11          HB1       ALA  11  22.043  -0.823  -2.764
   79   2HB   ALA  11          HB2       ALA  11  20.823  -1.444  -3.921
   80   3HB   ALA  11          HB3       ALA  11  21.136  -2.320  -2.398
   81    H    VAL  12           HN       VAL  12  21.469  -4.333  -2.726
   82    HA   VAL  12           HA       VAL  12  21.345  -6.220  -4.961
   83    HB   VAL  12           HB       VAL  12  19.780  -6.800  -2.461
   84   1HG1  VAL  12          HG1       VAL  12  20.894  -8.958  -2.595
   85   2HG1  VAL  12          HG1       VAL  12  20.117  -8.501  -4.129
   86   3HG1  VAL  12          HG1       VAL  12  21.897  -8.354  -3.948
   87   1HG2  VAL  12          HG2       VAL  12  22.787  -6.565  -2.320
   88   2HG2  VAL  12          HG2       VAL  12  21.584  -5.599  -1.400
   89   3HG2  VAL  12          HG2       VAL  12  21.732  -7.344  -1.099
   90    H    ASN  13           HN       ASN  13  19.245  -7.238  -5.402
   91    HA   ASN  13           HA       ASN  13  17.212  -6.934  -6.549
   92   1HB   ASN  13          HB1       ASN  13  16.564  -5.766  -3.880
   93   2HB   ASN  13          HB2       ASN  13  15.407  -6.503  -4.954
   94   1HD2  ASN  13          HD2       ASN  13  15.000  -8.755  -4.480
   95   2HD2  ASN  13          HD2       ASN  13  16.102  -9.759  -3.655
   96    H    TYR  14           HN       TYR  14  19.182  -4.839  -6.785
   97    HA   TYR  14           HA       TYR  14  18.036  -2.234  -6.705
   98   1HB   TYR  14          HB1       TYR  14  20.384  -2.176  -6.869
   99   2HB   TYR  14          HB2       TYR  14  20.452  -3.520  -7.983
  100    HD1  TYR  14           HD1      TYR  14  20.551  -3.171 -10.334
  101    HD2  TYR  14           HD2      TYR  14  19.475   0.082  -7.826
  102    HE1  TYR  14           HE1      TYR  14  20.675  -1.644 -12.251
  103    HE2  TYR  14           HE2      TYR  14  19.622   1.602  -9.713
  104    HH   TYR  14           HH       TYR  14  20.729   1.683 -11.867
  105    H    THR  15           HN       THR  15  16.760  -1.185  -8.103
  106    HA   THR  15           HA       THR  15  15.944  -2.578 -10.586
  107    HB   THR  15           HB       THR  15  14.548  -0.928  -8.475
  108    HG1  THR  15           HG1      THR  15  13.616  -3.296  -9.776
  109   1HG2  THR  15          HG2       THR  15  13.679   0.161 -10.488
  110   2HG2  THR  15          HG2       THR  15  13.172  -1.444 -11.115
  111   3HG2  THR  15          HG2       THR  15  12.486  -0.825  -9.591
  112    H    SER  16           HN       SER  16  14.960  -0.885 -12.116
  113    HA   SER  16           HA       SER  16  16.598   1.585 -12.233
  114   1HB   SER  16          HB1       SER  16  16.471  -0.420 -14.558
  115   2HB   SER  16          HB2       SER  16  17.474   1.044 -14.473
  116    HG   SER  16           HG       SER  16  18.706   0.102 -12.824
  117    H    ASP  17           HN       ASP  17  14.168  -0.349 -13.919
  118    HA   ASP  17           HA       ASP  17  12.724   2.128 -14.690
  119   1HB   ASP  17          HB1       ASP  17  11.594   0.586 -16.320
  120   2HB   ASP  17          HB2       ASP  17  13.332   0.586 -16.543
  121    H    CYS  18           HN       CYS  18  12.259   2.137 -12.292
  122    HA   CYS  18           HA       CYS  18  10.719   0.365 -10.838
  123   1HB   CYS  18          HB1       CYS  18  11.629   2.535 -10.205
  124   2HB   CYS  18          HB2       CYS  18  10.326   3.410 -10.979
  125    H    ASN  19           HN       ASN  19   9.116   2.999 -12.624
  126    HA   ASN  19           HA       ASN  19   6.546   2.110 -12.728
  127   1HB   ASN  19          HB1       ASN  19   7.555   4.116 -13.985
  128   2HB   ASN  19          HB2       ASN  19   7.927   3.001 -15.284
  129   1HD2  ASN  19          HD2       ASN  19   5.875   1.478 -15.838
  130   2HD2  ASN  19          HD2       ASN  19   4.436   2.364 -15.987
  131    H    GLY  20           HN       GLY  20   9.212   0.892 -14.514
  132   1HA   GLY  20          HA1       GLY  20   7.804  -0.946 -16.245
  133   2HA   GLY  20          HA2       GLY  20   9.524  -0.996 -15.885
  134    H    GLU  21           HN       GLU  21   9.762  -1.493 -13.439
  135    HA   GLU  21           HA       GLU  21   9.262  -4.218 -12.958
  136   1HB   GLU  21          HB1       GLU  21  10.930  -2.504 -11.973
  137   2HB   GLU  21          HB2       GLU  21   9.652  -1.977 -10.931
  138   1HG   GLU  21          HG1       GLU  21  10.929  -3.336  -9.559
  139   2HG   GLU  21          HG2       GLU  21   9.587  -4.351  -9.999
  140    H    CYS  22           HN       CYS  22   7.456  -1.401 -12.120
  141    HA   CYS  22           HA       CYS  22   5.518  -2.768 -10.451
  142   1HB   CYS  22          HB1       CYS  22   5.782  -0.008 -11.587
  143   2HB   CYS  22          HB2       CYS  22   4.221  -0.516 -11.085
  144    H    LEU  23           HN       LEU  23   5.579  -1.549 -13.827
  145    HA   LEU  23           HA       LEU  23   2.973  -2.372 -14.482
  146   1HB   LEU  23          HB1       LEU  23   5.537  -1.797 -15.961
  147   2HB   LEU  23          HB2       LEU  23   4.213  -2.490 -16.814
  148    HG   LEU  23           HG       LEU  23   4.094   0.153 -15.297
  149   1HD1  LEU  23          HD1       LEU  23   4.106   1.152 -17.578
  150   2HD1  LEU  23          HD1       LEU  23   5.580   0.178 -17.291
  151   3HD1  LEU  23          HD1       LEU  23   4.246  -0.490 -18.273
  152   1HD2  LEU  23          HD2       LEU  23   2.004   0.524 -16.547
  153   2HD2  LEU  23          HD2       LEU  23   2.158  -1.113 -17.257
  154   3HD2  LEU  23          HD2       LEU  23   1.881  -0.914 -15.502
  155    H    LEU  24           HN       LEU  24   6.071  -3.988 -14.258
  156    HA   LEU  24           HA       LEU  24   5.403  -6.318 -15.740
  157   1HB   LEU  24          HB1       LEU  24   7.548  -5.270 -14.042
  158   2HB   LEU  24          HB2       LEU  24   7.223  -6.916 -13.638
  159    HG   LEU  24           HG       LEU  24   7.762  -5.836 -16.439
  160   1HD1  LEU  24          HD1       LEU  24   9.587  -7.353 -14.531
  161   2HD1  LEU  24          HD1       LEU  24   9.975  -6.889 -16.215
  162   3HD1  LEU  24          HD1       LEU  24   9.721  -5.625 -14.982
  163   1HD2  LEU  24          HD2       LEU  24   7.707  -8.698 -15.391
  164   2HD2  LEU  24          HD2       LEU  24   6.483  -7.947 -16.459
  165   3HD2  LEU  24          HD2       LEU  24   8.150  -8.191 -17.050
  166    H    ARG  25           HN       ARG  25   4.814  -5.288 -12.642
  167    HA   ARG  25           HA       ARG  25   3.579  -7.845 -11.733
  168   1HB   ARG  25          HB1       ARG  25   4.562  -5.334 -10.335
  169   2HB   ARG  25          HB2       ARG  25   3.378  -6.335  -9.516
  170   1HG   ARG  25          HG1       ARG  25   4.856  -8.192  -9.322
  171   2HG   ARG  25          HG2       ARG  25   5.839  -7.684 -10.674
  172   1HD   ARG  25          HD1       ARG  25   5.770  -6.001  -8.155
  173   2HD   ARG  25          HD2       ARG  25   6.903  -7.326  -8.195
  174    HE   ARG  25           HE       ARG  25   7.006  -4.936  -9.900
  175   1HH1  ARG  25          HH1       ARG  25   9.377  -6.696 -11.775
  176   2HH1  ARG  25          HH1       ARG  25   7.723  -6.149 -11.899
  177   1HH2  ARG  25          HH2       ARG  25  10.255  -6.892  -9.631
  178   2HH2  ARG  25          HH2       ARG  25   9.241  -6.562  -8.257
  179    H    GLY  26           HN       GLY  26   2.585  -5.404 -13.518
  180   1HA   GLY  26          HA1       GLY  26   0.455  -4.659 -14.147
  181   2HA   GLY  26          HA2       GLY  26  -0.216  -5.898 -13.084
  182    H    TYR  27           HN       TYR  27   2.021  -3.774 -11.654
  183    HA   TYR  27           HA       TYR  27  -0.086  -2.628  -9.985
  184   1HB   TYR  27          HB1       TYR  27   2.977  -2.588  -9.976
  185   2HB   TYR  27          HB2       TYR  27   2.053  -1.688  -8.805
  186    HD1  TYR  27           HD1      TYR  27   3.765  -3.538  -7.591
  187    HD2  TYR  27           HD2      TYR  27  -0.033  -4.484  -9.303
  188    HE1  TYR  27           HE1      TYR  27   3.594  -5.496  -6.170
  189    HE2  TYR  27           HE2      TYR  27  -0.185  -6.414  -7.887
  190    HH   TYR  27           HH       TYR  27   2.008  -7.946  -6.501
  191    H    LYS  28           HN       LYS  28   0.289  -0.271  -9.376
  192    HA   LYS  28           HA       LYS  28  -0.092   1.202 -11.877
  193   1HB   LYS  28          HB1       LYS  28  -0.298   2.191  -8.998
  194   2HB   LYS  28          HB2       LYS  28  -0.848   3.046 -10.407
  195   1HG   LYS  28          HG1       LYS  28  -2.879   2.129  -9.929
  196   2HG   LYS  28          HG2       LYS  28  -2.263   0.733 -10.773
  197   1HD   LYS  28          HD1       LYS  28  -2.425  -0.565  -8.922
  198   2HD   LYS  28          HD2       LYS  28  -1.376   0.525  -8.026
  199   1HE   LYS  28          HE1       LYS  28  -3.296   1.999  -7.495
  200   2HE   LYS  28          HE2       LYS  28  -4.379   1.002  -8.446
  201   1HZ   LYS  28          HZ1       LYS  28  -4.751  -0.243  -6.650
  202   2HZ   LYS  28          HZ2       LYS  28  -3.107  -0.601  -6.379
  203   3HZ   LYS  28          HZ3       LYS  28  -3.755   0.796  -5.755
  204    H    GLY  29           HN       GLY  29   0.983   3.054 -12.384
  205   1HA   GLY  29          HA1       GLY  29   3.630   3.193 -12.645
  206   2HA   GLY  29          HA2       GLY  29   2.719   4.667 -12.326
  207    H    GLY  30           HN       GLY  30   5.061   2.506 -11.111
  208   1HA   GLY  30          HA1       GLY  30   4.809   3.438  -8.339
  209   2HA   GLY  30          HA2       GLY  30   5.995   2.282  -8.946
  210    H    HIS  31           HN       HIS  31   7.120   3.828  -7.431
  211    HA   HIS  31           HA       HIS  31   8.879   5.502  -9.028
  212   1HB   HIS  31          HB1       HIS  31   8.388   7.654  -7.763
  213   2HB   HIS  31          HB2       HIS  31   6.973   7.113  -8.655
  214    HD1  HIS  31           HD1      HIS  31   4.904   6.618  -7.154
  215    HD2  HIS  31           HD2      HIS  31   8.332   6.838  -4.851
  216    HE1  HIS  31           HE1      HIS  31   4.171   6.426  -4.832
  217    HE2  HIS  31           HE2      HIS  31   6.258   6.579  -3.464
  218    H    CYS  32           HN       CYS  32  10.430   6.728  -7.491
  219    HA   CYS  32           HA       CYS  32  11.257   4.776  -5.438
  220   1HB   CYS  32          HB1       CYS  32  12.701   7.127  -6.699
  221   2HB   CYS  32          HB2       CYS  32  13.334   6.075  -5.449
  222    H    GLY  33           HN       GLY  33  11.685   5.400  -3.346
  223   1HA   GLY  33          HA1       GLY  33   9.857   6.937  -2.017
  224   2HA   GLY  33          HA2       GLY  33  11.454   6.613  -1.365
  225    H    SER  34           HN       SER  34   9.751   9.037  -1.163
  226    HA   SER  34           HA       SER  34  11.258  11.031  -2.707
  227   1HB   SER  34          HB1       SER  34   9.459  12.520  -1.505
  228   2HB   SER  34          HB2       SER  34   8.834  11.323  -2.658
  229    HG   SER  34           HG       SER  34   8.025  11.355  -0.323
  230    H    PHE  35           HN       PHE  35  10.161  10.842   0.592
  231    HA   PHE  35           HA       PHE  35  12.685  12.184   1.485
  232   1HB   PHE  35          HB1       PHE  35  10.343  13.019   2.231
  233   2HB   PHE  35          HB2       PHE  35  10.196  11.531   3.151
  234    HD1  PHE  35           HD1      PHE  35  12.768  14.233   2.662
  235    HD2  PHE  35           HD2      PHE  35  10.728  11.718   5.437
  236    HE1  PHE  35           HE1      PHE  35  13.988  15.276   4.511
  237    HE2  PHE  35           HE2      PHE  35  11.951  12.768   7.279
  238    HZ   PHE  35           HZ       PHE  35  13.584  14.547   6.825
  239    H    ALA  36           HN       ALA  36  12.232   9.282   0.732
  240    HA   ALA  36           HA       ALA  36  14.084   8.245   2.566
  241   1HB   ALA  36          HB1       ALA  36  11.247   7.125   2.562
  242   2HB   ALA  36          HB2       ALA  36  12.630   6.392   3.418
  243   3HB   ALA  36          HB3       ALA  36  12.015   7.992   3.931
  244    H    ASN  37           HN       ASN  37  14.461   8.517   0.061
  245    HA   ASN  37           HA       ASN  37  13.568   6.545  -1.750
  246   1HB   ASN  37          HB1       ASN  37  14.795   8.856  -2.174
  247   2HB   ASN  37          HB2       ASN  37  16.279   7.984  -1.838
  248   1HD2  ASN  37          HD2       ASN  37  13.705   8.459  -4.132
  249   2HD2  ASN  37          HD2       ASN  37  14.455   7.591  -5.400
  250    H    VAL  38           HN       VAL  38  16.091   5.609  -2.621
  251    HA   VAL  38           HA       VAL  38  17.765   4.030  -2.239
  252    HB   VAL  38           HB       VAL  38  17.459   4.872   0.365
  253   1HG1  VAL  38          HG1       VAL  38  15.623   3.144   0.859
  254   2HG1  VAL  38          HG1       VAL  38  16.860   1.905   0.468
  255   3HG1  VAL  38          HG1       VAL  38  17.077   2.984   1.875
  256   1HG2  VAL  38          HG2       VAL  38  19.529   4.170  -0.494
  257   2HG2  VAL  38          HG2       VAL  38  19.208   3.571   1.156
  258   3HG2  VAL  38          HG2       VAL  38  19.025   2.458  -0.211
  259    H    ASN  39           HN       ASN  39  14.403   3.792  -1.895
  260    HA   ASN  39           HA       ASN  39  14.450   1.121  -3.041
  261   1HB   ASN  39          HB1       ASN  39  13.052   1.696  -0.352
  262   2HB   ASN  39          HB2       ASN  39  12.357   0.650  -1.527
  263   1HD2  ASN  39          HD2       ASN  39  15.259   1.011   0.474
  264   2HD2  ASN  39          HD2       ASN  39  15.756  -0.603   0.285
  265    H    CYS  40           HN       CYS  40  12.532   0.532  -4.098
  266    HA   CYS  40           HA       CYS  40  10.954   2.943  -4.878
  267   1HB   CYS  40          HB1       CYS  40  12.350   0.987  -6.468
  268   2HB   CYS  40          HB2       CYS  40  10.669   0.660  -6.700
  269    H    TRP  41           HN       TRP  41   8.735   2.565  -5.329
  270    HA   TRP  41           HA       TRP  41   7.475   0.214  -4.056
  271   1HB   TRP  41          HB1       TRP  41   6.871   3.063  -3.105
  272   2HB   TRP  41          HB2       TRP  41   5.919   1.642  -2.741
  273    HD1  TRP  41           HD1      TRP  41   9.612   2.904  -2.189
  274    HE1  TRP  41           HE1      TRP  41  10.405   1.708  -0.141
  275    HE3  TRP  41           HE3      TRP  41   5.613   0.044  -1.342
  276    HZ2  TRP  41           HZ2      TRP  41   9.428  -0.324   1.779
  277    HZ3  TRP  41           HZ3      TRP  41   5.499  -1.512   0.549
  278    HH2  TRP  41           HH2      TRP  41   7.404  -1.708   2.115
  279    H    CYS  42           HN       CYS  42   5.226  -0.027  -4.666
  280    HA   CYS  42           HA       CYS  42   4.723   1.373  -7.211
  281   1HB   CYS  42          HB1       CYS  42   3.518  -1.083  -5.943
  282   2HB   CYS  42          HB2       CYS  42   2.772  -0.305  -7.324
  283    H    GLU  43           HN       GLU  43   2.497   2.044  -7.591
  284    HA   GLU  43           HA       GLU  43   1.518   3.491  -5.211
  285   1HB   GLU  43          HB1       GLU  43   1.511   4.087  -8.192
  286   2HB   GLU  43          HB2       GLU  43   0.338   4.867  -7.144
  287   1HG   GLU  43          HG1       GLU  43   2.220   5.585  -5.613
  288   2HG   GLU  43          HG2       GLU  43   3.373   4.858  -6.734
  289    H    THR  44           HN       THR  44   0.880   1.209  -4.839
  290    HA   THR  44           HA       THR  44  -1.793   0.852  -6.011
  291    HB   THR  44           HB       THR  44  -0.358  -1.224  -6.064
  292    HG1  THR  44           HG1      THR  44  -2.557  -1.069  -4.324
  293   1HG2  THR  44          HG2       THR  44  -0.112  -2.527  -4.071
  294   2HG2  THR  44          HG2       THR  44   0.692  -0.948  -3.766
  295   3HG2  THR  44          HG2       THR  44  -0.912  -1.305  -3.056
  Start of MODEL   10
    1   1H    ASP   1          HT1       ASP   1   0.072   0.406  -0.600
    2   2H    ASP   1          HT2       ASP   1   0.747  -1.095  -0.091
    3   3H    ASP   1          HT3       ASP   1   1.126   0.351   0.709
    4    HA   ASP   1           HA       ASP   1   1.779   0.674  -2.004
    5   1HB   ASP   1          HB1       ASP   1   3.759   0.196   0.242
    6   2HB   ASP   1          HB2       ASP   1   3.915   1.250  -1.140
    7    H    LYS   2           HN       LYS   2   3.180  -0.618  -3.260
    8    HA   LYS   2           HA       LYS   2   3.616  -3.427  -2.421
    9   1HB   LYS   2          HB1       LYS   2   2.046  -2.327  -4.669
   10   2HB   LYS   2          HB2       LYS   2   3.387  -3.224  -5.249
   11   1HG   LYS   2          HG1       LYS   2   1.270  -4.614  -4.916
   12   2HG   LYS   2          HG2       LYS   2   2.630  -5.246  -4.009
   13   1HD   LYS   2          HD1       LYS   2   1.787  -4.140  -1.944
   14   2HD   LYS   2          HD2       LYS   2   0.519  -3.347  -2.863
   15   1HE   LYS   2          HE1       LYS   2  -0.545  -5.501  -3.308
   16   2HE   LYS   2          HE2       LYS   2   0.762  -6.342  -2.480
   17   1HZ   LYS   2          HZ1       LYS   2  -1.516  -5.127  -1.361
   18   2HZ   LYS   2          HZ2       LYS   2  -0.278  -5.962  -0.548
   19   3HZ   LYS   2          HZ3       LYS   2  -0.154  -4.287  -0.803
   20    H    LEU   3           HN       LEU   3   5.672  -3.133  -1.836
   21    HA   LEU   3           HA       LEU   3   7.610  -1.591  -3.215
   22   1HB   LEU   3          HB1       LEU   3   7.817  -2.610  -0.879
   23   2HB   LEU   3          HB2       LEU   3   8.147  -4.155  -1.639
   24    HG   LEU   3           HG       LEU   3   9.847  -1.855  -2.632
   25   1HD1  LEU   3          HD1       LEU   3  10.186  -2.960   0.159
   26   2HD1  LEU   3          HD1       LEU   3  11.309  -1.868  -0.722
   27   3HD1  LEU   3          HD1       LEU   3   9.677  -1.307  -0.304
   28   1HD2  LEU   3          HD2       LEU   3  10.594  -4.584  -1.538
   29   2HD2  LEU   3          HD2       LEU   3  10.238  -4.270  -3.259
   30   3HD2  LEU   3          HD2       LEU   3  11.626  -3.459  -2.480
   31    H    ILE   4           HN       ILE   4   9.405  -2.399  -4.426
   32    HA   ILE   4           HA       ILE   4   8.835  -4.799  -6.088
   33    HB   ILE   4           HB       ILE   4   9.773  -3.415  -8.058
   34   1HG1  ILE   4          HG1       ILE   4   8.720  -1.046  -6.481
   35   2HG1  ILE   4          HG1       ILE   4  10.441  -1.408  -6.610
   36   1HG2  ILE   4          HG2       ILE   4   7.536  -4.273  -7.874
   37   2HG2  ILE   4          HG2       ILE   4   7.046  -2.863  -6.887
   38   3HG2  ILE   4          HG2       ILE   4   7.483  -2.657  -8.615
   39   1HD1  ILE   4          HD1       ILE   4   9.751   0.161  -8.381
   40   2HD1  ILE   4          HD2       ILE   4  10.246  -1.421  -9.058
   41   3HD1  ILE   4          HD3       ILE   4   8.506  -0.984  -8.922
   42    H    GLY   5           HN       GLY   5  11.217  -2.389  -5.060
   43   1HA   GLY   5          HA1       GLY   5  13.184  -4.287  -4.396
   44   2HA   GLY   5          HA2       GLY   5  13.482  -3.781  -6.063
   45    H    SER   6           HN       SER   6  15.424  -2.746  -5.567
   46    HA   SER   6           HA       SER   6  15.431  -0.575  -3.657
   47   1HB   SER   6          HB1       SER   6  17.766  -1.362  -5.405
   48   2HB   SER   6          HB2       SER   6  17.669  -0.930  -3.702
   49    HG   SER   6           HG       SER   6  17.790  -3.295  -4.616
   50    H    CYS   7           HN       CYS   7  16.824   1.289  -4.568
   51    HA   CYS   7           HA       CYS   7  16.018   2.111  -7.331
   52   1HB   CYS   7          HB1       CYS   7  14.307   3.138  -5.883
   53   2HB   CYS   7          HB2       CYS   7  15.506   3.691  -4.745
   54    H    VAL   8           HN       VAL   8  18.430   1.194  -6.907
   55    HA   VAL   8           HA       VAL   8  20.162   3.605  -6.911
   56    HB   VAL   8           HB       VAL   8  20.905   0.985  -5.545
   57   1HG1  VAL   8          HG1       VAL   8  22.749   2.246  -4.559
   58   2HG1  VAL   8          HG1       VAL   8  22.842   2.201  -6.340
   59   3HG1  VAL   8          HG1       VAL   8  22.255   3.677  -5.514
   60   1HG2  VAL   8          HG2       VAL   8  20.008   3.561  -4.260
   61   2HG2  VAL   8          HG2       VAL   8  19.151   1.987  -4.252
   62   3HG2  VAL   8          HG2       VAL   8  20.732   2.136  -3.442
   63    H    TRP   9           HN       TRP   9  21.250   3.644  -8.748
   64    HA   TRP   9           HA       TRP   9  21.328   1.343 -10.523
   65   1HB   TRP   9          HB1       TRP   9  21.042   3.580 -11.486
   66   2HB   TRP   9          HB2       TRP   9  22.482   4.161 -10.669
   67    HD1  TRP   9           HD1      TRP   9  23.512   5.040 -12.897
   68    HE1  TRP   9           HE1      TRP   9  24.643   3.807 -14.758
   69    HE3  TRP   9           HE3      TRP   9  22.112   0.230 -11.930
   70    HZ2  TRP   9           HZ2      TRP   9  24.996   1.207 -15.813
   71    HZ3  TRP   9           HZ3      TRP   9  22.867  -1.590 -13.376
   72    HH2  TRP   9           HH2      TRP   9  24.311  -1.119 -15.329
   73    H    GLY  10           HN       GLY  10  22.390   0.202  -8.686
   74   1HA   GLY  10          HA1       GLY  10  24.880  -0.778  -9.166
   75   2HA   GLY  10          HA2       GLY  10  25.263   0.691  -8.275
   76    H    ALA  11           HN       ALA  11  22.806  -1.867  -7.976
   77    HA   ALA  11           HA       ALA  11  23.849  -2.804  -5.454
   78   1HB   ALA  11          HB1       ALA  11  21.825  -2.182  -4.134
   79   2HB   ALA  11          HB2       ALA  11  22.685  -0.739  -4.745
   80   3HB   ALA  11          HB3       ALA  11  21.201  -1.315  -5.566
   81    H    VAL  12           HN       VAL  12  22.039  -4.264  -4.478
   82    HA   VAL  12           HA       VAL  12  21.323  -6.170  -6.578
   83    HB   VAL  12           HB       VAL  12  20.486  -6.484  -3.690
   84   1HG1  VAL  12          HG1       VAL  12  19.890  -8.271  -5.189
   85   2HG1  VAL  12          HG1       VAL  12  21.605  -8.431  -5.704
   86   3HG1  VAL  12          HG1       VAL  12  21.114  -8.812  -4.025
   87   1HG2  VAL  12          HG2       VAL  12  23.320  -6.869  -4.696
   88   2HG2  VAL  12          HG2       VAL  12  22.790  -5.659  -3.488
   89   3HG2  VAL  12          HG2       VAL  12  22.700  -7.393  -3.098
   90    H    ASN  13           HN       ASN  13  19.089  -7.141  -6.391
   91    HA   ASN  13           HA       ASN  13  16.839  -6.805  -6.992
   92   1HB   ASN  13          HB1       ASN  13  16.915  -5.185  -4.477
   93   2HB   ASN  13          HB2       ASN  13  15.500  -5.958  -5.140
   94   1HD2  ASN  13          HD2       ASN  13  15.064  -8.038  -4.236
   95   2HD2  ASN  13          HD2       ASN  13  16.230  -8.981  -3.433
   96    H    TYR  14           HN       TYR  14  18.849  -4.926  -7.965
   97    HA   TYR  14           HA       TYR  14  17.990  -2.252  -7.924
   98   1HB   TYR  14          HB1       TYR  14  20.203  -2.831  -8.805
   99   2HB   TYR  14          HB2       TYR  14  19.509  -3.896 -10.016
  100    HD1  TYR  14           HD1      TYR  14  18.824  -0.312  -9.036
  101    HD2  TYR  14           HD2      TYR  14  19.860  -3.033 -12.142
  102    HE1  TYR  14           HE1      TYR  14  18.790   1.519 -10.657
  103    HE2  TYR  14           HE2      TYR  14  19.835  -1.187 -13.757
  104    HH   TYR  14           HH       TYR  14  18.600   1.170 -13.856
  105    H    THR  15           HN       THR  15  16.474  -1.125  -8.959
  106    HA   THR  15           HA       THR  15  14.465  -2.611 -10.488
  107    HB   THR  15           HB       THR  15  14.574   0.119  -9.161
  108    HG1  THR  15           HG1      THR  15  12.998  -2.196  -8.671
  109   1HG2  THR  15          HG2       THR  15  12.164  -1.211 -10.460
  110   2HG2  THR  15          HG2       THR  15  12.204   0.304  -9.506
  111   3HG2  THR  15          HG2       THR  15  12.997   0.232 -11.109
  112    H    SER  16           HN       SER  16  15.590   0.727 -10.867
  113    HA   SER  16           HA       SER  16  16.652   1.746 -12.719
  114   1HB   SER  16          HB1       SER  16  17.340  -0.718 -13.619
  115   2HB   SER  16          HB2       SER  16  15.864  -0.583 -14.552
  116    HG   SER  16           HG       SER  16  16.693   0.861 -15.749
  117    H    ASP  17           HN       ASP  17  13.782  -0.186 -13.105
  118    HA   ASP  17           HA       ASP  17  12.368   2.143 -14.278
  119   1HB   ASP  17          HB1       ASP  17  11.288   0.527 -15.883
  120   2HB   ASP  17          HB2       ASP  17  13.012   0.742 -16.102
  121    H    CYS  18           HN       CYS  18  11.726   2.348 -12.070
  122    HA   CYS  18           HA       CYS  18  10.282   0.521 -10.502
  123   1HB   CYS  18          HB1       CYS  18  11.114   3.048 -10.244
  124   2HB   CYS  18          HB2       CYS  18   9.480   3.462 -10.703
  125    H    ASN  19           HN       ASN  19   8.939   2.860 -12.774
  126    HA   ASN  19           HA       ASN  19   6.284   1.921 -12.861
  127   1HB   ASN  19          HB1       ASN  19   7.956   3.123 -15.145
  128   2HB   ASN  19          HB2       ASN  19   6.242   2.847 -15.234
  129   1HD2  ASN  19          HD2       ASN  19   6.939   3.747 -12.096
  130   2HD2  ASN  19          HD2       ASN  19   6.666   5.397 -12.194
  131    H    GLY  20           HN       GLY  20   9.140   0.784 -14.403
  132   1HA   GLY  20          HA1       GLY  20   7.876  -1.028 -16.252
  133   2HA   GLY  20          HA2       GLY  20   9.562  -1.069 -15.793
  134    H    GLU  21           HN       GLU  21   9.812  -1.825 -13.456
  135    HA   GLU  21           HA       GLU  21   9.097  -4.509 -13.152
  136   1HB   GLU  21          HB1       GLU  21  10.820  -3.012 -11.821
  137   2HB   GLU  21          HB2       GLU  21   9.482  -2.537 -10.839
  138   1HG   GLU  21          HG1       GLU  21   9.132  -4.622  -9.876
  139   2HG   GLU  21          HG2       GLU  21  10.020  -5.489 -11.103
  140    H    CYS  22           HN       CYS  22   7.400  -1.671 -12.094
  141    HA   CYS  22           HA       CYS  22   5.353  -3.116 -10.683
  142   1HB   CYS  22          HB1       CYS  22   5.715  -0.272 -11.612
  143   2HB   CYS  22          HB2       CYS  22   4.239  -0.759 -10.896
  144    H    LEU  23           HN       LEU  23   5.671  -1.652 -13.955
  145    HA   LEU  23           HA       LEU  23   3.023  -2.212 -14.752
  146   1HB   LEU  23          HB1       LEU  23   5.674  -1.624 -16.067
  147   2HB   LEU  23          HB2       LEU  23   4.396  -2.208 -17.054
  148    HG   LEU  23           HG       LEU  23   4.000   0.202 -15.173
  149   1HD1  LEU  23          HD1       LEU  23   4.415   1.672 -17.073
  150   2HD1  LEU  23          HD1       LEU  23   5.858   0.689 -16.730
  151   3HD1  LEU  23          HD1       LEU  23   4.800   0.258 -18.110
  152   1HD2  LEU  23          HD2       LEU  23   1.958  -0.844 -16.038
  153   2HD2  LEU  23          HD2       LEU  23   2.201   0.796 -16.696
  154   3HD2  LEU  23          HD2       LEU  23   2.571  -0.638 -17.705
  155    H    LEU  24           HN       LEU  24   5.951  -4.055 -14.492
  156    HA   LEU  24           HA       LEU  24   5.213  -6.282 -16.128
  157   1HB   LEU  24          HB1       LEU  24   7.299  -5.427 -14.277
  158   2HB   LEU  24          HB2       LEU  24   6.874  -7.056 -13.922
  159    HG   LEU  24           HG       LEU  24   7.542  -5.968 -16.700
  160   1HD1  LEU  24          HD1       LEU  24   9.339  -7.434 -14.733
  161   2HD1  LEU  24          HD1       LEU  24   9.765  -6.984 -16.411
  162   3HD1  LEU  24          HD1       LEU  24   9.456  -5.707 -15.205
  163   1HD2  LEU  24          HD2       LEU  24   6.279  -8.087 -16.700
  164   2HD2  LEU  24          HD2       LEU  24   7.945  -8.333 -17.288
  165   3HD2  LEU  24          HD2       LEU  24   7.504  -8.818 -15.622
  166    H    ARG  25           HN       ARG  25   4.608  -5.384 -12.911
  167    HA   ARG  25           HA       ARG  25   3.058  -7.852 -12.328
  168   1HB   ARG  25          HB1       ARG  25   3.702  -5.483 -10.494
  169   2HB   ARG  25          HB2       ARG  25   2.622  -6.765 -10.021
  170   1HG   ARG  25          HG1       ARG  25   4.474  -7.622  -9.102
  171   2HG   ARG  25          HG2       ARG  25   4.748  -8.266 -10.709
  172   1HD   ARG  25          HD1       ARG  25   6.161  -6.459 -11.296
  173   2HD   ARG  25          HD2       ARG  25   5.776  -5.502  -9.881
  174    HE   ARG  25           HE       ARG  25   6.714  -7.610  -8.669
  175   1HH1  ARG  25          HH1       ARG  25  10.124  -6.901  -9.382
  176   2HH1  ARG  25          HH1       ARG  25   8.951  -6.702  -8.188
  177   1HH2  ARG  25          HH2       ARG  25   9.316  -7.612 -11.597
  178   2HH2  ARG  25          HH2       ARG  25   7.609  -7.780 -11.776
  179    H    GLY  26           HN       GLY  26   2.387  -5.243 -13.977
  180   1HA   GLY  26          HA1       GLY  26   0.345  -4.341 -14.732
  181   2HA   GLY  26          HA2       GLY  26  -0.471  -5.591 -13.792
  182    H    TYR  27           HN       TYR  27   1.783  -3.612 -12.179
  183    HA   TYR  27           HA       TYR  27  -0.313  -2.567 -10.449
  184   1HB   TYR  27          HB1       TYR  27   2.688  -2.184 -10.587
  185   2HB   TYR  27          HB2       TYR  27   1.740  -1.304  -9.427
  186    HD1  TYR  27           HD1      TYR  27   4.014  -3.243  -8.961
  187    HD2  TYR  27           HD2      TYR  27  -0.188  -3.845  -8.828
  188    HE1  TYR  27           HE1      TYR  27   4.331  -5.034  -7.350
  189    HE2  TYR  27           HE2      TYR  27   0.116  -5.633  -7.234
  190    HH   TYR  27           HH       TYR  27   2.108  -7.283  -6.614
  191    H    LYS  28           HN       LYS  28  -0.840  -0.470 -10.111
  192    HA   LYS  28           HA       LYS  28  -1.399   1.150 -12.280
  193   1HB   LYS  28          HB1       LYS  28  -0.837   1.953  -9.374
  194   2HB   LYS  28          HB2       LYS  28  -1.530   3.045 -10.551
  195   1HG   LYS  28          HG1       LYS  28  -3.616   2.217 -10.166
  196   2HG   LYS  28          HG2       LYS  28  -3.114   0.657 -10.748
  197   1HD   LYS  28          HD1       LYS  28  -3.599  -0.158  -8.700
  198   2HD   LYS  28          HD2       LYS  28  -2.137   0.595  -8.143
  199   1HE   LYS  28          HE1       LYS  28  -4.899   1.950  -8.138
  200   2HE   LYS  28          HE2       LYS  28  -4.176   1.176  -6.741
  201   1HZ   LYS  28          HZ1       LYS  28  -2.272   2.955  -7.697
  202   2HZ   LYS  28          HZ2       LYS  28  -3.729   3.822  -7.629
  203   3HZ   LYS  28          HZ3       LYS  28  -3.110   2.994  -6.278
  204    H    GLY  29           HN       GLY  29   1.451   1.191 -10.234
  205   1HA   GLY  29          HA1       GLY  29   3.279   1.894 -12.219
  206   2HA   GLY  29          HA2       GLY  29   2.730   3.419 -11.508
  207    H    GLY  30           HN       GLY  30   5.071   3.511 -10.949
  208   1HA   GLY  30          HA1       GLY  30   5.414   2.844  -8.188
  209   2HA   GLY  30          HA2       GLY  30   6.518   1.915  -9.228
  210    H    HIS  31           HN       HIS  31   7.240   3.706  -7.263
  211    HA   HIS  31           HA       HIS  31   8.887   5.586  -8.801
  212   1HB   HIS  31          HB1       HIS  31   8.141   7.598  -7.492
  213   2HB   HIS  31          HB2       HIS  31   6.752   6.889  -8.327
  214    HD1  HIS  31           HD1      HIS  31   5.302   5.277  -6.861
  215    HD2  HIS  31           HD2      HIS  31   7.914   7.499  -4.534
  216    HE1  HIS  31           HE1      HIS  31   4.499   5.042  -4.523
  217    HE2  HIS  31           HE2      HIS  31   6.101   6.418  -3.177
  218    H    CYS  32           HN       CYS  32  10.544   6.584  -7.495
  219    HA   CYS  32           HA       CYS  32  11.453   4.772  -5.400
  220   1HB   CYS  32          HB1       CYS  32  12.570   7.407  -6.412
  221   2HB   CYS  32          HB2       CYS  32  13.362   6.363  -5.254
  222    H    GLY  33           HN       GLY  33  11.725   5.308  -3.241
  223   1HA   GLY  33          HA1       GLY  33   9.804   6.323  -1.722
  224   2HA   GLY  33          HA2       GLY  33  11.437   6.658  -1.266
  225    H    SER  34           HN       SER  34  12.249   8.448  -3.051
  226    HA   SER  34           HA       SER  34  10.359  10.589  -3.527
  227   1HB   SER  34          HB1       SER  34  10.780  10.730  -0.964
  228   2HB   SER  34          HB2       SER  34  12.447  11.188  -1.351
  229    HG   SER  34           HG       SER  34  10.214  12.687  -1.523
  230    H    PHE  35           HN       PHE  35  13.800   9.983  -2.884
  231    HA   PHE  35           HA       PHE  35  14.596  10.510  -5.580
  232   1HB   PHE  35          HB1       PHE  35  14.018  12.829  -4.448
  233   2HB   PHE  35          HB2       PHE  35  15.515  12.605  -3.576
  234    HD1  PHE  35           HD1      PHE  35  17.708  12.282  -4.929
  235    HD2  PHE  35           HD2      PHE  35  14.046  13.546  -6.708
  236    HE1  PHE  35           HE1      PHE  35  18.940  13.107  -6.880
  237    HE2  PHE  35           HE2      PHE  35  15.286  14.377  -8.661
  238    HZ   PHE  35           HZ       PHE  35  17.736  14.157  -8.751
  239    H    ALA  36           HN       ALA  36  15.427   8.515  -5.083
  240    HA   ALA  36           HA       ALA  36  17.288   7.164  -4.917
  241   1HB   ALA  36          HB1       ALA  36  19.392   7.928  -3.998
  242   2HB   ALA  36          HB2       ALA  36  18.776   9.149  -5.155
  243   3HB   ALA  36          HB3       ALA  36  18.656   9.420  -3.382
  244    H    ASN  37           HN       ASN  37  15.117   7.388  -3.144
  245    HA   ASN  37           HA       ASN  37  15.784   7.215  -0.404
  246   1HB   ASN  37          HB1       ASN  37  13.416   7.332  -0.971
  247   2HB   ASN  37          HB2       ASN  37  13.511   5.871  -1.956
  248   1HD2  ASN  37          HD2       ASN  37  14.102   6.837   1.526
  249   2HD2  ASN  37          HD2       ASN  37  13.468   5.381   2.123
  250    H    VAL  38           HN       VAL  38  16.388   5.158  -2.979
  251    HA   VAL  38           HA       VAL  38  17.831   3.352  -3.108
  252    HB   VAL  38           HB       VAL  38  18.427   4.129  -0.535
  253   1HG1  VAL  38          HG1       VAL  38  17.485   1.261  -0.221
  254   2HG1  VAL  38          HG1       VAL  38  18.375   2.227   1.000
  255   3HG1  VAL  38          HG1       VAL  38  16.699   2.653   0.573
  256   1HG2  VAL  38          HG2       VAL  38  19.996   3.348  -1.964
  257   2HG2  VAL  38          HG2       VAL  38  20.136   2.423  -0.456
  258   3HG2  VAL  38          HG2       VAL  38  19.369   1.652  -1.868
  259    H    ASN  39           HN       ASN  39  14.704   3.539  -1.855
  260    HA   ASN  39           HA       ASN  39  14.215   0.746  -2.684
  261   1HB   ASN  39          HB1       ASN  39  13.085   2.166  -0.241
  262   2HB   ASN  39          HB2       ASN  39  12.339   0.770  -0.974
  263   1HD2  ASN  39          HD2       ASN  39  13.255  -1.329  -0.365
  264   2HD2  ASN  39          HD2       ASN  39  14.681  -1.433   0.545
  265    H    CYS  40           HN       CYS  40  12.554   0.453  -4.010
  266    HA   CYS  40           HA       CYS  40  10.981   2.900  -4.719
  267   1HB   CYS  40          HB1       CYS  40  12.591   1.236  -6.376
  268   2HB   CYS  40          HB2       CYS  40  10.960   0.746  -6.723
  269    H    TRP  41           HN       TRP  41   8.848   2.710  -4.930
  270    HA   TRP  41           HA       TRP  41   7.573   0.151  -4.072
  271   1HB   TRP  41          HB1       TRP  41   6.703   2.933  -3.174
  272   2HB   TRP  41          HB2       TRP  41   6.000   1.408  -2.682
  273    HD1  TRP  41           HD1      TRP  41   9.496   3.211  -2.474
  274    HE1  TRP  41           HE1      TRP  41  10.481   2.418  -0.318
  275    HE3  TRP  41           HE3      TRP  41   5.948  -0.008  -1.028
  276    HZ2  TRP  41           HZ2      TRP  41   9.887   0.588   1.890
  277    HZ3  TRP  41           HZ3      TRP  41   6.120  -1.280   1.066
  278    HH2  TRP  41           HH2      TRP  41   8.096  -0.986   2.538
  279    H    CYS  42           HN       CYS  42   5.369  -0.134  -4.791
  280    HA   CYS  42           HA       CYS  42   5.057   1.161  -7.399
  281   1HB   CYS  42          HB1       CYS  42   3.569  -1.068  -6.060
  282   2HB   CYS  42          HB2       CYS  42   3.037  -0.370  -7.575
  283    H    GLU  43           HN       GLU  43   2.788   1.896  -7.896
  284    HA   GLU  43           HA       GLU  43   1.919   3.834  -5.872
  285   1HB   GLU  43          HB1       GLU  43   2.196   3.849  -8.805
  286   2HB   GLU  43          HB2       GLU  43   0.607   4.382  -8.360
  287   1HG   GLU  43          HG1       GLU  43   1.376   6.407  -7.755
  288   2HG   GLU  43          HG2       GLU  43   2.534   5.720  -6.630
  289    H    THR  44           HN       THR  44   1.168   1.585  -5.093
  290    HA   THR  44           HA       THR  44  -1.504   0.951  -6.190
  291    HB   THR  44           HB       THR  44  -0.317  -1.064  -5.642
  292    HG1  THR  44           HG1      THR  44  -2.162  -0.153  -3.769
  293   1HG2  THR  44          HG2       THR  44   0.069   0.068  -2.860
  294   2HG2  THR  44          HG2       THR  44   0.634  -1.504  -3.466
  295   3HG2  THR  44          HG2       THR  44   1.384  -0.002  -4.086
  Start of MODEL   11
    1   1H    ASP   1          HT1       ASP   1   0.300   0.907   0.051
    2   2H    ASP   1          HT2       ASP   1   1.335  -0.255   0.778
    3   3H    ASP   1          HT3       ASP   1   1.639   1.430   0.929
    4    HA   ASP   1           HA       ASP   1   1.530   0.841  -1.792
    5   1HB   ASP   1          HB1       ASP   1   4.181   1.138  -0.365
    6   2HB   ASP   1          HB2       ASP   1   3.625   1.936  -1.823
    7    H    LYS   2           HN       LYS   2   2.809  -0.517  -2.986
    8    HA   LYS   2           HA       LYS   2   3.643  -3.044  -1.642
    9   1HB   LYS   2          HB1       LYS   2   1.744  -2.545  -3.640
   10   2HB   LYS   2          HB2       LYS   2   3.073  -3.289  -4.511
   11   1HG   LYS   2          HG1       LYS   2   1.563  -4.391  -2.096
   12   2HG   LYS   2          HG2       LYS   2   1.372  -4.918  -3.758
   13   1HD   LYS   2          HD1       LYS   2   3.776  -5.624  -3.797
   14   2HD   LYS   2          HD2       LYS   2   3.933  -5.190  -2.104
   15   1HE   LYS   2          HE1       LYS   2   1.975  -6.810  -1.635
   16   2HE   LYS   2          HE2       LYS   2   2.114  -7.336  -3.304
   17   1HZ   LYS   2          HZ1       LYS   2   3.628  -8.179  -1.097
   18   2HZ   LYS   2          HZ2       LYS   2   3.761  -8.685  -2.714
   19   3HZ   LYS   2          HZ3       LYS   2   4.675  -7.375  -2.174
   20    H    LEU   3           HN       LEU   3   5.714  -3.229  -1.621
   21    HA   LEU   3           HA       LEU   3   7.509  -1.685  -3.293
   22   1HB   LEU   3          HB1       LEU   3   7.935  -2.237  -0.901
   23   2HB   LEU   3          HB2       LEU   3   8.012  -3.934  -1.288
   24    HG   LEU   3           HG       LEU   3   9.973  -2.051  -2.659
   25   1HD1  LEU   3          HD1       LEU   3  10.022  -1.451  -0.291
   26   2HD1  LEU   3          HD1       LEU   3  10.236  -3.171   0.157
   27   3HD1  LEU   3          HD1       LEU   3  11.507  -2.296  -0.769
   28   1HD2  LEU   3          HD2       LEU   3  10.259  -4.844  -1.485
   29   2HD2  LEU   3          HD2       LEU   3   9.943  -4.518  -3.208
   30   3HD2  LEU   3          HD2       LEU   3  11.465  -3.948  -2.466
   31    H    ILE   4           HN       ILE   4   9.167  -2.671  -4.534
   32    HA   ILE   4           HA       ILE   4   8.445  -5.309  -5.742
   33    HB   ILE   4           HB       ILE   4   8.768  -4.415  -8.034
   34   1HG1  ILE   4          HG1       ILE   4   9.451  -1.758  -6.767
   35   2HG1  ILE   4          HG1       ILE   4  10.451  -2.733  -7.827
   36   1HG2  ILE   4          HG2       ILE   4   6.565  -4.326  -7.003
   37   2HG2  ILE   4          HG2       ILE   4   6.893  -2.649  -6.477
   38   3HG2  ILE   4          HG2       ILE   4   6.810  -3.052  -8.223
   39   1HD1  ILE   4          HD1       ILE   4   7.903  -1.264  -8.458
   40   2HD1  ILE   4          HD2       ILE   4   9.521  -0.979  -9.153
   41   3HD1  ILE   4          HD3       ILE   4   8.607  -2.460  -9.580
   42    H    GLY   5           HN       GLY   5  10.917  -2.767  -5.415
   43   1HA   GLY   5          HA1       GLY   5  12.946  -4.649  -4.722
   44   2HA   GLY   5          HA2       GLY   5  13.156  -4.170  -6.401
   45    H    SER   6           HN       SER   6  15.178  -3.238  -5.672
   46    HA   SER   6           HA       SER   6  14.955  -0.837  -4.020
   47   1HB   SER   6          HB1       SER   6  17.145  -2.769  -4.808
   48   2HB   SER   6          HB2       SER   6  17.587  -1.116  -4.507
   49    HG   SER   6           HG       SER   6  16.502  -1.257  -2.470
   50    H    CYS   7           HN       CYS   7  15.916   1.097  -4.739
   51    HA   CYS   7           HA       CYS   7  15.834   1.494  -7.711
   52   1HB   CYS   7          HB1       CYS   7  14.000   2.703  -6.723
   53   2HB   CYS   7          HB2       CYS   7  14.977   3.264  -5.389
   54    H    VAL   8           HN       VAL   8  18.076   0.560  -6.930
   55    HA   VAL   8           HA       VAL   8  19.946   2.864  -6.893
   56    HB   VAL   8           HB       VAL   8  20.151   0.324  -5.213
   57   1HG1  VAL   8          HG1       VAL   8  22.381   0.912  -6.107
   58   2HG1  VAL   8          HG1       VAL   8  22.161   2.590  -5.512
   59   3HG1  VAL   8          HG1       VAL   8  22.270   1.231  -4.356
   60   1HG2  VAL   8          HG2       VAL   8  18.734   1.940  -4.273
   61   2HG2  VAL   8          HG2       VAL   8  20.250   1.858  -3.329
   62   3HG2  VAL   8          HG2       VAL   8  19.963   3.226  -4.454
   63    H    TRP   9           HN       TRP   9  21.074   2.766  -8.700
   64    HA   TRP   9           HA       TRP   9  21.336   0.329 -10.291
   65   1HB   TRP   9          HB1       TRP   9  21.292   2.708 -11.352
   66   2HB   TRP   9          HB2       TRP   9  22.910   2.946 -10.692
   67    HD1  TRP   9           HD1      TRP   9  21.023   1.087 -13.482
   68    HE1  TRP   9           HE1      TRP   9  22.757  -0.116 -14.838
   69    HE3  TRP   9           HE3      TRP   9  25.103   1.862 -10.660
   70    HZ2  TRP   9           HZ2      TRP   9  25.558  -0.736 -14.828
   71    HZ3  TRP   9           HZ3      TRP   9  27.267   0.979 -11.290
   72    HH2  TRP   9           HH2      TRP   9  27.536  -0.327 -13.394
   73    H    GLY  10           HN       GLY  10  22.684  -1.188  -9.789
   74   1HA   GLY  10          HA1       GLY  10  25.121  -1.770  -9.676
   75   2HA   GLY  10          HA2       GLY  10  25.281  -0.504  -8.466
   76    H    ALA  11           HN       ALA  11  22.627  -1.243  -7.335
   77    HA   ALA  11           HA       ALA  11  23.648  -3.314  -5.518
   78   1HB   ALA  11          HB1       ALA  11  22.460  -1.316  -4.636
   79   2HB   ALA  11          HB2       ALA  11  21.016  -1.797  -5.581
   80   3HB   ALA  11          HB3       ALA  11  21.580  -2.820  -4.230
   81    H    VAL  12           HN       VAL  12  21.950  -4.933  -4.804
   82    HA   VAL  12           HA       VAL  12  21.218  -6.510  -7.149
   83    HB   VAL  12           HB       VAL  12  20.481  -7.256  -4.313
   84   1HG1  VAL  12          HG1       VAL  12  19.743  -8.809  -5.968
   85   2HG1  VAL  12          HG1       VAL  12  21.410  -8.927  -6.635
   86   3HG1  VAL  12          HG1       VAL  12  21.035  -9.526  -4.990
   87   1HG2  VAL  12          HG2       VAL  12  22.829  -6.523  -4.125
   88   2HG2  VAL  12          HG2       VAL  12  22.693  -8.291  -3.973
   89   3HG2  VAL  12          HG2       VAL  12  23.249  -7.568  -5.517
   90    H    ASN  13           HN       ASN  13  19.049  -7.569  -7.077
   91    HA   ASN  13           HA       ASN  13  16.777  -7.210  -7.619
   92   1HB   ASN  13          HB1       ASN  13  16.826  -6.123  -4.834
   93   2HB   ASN  13          HB2       ASN  13  15.388  -6.583  -5.688
   94   1HD2  ASN  13          HD2       ASN  13  14.720  -8.758  -5.475
   95   2HD2  ASN  13          HD2       ASN  13  15.723  -9.968  -4.823
   96    H    TYR  14           HN       TYR  14  18.662  -5.123  -8.253
   97    HA   TYR  14           HA       TYR  14  17.648  -2.534  -7.698
   98   1HB   TYR  14          HB1       TYR  14  19.890  -2.762  -8.496
   99   2HB   TYR  14          HB2       TYR  14  19.400  -3.765  -9.847
  100    HD1  TYR  14           HD1      TYR  14  20.007  -2.705 -11.746
  101    HD2  TYR  14           HD2      TYR  14  18.146  -0.395  -8.707
  102    HE1  TYR  14           HE1      TYR  14  19.978  -0.786 -13.229
  103    HE2  TYR  14           HE2      TYR  14  18.120   1.554 -10.208
  104    HH   TYR  14           HH       TYR  14  18.511   1.338 -13.434
  105    H    THR  15           HN       THR  15  16.212  -1.232  -8.789
  106    HA   THR  15           HA       THR  15  14.280  -2.635 -10.468
  107    HB   THR  15           HB       THR  15  14.358   0.016  -8.998
  108    HG1  THR  15           HG1      THR  15  12.420  -1.936  -8.713
  109   1HG2  THR  15          HG2       THR  15  12.032  -1.154 -10.603
  110   2HG2  THR  15          HG2       THR  15  12.055   0.307  -9.555
  111   3HG2  THR  15          HG2       THR  15  12.978   0.279 -11.084
  112    H    SER  16           HN       SER  16  15.587   0.652 -10.741
  113    HA   SER  16           HA       SER  16  16.702   1.660 -12.544
  114   1HB   SER  16          HB1       SER  16  17.330  -0.836 -13.398
  115   2HB   SER  16          HB2       SER  16  15.928  -0.622 -14.449
  116    HG   SER  16           HG       SER  16  16.907   0.847 -15.526
  117    H    ASP  17           HN       ASP  17  13.749  -0.082 -13.023
  118    HA   ASP  17           HA       ASP  17  12.519   2.344 -14.192
  119   1HB   ASP  17          HB1       ASP  17  11.454   0.886 -15.934
  120   2HB   ASP  17          HB2       ASP  17  13.209   0.854 -16.053
  121    H    CYS  18           HN       CYS  18  11.916   2.283 -11.839
  122    HA   CYS  18           HA       CYS  18  10.295   0.471 -10.506
  123   1HB   CYS  18          HB1       CYS  18  11.099   2.932  -9.946
  124   2HB   CYS  18          HB2       CYS  18   9.555   3.416 -10.593
  125    H    ASN  19           HN       ASN  19   8.889   3.019 -12.492
  126    HA   ASN  19           HA       ASN  19   6.297   2.158 -12.749
  127   1HB   ASN  19          HB1       ASN  19   7.388   4.180 -13.891
  128   2HB   ASN  19          HB2       ASN  19   7.927   3.085 -15.159
  129   1HD2  ASN  19          HD2       ASN  19   6.401   2.637 -16.808
  130   2HD2  ASN  19          HD2       ASN  19   4.762   3.082 -16.693
  131    H    GLY  20           HN       GLY  20   9.051   1.059 -14.651
  132   1HA   GLY  20          HA1       GLY  20   7.699  -0.836 -16.286
  133   2HA   GLY  20          HA2       GLY  20   9.415  -0.860 -15.909
  134    H    GLU  21           HN       GLU  21   9.844  -1.571 -13.658
  135    HA   GLU  21           HA       GLU  21   9.271  -4.254 -13.209
  136   1HB   GLU  21          HB1       GLU  21  10.971  -2.764 -12.209
  137   2HB   GLU  21          HB2       GLU  21   9.784  -2.033 -11.207
  138   1HG   GLU  21          HG1       GLU  21  10.834  -3.564  -9.732
  139   2HG   GLU  21          HG2       GLU  21   9.337  -4.342 -10.169
  140    H    CYS  22           HN       CYS  22   7.461  -1.508 -12.303
  141    HA   CYS  22           HA       CYS  22   5.515  -2.892 -10.658
  142   1HB   CYS  22          HB1       CYS  22   5.773  -0.124 -11.800
  143   2HB   CYS  22          HB2       CYS  22   4.251  -0.618 -11.187
  144    H    LEU  23           HN       LEU  23   5.634  -1.692 -14.031
  145    HA   LEU  23           HA       LEU  23   3.013  -2.490 -14.716
  146   1HB   LEU  23          HB1       LEU  23   5.586  -1.884 -16.191
  147   2HB   LEU  23          HB2       LEU  23   4.238  -2.523 -17.039
  148    HG   LEU  23           HG       LEU  23   4.101   0.016 -15.334
  149   1HD1  LEU  23          HD1       LEU  23   4.240   1.237 -17.469
  150   2HD1  LEU  23          HD1       LEU  23   5.712   0.275 -17.158
  151   3HD1  LEU  23          HD1       LEU  23   4.496  -0.307 -18.337
  152   1HD2  LEU  23          HD2       LEU  23   2.311  -1.049 -17.548
  153   2HD2  LEU  23          HD2       LEU  23   1.918  -1.039 -15.803
  154   3HD2  LEU  23          HD2       LEU  23   2.094   0.503 -16.680
  155    H    LEU  24           HN       LEU  24   6.082  -4.067 -14.479
  156    HA   LEU  24           HA       LEU  24   5.543  -6.443 -15.943
  157   1HB   LEU  24          HB1       LEU  24   7.557  -5.294 -14.178
  158   2HB   LEU  24          HB2       LEU  24   7.257  -6.915 -13.682
  159    HG   LEU  24           HG       LEU  24   7.897  -6.003 -16.508
  160   1HD1  LEU  24          HD1       LEU  24   9.777  -5.563 -14.981
  161   2HD1  LEU  24          HD1       LEU  24   9.714  -7.254 -14.399
  162   3HD1  LEU  24          HD1       LEU  24  10.162  -6.903 -16.095
  163   1HD2  LEU  24          HD2       LEU  24   6.743  -8.186 -16.389
  164   2HD2  LEU  24          HD2       LEU  24   8.438  -8.391 -16.912
  165   3HD2  LEU  24          HD2       LEU  24   7.970  -8.774 -15.228
  166    H    ARG  25           HN       ARG  25   4.814  -5.395 -12.853
  167    HA   ARG  25           HA       ARG  25   3.498  -7.962 -12.096
  168   1HB   ARG  25          HB1       ARG  25   4.635  -5.605 -10.564
  169   2HB   ARG  25          HB2       ARG  25   3.451  -6.639  -9.775
  170   1HG   ARG  25          HG1       ARG  25   4.799  -8.621 -10.036
  171   2HG   ARG  25          HG2       ARG  25   5.804  -7.894 -11.269
  172   1HD   ARG  25          HD1       ARG  25   5.835  -6.794  -8.436
  173   2HD   ARG  25          HD2       ARG  25   6.817  -8.194  -8.876
  174    HE   ARG  25           HE       ARG  25   7.017  -5.567 -10.372
  175   1HH1  ARG  25          HH1       ARG  25  10.084  -7.200 -11.175
  176   2HH1  ARG  25          HH1       ARG  25   8.505  -7.173 -11.840
  177   1HH2  ARG  25          HH2       ARG  25  10.296  -6.653  -8.865
  178   2HH2  ARG  25          HH2       ARG  25   8.856  -6.280  -7.974
  179    H    GLY  26           HN       GLY  26   2.620  -5.432 -13.728
  180   1HA   GLY  26          HA1       GLY  26   0.505  -4.610 -14.359
  181   2HA   GLY  26          HA2       GLY  26  -0.206  -5.847 -13.325
  182    H    TYR  27           HN       TYR  27   2.064  -3.906 -11.775
  183    HA   TYR  27           HA       TYR  27   0.008  -2.754 -10.071
  184   1HB   TYR  27          HB1       TYR  27   3.033  -2.455 -10.144
  185   2HB   TYR  27          HB2       TYR  27   2.083  -1.519  -9.039
  186    HD1  TYR  27           HD1      TYR  27   0.048  -3.719  -8.191
  187    HD2  TYR  27           HD2      TYR  27   4.284  -3.710  -8.662
  188    HE1  TYR  27           HE1      TYR  27   0.233  -5.480  -6.528
  189    HE2  TYR  27           HE2      TYR  27   4.460  -5.500  -6.985
  190    HH   TYR  27           HH       TYR  27   2.166  -7.432  -6.129
  191    H    LYS  28           HN       LYS  28   0.399  -0.389  -9.437
  192    HA   LYS  28           HA       LYS  28  -0.023   1.119 -11.920
  193   1HB   LYS  28          HB1       LYS  28  -0.218   2.030  -9.030
  194   2HB   LYS  28          HB2       LYS  28  -0.785   2.931 -10.407
  195   1HG   LYS  28          HG1       LYS  28  -2.807   1.917 -10.108
  196   2HG   LYS  28          HG2       LYS  28  -2.087   0.495 -10.810
  197   1HD   LYS  28          HD1       LYS  28  -2.580  -0.610  -8.866
  198   2HD   LYS  28          HD2       LYS  28  -1.285   0.303  -8.118
  199   1HE   LYS  28          HE1       LYS  28  -2.900   2.141  -7.536
  200   2HE   LYS  28          HE2       LYS  28  -4.189   1.226  -8.281
  201   1HZ   LYS  28          HZ1       LYS  28  -4.469   0.166  -6.354
  202   2HZ   LYS  28          HZ2       LYS  28  -2.893  -0.452  -6.400
  203   3HZ   LYS  28          HZ3       LYS  28  -3.205   1.045  -5.692
  204    H    GLY  29           HN       GLY  29   1.061   2.927 -12.445
  205   1HA   GLY  29          HA1       GLY  29   3.714   3.019 -12.673
  206   2HA   GLY  29          HA2       GLY  29   2.810   4.517 -12.474
  207    H    GLY  30           HN       GLY  30   4.905   2.215 -10.991
  208   1HA   GLY  30          HA1       GLY  30   4.744   3.291  -8.308
  209   2HA   GLY  30          HA2       GLY  30   5.977   2.177  -8.923
  210    H    HIS  31           HN       HIS  31   7.194   3.612  -7.482
  211    HA   HIS  31           HA       HIS  31   8.785   5.428  -9.088
  212   1HB   HIS  31          HB1       HIS  31   8.457   7.422  -7.498
  213   2HB   HIS  31          HB2       HIS  31   7.036   7.060  -8.460
  214    HD1  HIS  31           HD1      HIS  31   4.992   6.287  -7.175
  215    HD2  HIS  31           HD2      HIS  31   8.243   6.533  -4.597
  216    HE1  HIS  31           HE1      HIS  31   4.092   6.004  -4.908
  217    HE2  HIS  31           HE2      HIS  31   6.063   6.155  -3.401
  218    H    CYS  32           HN       CYS  32  10.494   6.505  -7.672
  219    HA   CYS  32           HA       CYS  32  11.627   4.391  -6.011
  220   1HB   CYS  32          HB1       CYS  32  12.601   7.132  -6.852
  221   2HB   CYS  32          HB2       CYS  32  13.502   6.067  -5.802
  222    H    GLY  33           HN       GLY  33  12.124   4.615  -3.827
  223   1HA   GLY  33          HA1       GLY  33  10.335   5.337  -2.031
  224   2HA   GLY  33          HA2       GLY  33  11.992   5.607  -1.665
  225    H    SER  34           HN       SER  34  12.836   7.727  -2.016
  226    HA   SER  34           HA       SER  34  10.987   9.905  -2.668
  227   1HB   SER  34          HB1       SER  34  10.502   9.416  -0.228
  228   2HB   SER  34          HB2       SER  34  12.198   9.717   0.163
  229    HG   SER  34           HG       SER  34  11.682  11.774   0.166
  230    H    PHE  35           HN       PHE  35  14.120   9.196  -1.117
  231    HA   PHE  35           HA       PHE  35  15.667  10.391  -3.165
  232   1HB   PHE  35          HB1       PHE  35  14.530  12.359  -1.881
  233   2HB   PHE  35          HB2       PHE  35  15.618  11.979  -0.570
  234    HD1  PHE  35           HD1      PHE  35  15.530  12.992  -4.143
  235    HD2  PHE  35           HD2      PHE  35  17.963  12.569  -0.671
  236    HE1  PHE  35           HE1      PHE  35  17.341  14.220  -5.261
  237    HE2  PHE  35           HE2      PHE  35  19.769  13.793  -1.790
  238    HZ   PHE  35           HZ       PHE  35  19.465  14.624  -4.086
  239    H    ALA  36           HN       ALA  36  16.607   8.436  -2.870
  240    HA   ALA  36           HA       ALA  36  18.540   7.251  -2.326
  241   1HB   ALA  36          HB1       ALA  36  19.574   9.290  -1.349
  242   2HB   ALA  36          HB2       ALA  36  18.750   8.938   0.207
  243   3HB   ALA  36          HB3       ALA  36  19.936   7.789  -0.437
  244    H    ASN  37           HN       ASN  37  15.810   6.849  -1.582
  245    HA   ASN  37           HA       ASN  37  15.762   5.586   0.999
  246   1HB   ASN  37          HB1       ASN  37  13.791   6.716  -0.225
  247   2HB   ASN  37          HB2       ASN  37  13.817   5.281  -1.269
  248   1HD2  ASN  37          HD2       ASN  37  12.755   6.512   1.828
  249   2HD2  ASN  37          HD2       ASN  37  12.112   5.040   2.368
  250    H    VAL  38           HN       VAL  38  16.816   4.814  -2.033
  251    HA   VAL  38           HA       VAL  38  17.349   2.874  -3.171
  252    HB   VAL  38           HB       VAL  38  18.753   1.378  -1.890
  253   1HG1  VAL  38          HG1       VAL  38  19.655   3.679  -2.295
  254   2HG1  VAL  38          HG1       VAL  38  18.993   4.178  -0.718
  255   3HG1  VAL  38          HG1       VAL  38  20.317   2.976  -0.786
  256   1HG2  VAL  38          HG2       VAL  38  17.787   2.609   0.689
  257   2HG2  VAL  38          HG2       VAL  38  17.417   0.960   0.088
  258   3HG2  VAL  38          HG2       VAL  38  19.094   1.410   0.497
  259    H    ASN  39           HN       ASN  39  14.645   3.047  -2.379
  260    HA   ASN  39           HA       ASN  39  13.873   0.229  -2.573
  261   1HB   ASN  39          HB1       ASN  39  12.511   2.068  -0.596
  262   2HB   ASN  39          HB2       ASN  39  12.103   0.486  -1.103
  263   1HD2  ASN  39          HD2       ASN  39  14.018   2.212   1.117
  264   2HD2  ASN  39          HD2       ASN  39  14.737   0.854   1.867
  265    H    CYS  40           HN       CYS  40  12.621   0.206  -4.370
  266    HA   CYS  40           HA       CYS  40  11.052   2.628  -5.062
  267   1HB   CYS  40          HB1       CYS  40  12.074   1.965  -7.040
  268   2HB   CYS  40          HB2       CYS  40  12.187   0.303  -6.571
  269    H    TRP  41           HN       TRP  41   8.963   2.633  -4.925
  270    HA   TRP  41           HA       TRP  41   7.554   0.126  -4.118
  271   1HB   TRP  41          HB1       TRP  41   7.034   2.963  -3.150
  272   2HB   TRP  41          HB2       TRP  41   5.959   1.613  -2.901
  273    HD1  TRP  41           HD1      TRP  41   9.666   2.639  -1.972
  274    HE1  TRP  41           HE1      TRP  41  10.098   1.431   0.180
  275    HE3  TRP  41           HE3      TRP  41   5.443  -0.025  -1.579
  276    HZ2  TRP  41           HZ2      TRP  41   8.845  -0.497   1.970
  277    HZ3  TRP  41           HZ3      TRP  41   5.047  -1.547   0.319
  278    HH2  TRP  41           HH2      TRP  41   6.745  -1.785   2.098
  279    H    CYS  42           HN       CYS  42   5.346  -0.042  -4.831
  280    HA   CYS  42           HA       CYS  42   5.041   1.271  -7.427
  281   1HB   CYS  42          HB1       CYS  42   3.662  -1.051  -6.153
  282   2HB   CYS  42          HB2       CYS  42   3.001  -0.273  -7.578
  283    H    GLU  43           HN       GLU  43   2.638   1.830  -7.929
  284    HA   GLU  43           HA       GLU  43   1.788   3.604  -5.692
  285   1HB   GLU  43          HB1       GLU  43   1.580   3.856  -8.715
  286   2HB   GLU  43          HB2       GLU  43   0.448   4.733  -7.695
  287   1HG   GLU  43          HG1       GLU  43   2.425   5.518  -6.277
  288   2HG   GLU  43          HG2       GLU  43   3.497   4.763  -7.444
  289    H    THR  44           HN       THR  44   1.260   1.496  -4.969
  290    HA   THR  44           HA       THR  44  -1.372   0.557  -5.770
  291    HB   THR  44           HB       THR  44  -0.759  -1.243  -3.961
  292    HG1  THR  44           HG1      THR  44   0.578   0.774  -3.330
  293   1HG2  THR  44          HG2       THR  44   1.470  -0.449  -5.922
  294   2HG2  THR  44          HG2       THR  44   1.109  -2.119  -5.369
  295   3HG2  THR  44          HG2       THR  44  -0.012  -1.300  -6.467
  Start of MODEL   12
    1   1H    ASP   1          HT1       ASP   1   0.803  -0.509   0.626
    2   2H    ASP   1          HT2       ASP   1   0.785   1.170   0.902
    3   3H    ASP   1          HT3       ASP   1  -0.271   0.518  -0.223
    4    HA   ASP   1           HA       ASP   1   1.178   0.783  -1.833
    5   1HB   ASP   1          HB1       ASP   1   3.618   1.342  -0.183
    6   2HB   ASP   1          HB2       ASP   1   2.906   2.276  -1.485
    7    H    LYS   2           HN       LYS   2   2.730  -0.453  -2.935
    8    HA   LYS   2           HA       LYS   2   3.540  -2.977  -1.588
    9   1HB   LYS   2          HB1       LYS   2   2.307  -2.426  -4.171
   10   2HB   LYS   2          HB2       LYS   2   3.905  -2.998  -4.493
   11   1HG   LYS   2          HG1       LYS   2   1.839  -4.442  -2.839
   12   2HG   LYS   2          HG2       LYS   2   2.222  -4.807  -4.520
   13   1HD   LYS   2          HD1       LYS   2   4.677  -5.172  -3.709
   14   2HD   LYS   2          HD2       LYS   2   4.025  -5.254  -2.082
   15   1HE   LYS   2          HE1       LYS   2   3.590  -7.144  -4.425
   16   2HE   LYS   2          HE2       LYS   2   4.116  -7.522  -2.799
   17   1HZ   LYS   2          HZ1       LYS   2   1.531  -7.554  -3.818
   18   2HZ   LYS   2          HZ2       LYS   2   1.999  -7.923  -2.236
   19   3HZ   LYS   2          HZ3       LYS   2   1.571  -6.319  -2.650
   20    H    LEU   3           HN       LEU   3   5.622  -3.833  -2.205
   21    HA   LEU   3           HA       LEU   3   7.606  -1.647  -2.554
   22   1HB   LEU   3          HB1       LEU   3   7.748  -3.118  -0.521
   23   2HB   LEU   3          HB2       LEU   3   7.976  -4.518  -1.542
   24    HG   LEU   3           HG       LEU   3   9.926  -2.213  -1.944
   25   1HD1  LEU   3          HD1       LEU   3   9.717  -2.332   0.466
   26   2HD1  LEU   3          HD1       LEU   3  10.042  -4.092   0.425
   27   3HD1  LEU   3          HD1       LEU   3  11.301  -2.928  -0.094
   28   1HD2  LEU   3          HD2       LEU   3  11.507  -4.047  -2.199
   29   2HD2  LEU   3          HD2       LEU   3  10.281  -5.225  -1.631
   30   3HD2  LEU   3          HD2       LEU   3  10.073  -4.416  -3.202
   31    H    ILE   4           HN       ILE   4   9.463  -2.178  -3.832
   32    HA   ILE   4           HA       ILE   4   8.958  -4.034  -6.123
   33    HB   ILE   4           HB       ILE   4  10.063  -1.212  -6.355
   34   1HG1  ILE   4          HG1       ILE   4   7.337  -2.413  -7.052
   35   2HG1  ILE   4          HG1       ILE   4   7.632  -1.249  -5.791
   36   1HG2  ILE   4          HG2       ILE   4   9.846  -1.613  -8.778
   37   2HG2  ILE   4          HG2       ILE   4  10.940  -2.798  -8.036
   38   3HG2  ILE   4          HG2       ILE   4   9.268  -3.281  -8.440
   39   1HD1  ILE   4          HD1       ILE   4   7.973  -0.805  -8.768
   40   2HD1  ILE   4          HD2       ILE   4   6.716  -0.123  -7.681
   41   3HD1  ILE   4          HD3       ILE   4   8.406   0.374  -7.482
   42    H    GLY   5           HN       GLY   5  11.336  -2.068  -4.372
   43   1HA   GLY   5          HA1       GLY   5  13.219  -3.996  -3.837
   44   2HA   GLY   5          HA2       GLY   5  13.587  -3.514  -5.493
   45    H    SER   6           HN       SER   6  15.585  -2.532  -4.981
   46    HA   SER   6           HA       SER   6  15.583  -0.357  -3.086
   47   1HB   SER   6          HB1       SER   6  17.694  -1.768  -4.695
   48   2HB   SER   6          HB2       SER   6  17.987  -0.551  -3.482
   49    HG   SER   6           HG       SER   6  17.941  -2.886  -3.040
   50    H    CYS   7           HN       CYS   7  16.611   1.585  -3.734
   51    HA   CYS   7           HA       CYS   7  16.537   2.297  -6.592
   52   1HB   CYS   7          HB1       CYS   7  14.327   2.931  -5.471
   53   2HB   CYS   7          HB2       CYS   7  15.242   4.007  -4.425
   54    H    VAL   8           HN       VAL   8  18.580   1.746  -4.552
   55    HA   VAL   8           HA       VAL   8  19.827   4.396  -4.115
   56    HB   VAL   8           HB       VAL   8  20.641   1.582  -3.245
   57   1HG1  VAL   8          HG1       VAL   8  22.646   2.957  -3.573
   58   2HG1  VAL   8          HG1       VAL   8  21.928   4.235  -2.544
   59   3HG1  VAL   8          HG1       VAL   8  22.357   2.645  -1.842
   60   1HG2  VAL   8          HG2       VAL   8  19.664   3.950  -1.668
   61   2HG2  VAL   8          HG2       VAL   8  18.742   2.451  -2.051
   62   3HG2  VAL   8          HG2       VAL   8  20.152   2.376  -0.974
   63    H    TRP   9           HN       TRP   9  21.484   5.076  -5.286
   64    HA   TRP   9           HA       TRP   9  22.132   3.622  -7.738
   65   1HB   TRP   9          HB1       TRP   9  22.228   6.408  -6.816
   66   2HB   TRP   9          HB2       TRP   9  23.822   5.955  -7.392
   67    HD1  TRP   9           HD1      TRP   9  24.098   6.363  -9.943
   68    HE1  TRP   9           HE1      TRP   9  22.474   6.239 -11.855
   69    HE3  TRP   9           HE3      TRP   9  19.938   5.051  -7.489
   70    HZ2  TRP   9           HZ2      TRP   9  19.687   5.641 -12.390
   71    HZ3  TRP   9           HZ3      TRP   9  17.793   4.689  -8.660
   72    HH2  TRP   9           HH2      TRP   9  17.661   4.980 -11.116
   73    H    GLY  10           HN       GLY  10  22.786   1.901  -6.205
   74   1HA   GLY  10          HA1       GLY  10  25.170   0.876  -6.445
   75   2HA   GLY  10          HA2       GLY  10  25.591   2.139  -5.293
   76    H    ALA  11           HN       ALA  11  23.129  -0.369  -5.691
   77    HA   ALA  11           HA       ALA  11  23.773  -1.539  -3.096
   78   1HB   ALA  11          HB1       ALA  11  21.466  -1.285  -2.213
   79   2HB   ALA  11          HB2       ALA  11  22.236   0.295  -2.524
   80   3HB   ALA  11          HB3       ALA  11  21.040  -0.380  -3.689
   81    H    VAL  12           HN       VAL  12  22.038  -3.303  -2.680
   82    HA   VAL  12           HA       VAL  12  22.044  -5.006  -5.054
   83    HB   VAL  12           HB       VAL  12  20.706  -5.752  -2.459
   84   1HG1  VAL  12          HG1       VAL  12  21.715  -7.941  -2.842
   85   2HG1  VAL  12          HG1       VAL  12  20.668  -7.428  -4.180
   86   3HG1  VAL  12          HG1       VAL  12  22.456  -7.321  -4.349
   87   1HG2  VAL  12          HG2       VAL  12  23.710  -5.671  -2.854
   88   2HG2  VAL  12          HG2       VAL  12  22.770  -4.694  -1.682
   89   3HG2  VAL  12          HG2       VAL  12  22.863  -6.459  -1.485
   90    H    ASN  13           HN       ASN  13  20.051  -6.248  -5.477
   91    HA   ASN  13           HA       ASN  13  17.910  -6.146  -6.527
   92   1HB   ASN  13          HB1       ASN  13  16.975  -4.727  -4.083
   93   2HB   ASN  13          HB2       ASN  13  16.120  -5.942  -4.987
   94   1HD2  ASN  13          HD2       ASN  13  16.001  -7.951  -3.788
   95   2HD2  ASN  13          HD2       ASN  13  17.187  -8.413  -2.658
   96    H    TYR  14           HN       TYR  14  19.747  -3.864  -6.777
   97    HA   TYR  14           HA       TYR  14  18.417  -1.367  -6.649
   98   1HB   TYR  14          HB1       TYR  14  20.758  -1.168  -6.946
   99   2HB   TYR  14          HB2       TYR  14  20.826  -2.428  -8.161
  100    HD1  TYR  14           HD1      TYR  14  20.362  -1.950 -10.490
  101    HD2  TYR  14           HD2      TYR  14  19.925   1.108  -7.585
  102    HE1  TYR  14           HE1      TYR  14  20.184  -0.288 -12.267
  103    HE2  TYR  14           HE2      TYR  14  19.752   2.771  -9.343
  104    HH   TYR  14           HH       TYR  14  19.643   3.130 -11.551
  105    H    THR  15           HN       THR  15  16.965  -0.380  -7.927
  106    HA   THR  15           HA       THR  15  16.040  -1.776 -10.350
  107    HB   THR  15           HB       THR  15  14.715  -0.007  -8.276
  108    HG1  THR  15           HG1      THR  15  15.135  -2.308  -7.994
  109   1HG2  THR  15          HG2       THR  15  13.403  -1.291 -10.702
  110   2HG2  THR  15          HG2       THR  15  12.617  -0.431  -9.355
  111   3HG2  THR  15          HG2       THR  15  13.632   0.484 -10.500
  112    H    SER  16           HN       SER  16  15.101  -0.304 -11.917
  113    HA   SER  16           HA       SER  16  16.370   2.368 -12.104
  114   1HB   SER  16          HB1       SER  16  16.503   0.362 -14.416
  115   2HB   SER  16          HB2       SER  16  17.348   1.916 -14.289
  116    HG   SER  16           HG       SER  16  18.595   1.116 -12.647
  117    H    ASP  17           HN       ASP  17  14.236   0.018 -13.667
  118    HA   ASP  17           HA       ASP  17  12.504   2.211 -14.653
  119   1HB   ASP  17          HB1       ASP  17  11.721   0.513 -16.278
  120   2HB   ASP  17          HB2       ASP  17  13.474   0.600 -16.323
  121    H    CYS  18           HN       CYS  18  11.960   2.243 -12.259
  122    HA   CYS  18           HA       CYS  18  10.563   0.212 -10.906
  123   1HB   CYS  18          HB1       CYS  18  11.315   2.557 -10.166
  124   2HB   CYS  18          HB2       CYS  18   9.797   3.180 -10.766
  125    H    ASN  19           HN       ASN  19   8.979   2.854 -12.707
  126    HA   ASN  19           HA       ASN  19   6.407   1.833 -12.796
  127   1HB   ASN  19          HB1       ASN  19   7.367   3.965 -13.968
  128   2HB   ASN  19          HB2       ASN  19   7.571   2.936 -15.367
  129   1HD2  ASN  19          HD2       ASN  19   4.854   1.535 -13.992
  130   2HD2  ASN  19          HD2       ASN  19   3.676   2.503 -14.733
  131    H    GLY  20           HN       GLY  20   9.163   0.831 -14.574
  132   1HA   GLY  20          HA1       GLY  20   7.860  -0.939 -16.449
  133   2HA   GLY  20          HA2       GLY  20   9.575  -0.991 -16.017
  134    H    GLU  21           HN       GLU  21   9.702  -1.591 -13.523
  135    HA   GLU  21           HA       GLU  21   9.093  -4.351 -13.367
  136   1HB   GLU  21          HB1       GLU  21  10.753  -2.887 -11.943
  137   2HB   GLU  21          HB2       GLU  21   9.432  -2.722 -10.824
  138   1HG   GLU  21          HG1       GLU  21   9.107  -5.163 -10.692
  139   2HG   GLU  21          HG2       GLU  21  10.419  -5.437 -11.850
  140    H    CYS  22           HN       CYS  22   7.344  -1.589 -12.388
  141    HA   CYS  22           HA       CYS  22   5.354  -3.090 -10.863
  142   1HB   CYS  22          HB1       CYS  22   5.816  -0.243 -11.537
  143   2HB   CYS  22          HB2       CYS  22   4.147  -0.673 -11.385
  144    H    LEU  23           HN       LEU  23   5.545  -1.662 -14.142
  145    HA   LEU  23           HA       LEU  23   2.943  -2.365 -14.960
  146   1HB   LEU  23          HB1       LEU  23   5.608  -1.809 -16.269
  147   2HB   LEU  23          HB2       LEU  23   4.293  -2.367 -17.234
  148    HG   LEU  23           HG       LEU  23   4.075   0.098 -15.445
  149   1HD1  LEU  23          HD1       LEU  23   5.890   0.378 -17.093
  150   2HD1  LEU  23          HD1       LEU  23   4.765  -0.072 -18.411
  151   3HD1  LEU  23          HD1       LEU  23   4.499   1.428 -17.463
  152   1HD2  LEU  23          HD2       LEU  23   2.240   0.708 -16.951
  153   2HD2  LEU  23          HD2       LEU  23   2.512  -0.799 -17.881
  154   3HD2  LEU  23          HD2       LEU  23   1.938  -0.876 -16.188
  155    H    LEU  24           HN       LEU  24   5.982  -4.049 -14.667
  156    HA   LEU  24           HA       LEU  24   5.336  -6.340 -16.232
  157   1HB   LEU  24          HB1       LEU  24   7.409  -5.351 -14.421
  158   2HB   LEU  24          HB2       LEU  24   7.086  -7.012 -14.099
  159    HG   LEU  24           HG       LEU  24   7.720  -5.835 -16.846
  160   1HD1  LEU  24          HD1       LEU  24   9.503  -7.386 -14.937
  161   2HD1  LEU  24          HD1       LEU  24   9.927  -6.858 -16.590
  162   3HD1  LEU  24          HD1       LEU  24   9.630  -5.637 -15.327
  163   1HD2  LEU  24          HD2       LEU  24   6.458  -7.960 -16.940
  164   2HD2  LEU  24          HD2       LEU  24   8.130  -8.168 -17.522
  165   3HD2  LEU  24          HD2       LEU  24   7.682  -8.715 -15.876
  166    H    ARG  25           HN       ARG  25   4.675  -5.408 -13.090
  167    HA   ARG  25           HA       ARG  25   3.383  -7.971 -12.307
  168   1HB   ARG  25          HB1       ARG  25   3.952  -5.411 -10.773
  169   2HB   ARG  25          HB2       ARG  25   2.737  -6.502 -10.171
  170   1HG   ARG  25          HG1       ARG  25   4.491  -7.287  -8.908
  171   2HG   ARG  25          HG2       ARG  25   4.720  -8.312 -10.299
  172   1HD   ARG  25          HD1       ARG  25   6.110  -5.627 -10.071
  173   2HD   ARG  25          HD2       ARG  25   6.870  -7.042  -9.395
  174    HE   ARG  25           HE       ARG  25   6.024  -6.787 -12.251
  175   1HH1  ARG  25          HH1       ARG  25   9.566  -7.421 -12.379
  176   2HH1  ARG  25          HH1       ARG  25   8.501  -6.054 -12.255
  177   1HH2  ARG  25          HH2       ARG  25   8.489  -9.578 -11.638
  178   2HH2  ARG  25          HH2       ARG  25   6.854  -9.421 -11.116
  179    H    GLY  26           HN       GLY  26   2.464  -5.461 -14.116
  180   1HA   GLY  26          HA1       GLY  26   0.356  -4.795 -14.922
  181   2HA   GLY  26          HA2       GLY  26  -0.349  -6.099 -13.963
  182    H    TYR  27           HN       TYR  27   1.691  -3.887 -12.344
  183    HA   TYR  27           HA       TYR  27  -0.528  -3.012 -10.687
  184   1HB   TYR  27          HB1       TYR  27   2.443  -2.279 -10.742
  185   2HB   TYR  27          HB2       TYR  27   1.348  -1.589  -9.585
  186    HD1  TYR  27           HD1      TYR  27  -0.251  -4.151  -8.890
  187    HD2  TYR  27           HD2      TYR  27   3.932  -3.444  -9.250
  188    HE1  TYR  27           HE1      TYR  27   0.189  -5.943  -7.322
  189    HE2  TYR  27           HE2      TYR  27   4.376  -5.243  -7.677
  190    HH   TYR  27           HH       TYR  27   3.116  -7.384  -6.940
  191    H    LYS  28           HN       LYS  28  -0.573  -0.626 -10.091
  192    HA   LYS  28           HA       LYS  28  -1.416   0.814 -12.451
  193   1HB   LYS  28          HB1       LYS  28  -0.914   2.032  -9.692
  194   2HB   LYS  28          HB2       LYS  28  -1.906   2.666 -10.969
  195   1HG   LYS  28          HG1       LYS  28  -3.558   1.811  -9.669
  196   2HG   LYS  28          HG2       LYS  28  -3.282   0.417 -10.694
  197   1HD   LYS  28          HD1       LYS  28  -2.311  -0.850  -8.979
  198   2HD   LYS  28          HD2       LYS  28  -1.637   0.568  -8.184
  199   1HE   LYS  28          HE1       LYS  28  -3.988   1.240  -7.520
  200   2HE   LYS  28          HE2       LYS  28  -4.602  -0.223  -8.261
  201   1HZ   LYS  28          HZ1       LYS  28  -2.627  -0.946  -6.243
  202   2HZ   LYS  28          HZ2       LYS  28  -3.670   0.194  -5.687
  203   3HZ   LYS  28          HZ3       LYS  28  -4.274  -1.250  -6.321
  204    H    GLY  29           HN       GLY  29   1.403   0.833 -10.369
  205   1HA   GLY  29          HA1       GLY  29   3.230   1.737 -12.231
  206   2HA   GLY  29          HA2       GLY  29   2.558   3.212 -11.525
  207    H    GLY  30           HN       GLY  30   5.031   3.156 -11.030
  208   1HA   GLY  30          HA1       GLY  30   5.263   2.642  -8.186
  209   2HA   GLY  30          HA2       GLY  30   6.364   1.664  -9.159
  210    H    HIS  31           HN       HIS  31   7.153   3.483  -7.279
  211    HA   HIS  31           HA       HIS  31   8.910   5.215  -8.811
  212   1HB   HIS  31          HB1       HIS  31   8.168   7.367  -7.688
  213   2HB   HIS  31          HB2       HIS  31   6.908   6.708  -8.718
  214    HD1  HIS  31           HD1      HIS  31   4.772   5.953  -7.512
  215    HD2  HIS  31           HD2      HIS  31   7.670   6.980  -4.738
  216    HE1  HIS  31           HE1      HIS  31   3.665   5.953  -5.321
  217    HE2  HIS  31           HE2      HIS  31   5.457   6.593  -3.686
  218    H    CYS  32           HN       CYS  32  10.422   6.411  -7.401
  219    HA   CYS  32           HA       CYS  32  11.163   4.704  -5.168
  220   1HB   CYS  32          HB1       CYS  32  12.370   7.240  -6.315
  221   2HB   CYS  32          HB2       CYS  32  13.087   6.284  -5.032
  222    H    GLY  33           HN       GLY  33  11.301   5.340  -3.064
  223   1HA   GLY  33          HA1       GLY  33   9.329   6.241  -1.582
  224   2HA   GLY  33          HA2       GLY  33  10.934   6.828  -1.190
  225    H    SER  34           HN       SER  34  11.451   8.934  -1.627
  226    HA   SER  34           HA       SER  34  10.045  10.731  -3.306
  227   1HB   SER  34          HB1       SER  34   9.194  10.839  -0.336
  228   2HB   SER  34          HB2       SER  34   9.119  12.256  -1.373
  229    HG   SER  34           HG       SER  34   7.986  10.001  -2.482
  230    H    PHE  35           HN       PHE  35  11.247  11.032  -0.020
  231    HA   PHE  35           HA       PHE  35  13.451  12.782  -1.062
  232   1HB   PHE  35          HB1       PHE  35  11.398  13.716   0.429
  233   2HB   PHE  35          HB2       PHE  35  12.376  13.098   1.743
  234    HD1  PHE  35           HD1      PHE  35  14.817  13.990   1.979
  235    HD2  PHE  35           HD2      PHE  35  11.946  15.757  -0.635
  236    HE1  PHE  35           HE1      PHE  35  16.164  16.028   1.867
  237    HE2  PHE  35           HE2      PHE  35  13.303  17.797  -0.736
  238    HZ   PHE  35           HZ       PHE  35  15.415  17.939   0.513
  239    H    ALA  36           HN       ALA  36  13.626   9.993  -0.807
  240    HA   ALA  36           HA       ALA  36  15.989   9.795   0.699
  241   1HB   ALA  36          HB1       ALA  36  15.183   7.997   2.247
  242   2HB   ALA  36          HB2       ALA  36  14.361   9.556   2.545
  243   3HB   ALA  36          HB3       ALA  36  13.528   8.259   1.630
  244    H    ASN  37           HN       ASN  37  15.618   9.510  -1.788
  245    HA   ASN  37           HA       ASN  37  14.911   7.258  -3.176
  246   1HB   ASN  37          HB1       ASN  37  16.414   9.485  -3.851
  247   2HB   ASN  37          HB2       ASN  37  17.708   8.325  -3.719
  248   1HD2  ASN  37          HD2       ASN  37  14.895   6.721  -4.928
  249   2HD2  ASN  37          HD2       ASN  37  15.332   6.901  -6.553
  250    H    VAL  38           HN       VAL  38  15.013   5.417  -1.932
  251    HA   VAL  38           HA       VAL  38  17.660   4.176  -1.735
  252    HB   VAL  38           HB       VAL  38  16.971   5.428   0.381
  253   1HG1  VAL  38          HG1       VAL  38  15.187   3.009   0.815
  254   2HG1  VAL  38          HG1       VAL  38  15.590   4.255   2.027
  255   3HG1  VAL  38          HG1       VAL  38  14.655   4.707   0.574
  256   1HG2  VAL  38          HG2       VAL  38  18.822   4.083   0.411
  257   2HG2  VAL  38          HG2       VAL  38  17.908   3.843   1.927
  258   3HG2  VAL  38          HG2       VAL  38  17.840   2.602   0.648
  259    H    ASN  39           HN       ASN  39  14.163   3.797  -1.312
  260    HA   ASN  39           HA       ASN  39  14.393   1.210  -2.744
  261   1HB   ASN  39          HB1       ASN  39  13.066   1.604  -0.016
  262   2HB   ASN  39          HB2       ASN  39  12.279   0.597  -1.189
  263   1HD2  ASN  39          HD2       ASN  39  15.850   0.426  -1.393
  264   2HD2  ASN  39          HD2       ASN  39  15.903  -1.106  -0.688
  265    H    CYS  40           HN       CYS  40  12.528   0.559  -3.787
  266    HA   CYS  40           HA       CYS  40  10.826   2.897  -4.592
  267   1HB   CYS  40          HB1       CYS  40  12.492   1.380  -6.244
  268   2HB   CYS  40          HB2       CYS  40  10.969   0.580  -6.499
  269    H    TRP  41           HN       TRP  41   8.694   2.541  -5.026
  270    HA   TRP  41           HA       TRP  41   7.473   0.060  -3.948
  271   1HB   TRP  41          HB1       TRP  41   6.611   2.871  -3.070
  272   2HB   TRP  41          HB2       TRP  41   5.959   1.351  -2.511
  273    HD1  TRP  41           HD1      TRP  41   9.419   3.247  -2.487
  274    HE1  TRP  41           HE1      TRP  41  10.595   2.415  -0.434
  275    HE3  TRP  41           HE3      TRP  41   6.067  -0.100  -0.868
  276    HZ2  TRP  41           HZ2      TRP  41  10.206   0.537   1.763
  277    HZ3  TRP  41           HZ3      TRP  41   6.418  -1.400   1.171
  278    HH2  TRP  41           HH2      TRP  41   8.491  -1.096   2.513
  279    H    CYS  42           HN       CYS  42   5.286  -0.190  -4.609
  280    HA   CYS  42           HA       CYS  42   4.828   0.930  -7.302
  281   1HB   CYS  42          HB1       CYS  42   4.375  -1.577  -6.251
  282   2HB   CYS  42          HB2       CYS  42   2.766  -0.886  -6.192
  283    H    GLU  43           HN       GLU  43   2.657   1.710  -7.725
  284    HA   GLU  43           HA       GLU  43   1.709   3.573  -5.664
  285   1HB   GLU  43          HB1       GLU  43   2.491   3.820  -8.348
  286   2HB   GLU  43          HB2       GLU  43   0.762   3.780  -8.478
  287   1HG   GLU  43          HG1       GLU  43   0.505   5.888  -7.669
  288   2HG   GLU  43          HG2       GLU  43   1.691   5.664  -6.395
  289    H    THR  44           HN       THR  44   0.983   1.251  -5.025
  290    HA   THR  44           HA       THR  44  -1.625   0.699  -6.216
  291    HB   THR  44           HB       THR  44  -0.245  -1.309  -5.821
  292    HG1  THR  44           HG1      THR  44  -2.288  -0.823  -3.940
  293   1HG2  THR  44          HG2       THR  44   0.340  -2.036  -3.586
  294   2HG2  THR  44          HG2       THR  44   1.034  -0.396  -3.826
  295   3HG2  THR  44          HG2       THR  44  -0.450  -0.617  -2.853
  Start of MODEL   13
    1   1H    ASP   1          HT1       ASP   1  -0.158   0.755  -0.303
    2   2H    ASP   1          HT2       ASP   1   0.477  -0.710   0.307
    3   3H    ASP   1          HT3       ASP   1   0.925   0.749   1.053
    4    HA   ASP   1           HA       ASP   1   1.491   0.798  -1.739
    5   1HB   ASP   1          HB1       ASP   1   3.751   1.394  -0.906
    6   2HB   ASP   1          HB2       ASP   1   2.702   2.024   0.340
    7    H    LYS   2           HN       LYS   2   3.560  -0.272  -2.334
    8    HA   LYS   2           HA       LYS   2   3.670  -3.107  -1.616
    9   1HB   LYS   2          HB1       LYS   2   1.765  -2.503  -3.336
   10   2HB   LYS   2          HB2       LYS   2   3.058  -2.415  -4.507
   11   1HG   LYS   2          HG1       LYS   2   2.093  -4.528  -4.708
   12   2HG   LYS   2          HG2       LYS   2   3.657  -4.801  -3.941
   13   1HD   LYS   2          HD1       LYS   2   2.406  -4.853  -1.683
   14   2HD   LYS   2          HD2       LYS   2   0.911  -4.669  -2.582
   15   1HE   LYS   2          HE1       LYS   2   1.440  -6.781  -3.855
   16   2HE   LYS   2          HE2       LYS   2   2.884  -6.987  -2.879
   17   1HZ   LYS   2          HZ1       LYS   2   0.260  -7.780  -2.252
   18   2HZ   LYS   2          HZ2       LYS   2   1.644  -7.990  -1.313
   19   3HZ   LYS   2          HZ3       LYS   2   0.709  -6.588  -1.140
   20    H    LEU   3           HN       LEU   3   5.791  -2.812  -1.129
   21    HA   LEU   3           HA       LEU   3   7.708  -1.377  -2.612
   22   1HB   LEU   3          HB1       LEU   3   8.014  -2.329  -0.271
   23   2HB   LEU   3          HB2       LEU   3   8.211  -3.913  -0.978
   24    HG   LEU   3           HG       LEU   3  10.051  -1.727  -2.019
   25   1HD1  LEU   3          HD1       LEU   3  10.023  -1.327   0.369
   26   2HD1  LEU   3          HD1       LEU   3  10.411  -3.044   0.690
   27   3HD1  LEU   3          HD1       LEU   3  11.584  -1.984  -0.168
   28   1HD2  LEU   3          HD2       LEU   3  10.234  -4.148  -2.769
   29   2HD2  LEU   3          HD2       LEU   3  11.699  -3.489  -1.981
   30   3HD2  LEU   3          HD2       LEU   3  10.586  -4.568  -1.079
   31    H    ILE   4           HN       ILE   4   9.447  -2.230  -3.891
   32    HA   ILE   4           HA       ILE   4   8.782  -4.686  -5.452
   33    HB   ILE   4           HB       ILE   4   9.216  -3.595  -7.610
   34   1HG1  ILE   4          HG1       ILE   4   9.704  -0.962  -6.177
   35   2HG1  ILE   4          HG1       ILE   4  10.984  -1.935  -6.886
   36   1HG2  ILE   4          HG2       ILE   4   7.391  -1.889  -5.905
   37   2HG2  ILE   4          HG2       ILE   4   7.333  -2.020  -7.687
   38   3HG2  ILE   4          HG2       ILE   4   6.989  -3.451  -6.676
   39   1HD1  ILE   4          HD1       ILE   4   8.642  -0.721  -8.380
   40   2HD1  ILE   4          HD2       ILE   4  10.340  -0.199  -8.415
   41   3HD1  ILE   4          HD3       ILE   4   9.894  -1.802  -9.073
   42    H    GLY   5           HN       GLY   5  11.212  -2.289  -4.570
   43   1HA   GLY   5          HA1       GLY   5  13.219  -4.129  -3.864
   44   2HA   GLY   5          HA2       GLY   5  13.441  -3.811  -5.584
   45    H    SER   6           HN       SER   6  15.468  -2.715  -5.285
   46    HA   SER   6           HA       SER   6  15.509  -0.439  -3.520
   47   1HB   SER   6          HB1       SER   6  17.658  -1.447  -5.398
   48   2HB   SER   6          HB2       SER   6  17.776  -0.550  -3.914
   49    HG   SER   6           HG       SER   6  17.986  -2.977  -4.056
   50    H    CYS   7           HN       CYS   7  16.804   1.484  -4.679
   51    HA   CYS   7           HA       CYS   7  15.809   2.068  -7.389
   52   1HB   CYS   7          HB1       CYS   7  14.219   2.790  -5.234
   53   2HB   CYS   7          HB2       CYS   7  15.132   4.261  -5.471
   54    H    VAL   8           HN       VAL   8  18.306   1.586  -6.688
   55    HA   VAL   8           HA       VAL   8  19.643   4.146  -7.129
   56    HB   VAL   8           HB       VAL   8  20.072   2.393  -4.682
   57   1HG1  VAL   8          HG1       VAL   8  22.270   3.393  -4.290
   58   2HG1  VAL   8          HG1       VAL   8  22.292   2.372  -5.749
   59   3HG1  VAL   8          HG1       VAL   8  22.220   4.155  -5.910
   60   1HG2  VAL   8          HG2       VAL   8  20.415   4.595  -3.646
   61   2HG2  VAL   8          HG2       VAL   8  20.205   5.377  -5.231
   62   3HG2  VAL   8          HG2       VAL   8  18.836   4.489  -4.493
   63    H    TRP   9           HN       TRP   9  21.039   3.907  -8.694
   64    HA   TRP   9           HA       TRP   9  21.681   1.295  -9.799
   65   1HB   TRP   9          HB1       TRP   9  21.548   3.903 -10.889
   66   2HB   TRP   9          HB2       TRP   9  23.269   3.682 -10.730
   67    HD1  TRP   9           HD1      TRP   9  20.902   3.469 -13.354
   68    HE1  TRP   9           HE1      TRP   9  21.516   1.694 -14.995
   69    HE3  TRP   9           HE3      TRP   9  24.302   0.807 -10.680
   70    HZ2  TRP   9           HZ2      TRP   9  23.204  -0.592 -15.284
   71    HZ3  TRP   9           HZ3      TRP   9  25.393  -1.155 -11.649
   72    HH2  TRP   9           HH2      TRP   9  24.856  -1.867 -13.953
   73    H    GLY  10           HN       GLY  10  22.962   0.139  -8.536
   74   1HA   GLY  10          HA1       GLY  10  25.565  -0.038  -8.284
   75   2HA   GLY  10          HA2       GLY  10  25.362   1.374  -7.253
   76    H    ALA  11           HN       ALA  11  22.657   0.122  -6.501
   77    HA   ALA  11           HA       ALA  11  23.761  -1.473  -4.267
   78   1HB   ALA  11          HB1       ALA  11  21.505  -1.144  -3.290
   79   2HB   ALA  11          HB2       ALA  11  22.246   0.411  -3.769
   80   3HB   ALA  11          HB3       ALA  11  20.989  -0.340  -4.801
   81    H    VAL  12           HN       VAL  12  22.269  -3.270  -3.571
   82    HA   VAL  12           HA       VAL  12  22.039  -5.133  -5.812
   83    HB   VAL  12           HB       VAL  12  21.160  -5.747  -2.986
   84   1HG1  VAL  12          HG1       VAL  12  22.112  -7.947  -3.383
   85   2HG1  VAL  12          HG1       VAL  12  20.814  -7.541  -4.519
   86   3HG1  VAL  12          HG1       VAL  12  22.532  -7.447  -5.048
   87   1HG2  VAL  12          HG2       VAL  12  24.034  -5.699  -3.946
   88   2HG2  VAL  12          HG2       VAL  12  23.333  -4.628  -2.693
   89   3HG2  VAL  12          HG2       VAL  12  23.476  -6.376  -2.384
   90    H    ASN  13           HN       ASN  13  20.081  -6.524  -5.825
   91    HA   ASN  13           HA       ASN  13  17.827  -6.608  -6.583
   92   1HB   ASN  13          HB1       ASN  13  16.705  -5.118  -4.317
   93   2HB   ASN  13          HB2       ASN  13  16.478  -6.789  -4.746
   94   1HD2  ASN  13          HD2       ASN  13  17.901  -4.721  -2.523
   95   2HD2  ASN  13          HD2       ASN  13  18.825  -5.877  -1.679
   96    H    TYR  14           HN       TYR  14  19.440  -4.308  -7.267
   97    HA   TYR  14           HA       TYR  14  18.066  -1.844  -7.152
   98   1HB   TYR  14          HB1       TYR  14  20.393  -1.972  -7.837
   99   2HB   TYR  14          HB2       TYR  14  19.973  -3.031  -9.174
  100    HD1  TYR  14           HD1      TYR  14  18.379   0.193  -8.077
  101    HD2  TYR  14           HD2      TYR  14  20.540  -1.886 -11.091
  102    HE1  TYR  14           HE1      TYR  14  18.149   2.119  -9.574
  103    HE2  TYR  14           HE2      TYR  14  20.316   0.036 -12.576
  104    HH   TYR  14           HH       TYR  14  19.637   2.974 -11.648
  105    H    THR  15           HN       THR  15  16.600  -0.824  -8.510
  106    HA   THR  15           HA       THR  15  14.939  -2.674 -10.086
  107    HB   THR  15           HB       THR  15  14.526   0.068  -8.840
  108    HG1  THR  15           HG1      THR  15  13.880  -2.595  -8.285
  109   1HG2  THR  15          HG2       THR  15  12.501  -1.601 -10.395
  110   2HG2  THR  15          HG2       THR  15  12.206  -0.086  -9.486
  111   3HG2  THR  15          HG2       THR  15  13.203  -0.060 -10.968
  112    H    SER  16           HN       SER  16  15.833   0.737 -10.539
  113    HA   SER  16           HA       SER  16  16.887   1.773 -12.348
  114   1HB   SER  16          HB1       SER  16  17.749  -0.819 -12.987
  115   2HB   SER  16          HB2       SER  16  16.591  -0.549 -14.296
  116    HG   SER  16           HG       SER  16  18.492   1.377 -13.471
  117    H    ASP  17           HN       ASP  17  14.168  -0.362 -12.800
  118    HA   ASP  17           HA       ASP  17  12.773   1.845 -14.196
  119   1HB   ASP  17          HB1       ASP  17  11.952   0.217 -15.892
  120   2HB   ASP  17          HB2       ASP  17  13.701   0.314 -15.898
  121    H    CYS  18           HN       CYS  18  11.781   2.222 -12.234
  122    HA   CYS  18           HA       CYS  18  10.330   0.198 -10.772
  123   1HB   CYS  18          HB1       CYS  18  11.179   2.625 -10.177
  124   2HB   CYS  18          HB2       CYS  18   9.617   3.162 -10.725
  125    H    ASN  19           HN       ASN  19   8.844   2.961 -12.509
  126    HA   ASN  19           HA       ASN  19   6.304   1.980 -12.778
  127   1HB   ASN  19          HB1       ASN  19   7.363   4.151 -13.812
  128   2HB   ASN  19          HB2       ASN  19   7.575   3.171 -15.251
  129   1HD2  ASN  19          HD2       ASN  19   4.875   1.633 -14.425
  130   2HD2  ASN  19          HD2       ASN  19   3.705   2.748 -14.937
  131    H    GLY  20           HN       GLY  20   9.111   1.006 -14.469
  132   1HA   GLY  20          HA1       GLY  20   7.872  -0.660 -16.489
  133   2HA   GLY  20          HA2       GLY  20   9.564  -0.776 -15.981
  134    H    GLU  21           HN       GLU  21   9.646  -1.572 -13.545
  135    HA   GLU  21           HA       GLU  21   8.946  -4.290 -13.505
  136   1HB   GLU  21          HB1       GLU  21  10.612  -3.074 -12.065
  137   2HB   GLU  21          HB2       GLU  21   9.305  -2.520 -11.069
  138   1HG   GLU  21          HG1       GLU  21  10.187  -4.584 -10.004
  139   2HG   GLU  21          HG2       GLU  21   8.594  -4.921 -10.626
  140    H    CYS  22           HN       CYS  22   7.265  -1.540 -12.353
  141    HA   CYS  22           HA       CYS  22   5.174  -3.035 -11.024
  142   1HB   CYS  22          HB1       CYS  22   5.771  -0.153 -11.595
  143   2HB   CYS  22          HB2       CYS  22   4.115  -0.548 -11.275
  144    H    LEU  23           HN       LEU  23   5.494  -1.395 -14.188
  145    HA   LEU  23           HA       LEU  23   2.884  -1.985 -15.090
  146   1HB   LEU  23          HB1       LEU  23   5.522  -1.183 -16.273
  147   2HB   LEU  23          HB2       LEU  23   4.510  -2.070 -17.346
  148    HG   LEU  23           HG       LEU  23   3.585   0.419 -15.838
  149   1HD1  LEU  23          HD1       LEU  23   4.524   0.111 -18.715
  150   2HD1  LEU  23          HD1       LEU  23   3.819   1.597 -17.998
  151   3HD1  LEU  23          HD1       LEU  23   5.377   0.967 -17.399
  152   1HD2  LEU  23          HD2       LEU  23   1.768   0.435 -17.479
  153   2HD2  LEU  23          HD2       LEU  23   2.426  -1.055 -18.232
  154   3HD2  LEU  23          HD2       LEU  23   1.766  -1.096 -16.571
  155    H    LEU  24           HN       LEU  24   5.846  -3.795 -14.828
  156    HA   LEU  24           HA       LEU  24   5.197  -5.969 -16.530
  157   1HB   LEU  24          HB1       LEU  24   7.203  -5.174 -14.595
  158   2HB   LEU  24          HB2       LEU  24   6.741  -6.784 -14.209
  159    HG   LEU  24           HG       LEU  24   7.564  -5.729 -16.946
  160   1HD1  LEU  24          HD1       LEU  24   9.721  -6.884 -16.559
  161   2HD1  LEU  24          HD1       LEU  24   9.418  -5.593 -15.364
  162   3HD1  LEU  24          HD1       LEU  24   9.177  -7.306 -14.906
  163   1HD2  LEU  24          HD2       LEU  24   7.902  -8.129 -17.538
  164   2HD2  LEU  24          HD2       LEU  24   7.302  -8.581 -15.913
  165   3HD2  LEU  24          HD2       LEU  24   6.212  -7.782 -17.089
  166    H    ARG  25           HN       ARG  25   4.496  -5.265 -13.292
  167    HA   ARG  25           HA       ARG  25   2.872  -7.733 -12.955
  168   1HB   ARG  25          HB1       ARG  25   3.764  -5.595 -10.955
  169   2HB   ARG  25          HB2       ARG  25   2.813  -6.987 -10.506
  170   1HG   ARG  25          HG1       ARG  25   4.654  -8.333 -10.524
  171   2HG   ARG  25          HG2       ARG  25   5.067  -7.888 -12.157
  172   1HD   ARG  25          HD1       ARG  25   6.858  -6.725 -11.428
  173   2HD   ARG  25          HD2       ARG  25   5.755  -5.581 -10.736
  174    HE   ARG  25           HE       ARG  25   7.063  -6.254  -8.949
  175   1HH1  ARG  25          HH1       ARG  25   5.472  -8.918  -7.135
  176   2HH1  ARG  25          HH1       ARG  25   5.354  -7.208  -7.192
  177   1HH2  ARG  25          HH2       ARG  25   6.487 -10.086  -9.036
  178   2HH2  ARG  25          HH2       ARG  25   7.089  -9.020 -10.258
  179    H    GLY  26           HN       GLY  26   2.202  -5.203 -14.513
  180   1HA   GLY  26          HA1       GLY  26   0.274  -4.033 -15.087
  181   2HA   GLY  26          HA2       GLY  26  -0.601  -5.380 -14.367
  182    H    TYR  27           HN       TYR  27   1.629  -3.498 -12.559
  183    HA   TYR  27           HA       TYR  27  -0.418  -2.785 -10.624
  184   1HB   TYR  27          HB1       TYR  27   2.559  -2.243 -10.913
  185   2HB   TYR  27          HB2       TYR  27   1.667  -1.407  -9.688
  186    HD1  TYR  27           HD1      TYR  27   4.046  -3.314  -9.359
  187    HD2  TYR  27           HD2      TYR  27  -0.144  -4.002  -8.974
  188    HE1  TYR  27           HE1      TYR  27   4.490  -5.109  -7.801
  189    HE2  TYR  27           HE2      TYR  27   0.315  -5.803  -7.410
  190    HH   TYR  27           HH       TYR  27   2.541  -7.414  -7.095
  191    H    LYS  28           HN       LYS  28  -0.795  -0.633  -9.900
  192    HA   LYS  28           HA       LYS  28  -1.709   1.074 -11.965
  193   1HB   LYS  28          HB1       LYS  28  -1.069   1.575  -9.031
  194   2HB   LYS  28          HB2       LYS  28  -2.121   2.596  -9.999
  195   1HG   LYS  28          HG1       LYS  28  -3.855   1.027 -10.073
  196   2HG   LYS  28          HG2       LYS  28  -2.814  -0.356 -10.106
  197   1HD   LYS  28          HD1       LYS  28  -3.910  -0.479  -8.027
  198   2HD   LYS  28          HD2       LYS  28  -2.285   0.061  -7.663
  199   1HE   LYS  28          HE1       LYS  28  -3.010   2.377  -7.359
  200   2HE   LYS  28          HE2       LYS  28  -4.581   2.050  -8.073
  201   1HZ   LYS  28          HZ1       LYS  28  -4.125   0.300  -5.907
  202   2HZ   LYS  28          HZ2       LYS  28  -3.793   1.860  -5.430
  203   3HZ   LYS  28          HZ3       LYS  28  -5.333   1.511  -6.030
  204    H    GLY  29           HN       GLY  29   1.309   0.858 -10.277
  205   1HA   GLY  29          HA1       GLY  29   2.952   1.986 -12.144
  206   2HA   GLY  29          HA2       GLY  29   2.331   3.394 -11.266
  207    H    GLY  30           HN       GLY  30   4.833   3.433 -10.915
  208   1HA   GLY  30          HA1       GLY  30   5.273   2.657  -8.182
  209   2HA   GLY  30          HA2       GLY  30   6.310   1.770  -9.304
  210    H    HIS  31           HN       HIS  31   7.150   3.514  -7.325
  211    HA   HIS  31           HA       HIS  31   8.690   5.447  -8.897
  212   1HB   HIS  31          HB1       HIS  31   7.956   7.420  -7.505
  213   2HB   HIS  31          HB2       HIS  31   6.581   6.700  -8.332
  214    HD1  HIS  31           HD1      HIS  31   4.655   6.481  -6.755
  215    HD2  HIS  31           HD2      HIS  31   8.159   5.942  -4.637
  216    HE1  HIS  31           HE1      HIS  31   3.990   6.074  -4.427
  217    HE2  HIS  31           HE2      HIS  31   6.128   5.771  -3.185
  218    H    CYS  32           HN       CYS  32  10.330   6.602  -7.511
  219    HA   CYS  32           HA       CYS  32  11.537   4.629  -5.763
  220   1HB   CYS  32          HB1       CYS  32  12.356   7.493  -6.418
  221   2HB   CYS  32          HB2       CYS  32  13.223   6.505  -5.291
  222    H    GLY  33           HN       GLY  33  11.916   4.891  -3.561
  223   1HA   GLY  33          HA1       GLY  33   9.992   5.450  -1.841
  224   2HA   GLY  33          HA2       GLY  33  11.623   5.862  -1.414
  225    H    SER  34           HN       SER  34  12.285   8.008  -1.702
  226    HA   SER  34           HA       SER  34  10.268  10.057  -2.295
  227   1HB   SER  34          HB1       SER  34  10.842  11.077   0.044
  228   2HB   SER  34          HB2       SER  34   9.892   9.582   0.088
  229    HG   SER  34           HG       SER  34  12.249   9.937   1.151
  230    H    PHE  35           HN       PHE  35  13.401   9.642  -0.830
  231    HA   PHE  35           HA       PHE  35  14.909  10.891  -2.902
  232   1HB   PHE  35          HB1       PHE  35  13.580  12.791  -1.706
  233   2HB   PHE  35          HB2       PHE  35  14.684  12.553  -0.377
  234    HD1  PHE  35           HD1      PHE  35  17.256  12.677  -0.891
  235    HD2  PHE  35           HD2      PHE  35  14.263  14.143  -3.555
  236    HE1  PHE  35           HE1      PHE  35  18.936  14.039  -2.035
  237    HE2  PHE  35           HE2      PHE  35  15.959  15.513  -4.693
  238    HZ   PHE  35           HZ       PHE  35  18.295  15.462  -3.936
  239    H    ALA  36           HN       ALA  36  15.987   9.053  -2.542
  240    HA   ALA  36           HA       ALA  36  18.046   8.056  -1.974
  241   1HB   ALA  36          HB1       ALA  36  18.021   9.727   0.579
  242   2HB   ALA  36          HB2       ALA  36  19.333   8.711  -0.042
  243   3HB   ALA  36          HB3       ALA  36  18.850  10.179  -0.950
  244    H    ASN  37           HN       ASN  37  15.404   7.291  -1.399
  245    HA   ASN  37           HA       ASN  37  15.372   6.030   1.195
  246   1HB   ASN  37          HB1       ASN  37  13.360   6.941  -0.317
  247   2HB   ASN  37          HB2       ASN  37  13.492   5.331  -1.030
  248   1HD2  ASN  37          HD2       ASN  37  12.091   7.106   1.435
  249   2HD2  ASN  37          HD2       ASN  37  11.628   5.818   2.450
  250    H    VAL  38           HN       VAL  38  16.633   5.444  -1.798
  251    HA   VAL  38           HA       VAL  38  17.380   3.594  -2.982
  252    HB   VAL  38           HB       VAL  38  18.978   2.330  -1.721
  253   1HG1  VAL  38          HG1       VAL  38  20.222   4.086  -0.453
  254   2HG1  VAL  38          HG1       VAL  38  19.486   4.756  -1.948
  255   3HG1  VAL  38          HG1       VAL  38  18.715   5.043  -0.372
  256   1HG2  VAL  38          HG2       VAL  38  19.215   2.283   0.700
  257   2HG2  VAL  38          HG2       VAL  38  17.729   3.260   0.879
  258   3HG2  VAL  38          HG2       VAL  38  17.641   1.603   0.205
  259    H    ASN  39           HN       ASN  39  14.696   3.494  -2.226
  260    HA   ASN  39           HA       ASN  39  14.132   0.625  -2.490
  261   1HB   ASN  39          HB1       ASN  39  13.172   2.318  -0.188
  262   2HB   ASN  39          HB2       ASN  39  12.256   0.980  -0.814
  263   1HD2  ASN  39          HD2       ASN  39  15.088   1.835   0.973
  264   2HD2  ASN  39          HD2       ASN  39  15.522   0.245   1.404
  265    H    CYS  40           HN       CYS  40  12.857   0.508  -4.185
  266    HA   CYS  40           HA       CYS  40  11.072   2.819  -4.805
  267   1HB   CYS  40          HB1       CYS  40  12.727   1.412  -6.490
  268   2HB   CYS  40          HB2       CYS  40  11.256   0.524  -6.716
  269    H    TRP  41           HN       TRP  41   8.974   2.565  -4.995
  270    HA   TRP  41           HA       TRP  41   7.736   0.040  -4.010
  271   1HB   TRP  41          HB1       TRP  41   6.703   2.833  -3.336
  272   2HB   TRP  41          HB2       TRP  41   6.204   1.311  -2.624
  273    HD1  TRP  41           HD1      TRP  41   9.500   3.461  -2.886
  274    HE1  TRP  41           HE1      TRP  41  10.699   3.025  -0.744
  275    HE3  TRP  41           HE3      TRP  41   6.393   0.156  -0.817
  276    HZ2  TRP  41           HZ2      TRP  41  10.430   1.443   1.705
  277    HZ3  TRP  41           HZ3      TRP  41   6.783  -0.821   1.350
  278    HH2  TRP  41           HH2      TRP  41   8.830  -0.197   2.672
  279    H    CYS  42           HN       CYS  42   5.428  -0.088  -4.511
  280    HA   CYS  42           HA       CYS  42   5.062   0.923  -7.286
  281   1HB   CYS  42          HB1       CYS  42   4.765  -1.545  -6.278
  282   2HB   CYS  42          HB2       CYS  42   3.142  -0.960  -6.076
  283    H    GLU  43           HN       GLU  43   2.740   1.470  -7.704
  284    HA   GLU  43           HA       GLU  43   1.824   3.522  -5.814
  285   1HB   GLU  43          HB1       GLU  43   2.406   3.575  -8.530
  286   2HB   GLU  43          HB2       GLU  43   0.680   3.359  -8.591
  287   1HG   GLU  43          HG1       GLU  43   0.961   5.707  -8.602
  288   2HG   GLU  43          HG2       GLU  43   0.659   5.352  -6.903
  289    H    THR  44           HN       THR  44   1.221   1.258  -4.882
  290    HA   THR  44           HA       THR  44  -1.467   0.434  -5.810
  291    HB   THR  44           HB       THR  44  -1.179  -1.373  -3.944
  292    HG1  THR  44           HG1      THR  44   0.333   0.429  -3.171
  293   1HG2  THR  44          HG2       THR  44   0.695  -2.489  -5.061
  294   2HG2  THR  44          HG2       THR  44  -0.159  -1.624  -6.358
  295   3HG2  THR  44          HG2       THR  44   1.300  -0.892  -5.654
  Start of MODEL   14
    1   1H    ASP   1          HT1       ASP   1   0.739   0.622  -0.224
    2   2H    ASP   1          HT2       ASP   1   2.012  -0.454   0.186
    3   3H    ASP   1          HT3       ASP   1   2.238   1.242   0.243
    4    HA   ASP   1           HA       ASP   1   1.438   0.620  -2.346
    5   1HB   ASP   1          HB1       ASP   1   4.329   0.930  -1.438
    6   2HB   ASP   1          HB2       ASP   1   3.661   1.433  -2.957
    7    H    LYS   2           HN       LYS   2   2.668  -0.748  -3.893
    8    HA   LYS   2           HA       LYS   2   3.369  -3.319  -2.693
    9   1HB   LYS   2          HB1       LYS   2   2.213  -2.282  -5.280
   10   2HB   LYS   2          HB2       LYS   2   3.136  -3.721  -5.295
   11   1HG   LYS   2          HG1       LYS   2   0.697  -3.170  -3.491
   12   2HG   LYS   2          HG2       LYS   2   0.602  -4.052  -4.998
   13   1HD   LYS   2          HD1       LYS   2   2.251  -5.758  -4.038
   14   2HD   LYS   2          HD2       LYS   2   2.107  -4.938  -2.495
   15   1HE   LYS   2          HE1       LYS   2  -0.233  -5.458  -2.267
   16   2HE   LYS   2          HE2       LYS   2  -0.357  -6.010  -3.927
   17   1HZ   LYS   2          HZ1       LYS   2   1.662  -7.533  -2.694
   18   2HZ   LYS   2          HZ2       LYS   2   0.328  -7.543  -1.646
   19   3HZ   LYS   2          HZ3       LYS   2   0.158  -8.053  -3.242
   20    H    LEU   3           HN       LEU   3   5.403  -3.289  -2.205
   21    HA   LEU   3           HA       LEU   3   7.473  -1.751  -3.384
   22   1HB   LEU   3          HB1       LEU   3   7.448  -2.998  -1.097
   23   2HB   LEU   3          HB2       LEU   3   7.814  -4.458  -1.988
   24    HG   LEU   3           HG       LEU   3   9.688  -2.064  -2.343
   25   1HD1  LEU   3          HD1       LEU   3   9.295  -2.312   0.061
   26   2HD1  LEU   3          HD1       LEU   3   9.718  -4.040  -0.029
   27   3HD1  LEU   3          HD1       LEU   3  10.952  -2.787  -0.404
   28   1HD2  LEU   3          HD2       LEU   3  10.242  -5.036  -2.007
   29   2HD2  LEU   3          HD2       LEU   3  10.071  -4.253  -3.583
   30   3HD2  LEU   3          HD2       LEU   3  11.388  -3.731  -2.493
   31    H    ILE   4           HN       ILE   4   9.278  -2.558  -4.566
   32    HA   ILE   4           HA       ILE   4   8.692  -4.837  -6.412
   33    HB   ILE   4           HB       ILE   4   9.574  -3.488  -8.334
   34   1HG1  ILE   4          HG1       ILE   4   9.447  -1.150  -6.388
   35   2HG1  ILE   4          HG1       ILE   4  10.889  -1.823  -7.157
   36   1HG2  ILE   4          HG2       ILE   4   7.495  -2.195  -8.644
   37   2HG2  ILE   4          HG2       ILE   4   7.159  -3.745  -7.841
   38   3HG2  ILE   4          HG2       ILE   4   7.211  -2.242  -6.872
   39   1HD1  ILE   4          HD1       ILE   4  10.172   0.207  -8.297
   40   2HD1  ILE   4          HD2       ILE   4  10.089  -1.238  -9.331
   41   3HD1  ILE   4          HD3       ILE   4   8.587  -0.525  -8.634
   42    H    GLY   5           HN       GLY   5  11.092  -2.568  -5.196
   43   1HA   GLY   5          HA1       GLY   5  12.992  -4.466  -4.423
   44   2HA   GLY   5          HA2       GLY   5  13.403  -4.077  -6.078
   45    H    SER   6           HN       SER   6  15.307  -3.015  -5.581
   46    HA   SER   6           HA       SER   6  15.148  -0.702  -3.720
   47   1HB   SER   6          HB1       SER   6  17.327  -2.159  -3.552
   48   2HB   SER   6          HB2       SER   6  17.714  -1.587  -5.148
   49    HG   SER   6           HG       SER   6  17.446  -0.140  -2.719
   50    H    CYS   7           HN       CYS   7  16.261   1.205  -4.384
   51    HA   CYS   7           HA       CYS   7  15.986   1.842  -7.295
   52   1HB   CYS   7          HB1       CYS   7  14.022   2.771  -6.051
   53   2HB   CYS   7          HB2       CYS   7  15.117   3.570  -4.946
   54    H    VAL   8           HN       VAL   8  18.309   1.031  -6.288
   55    HA   VAL   8           HA       VAL   8  19.865   3.595  -6.203
   56    HB   VAL   8           HB       VAL   8  20.518   1.045  -4.695
   57   1HG1  VAL   8          HG1       VAL   8  22.188   2.420  -3.518
   58   2HG1  VAL   8          HG1       VAL   8  22.503   2.381  -5.275
   59   3HG1  VAL   8          HG1       VAL   8  21.731   3.819  -4.541
   60   1HG2  VAL   8          HG2       VAL   8  19.966   2.254  -2.642
   61   2HG2  VAL   8          HG2       VAL   8  19.378   3.619  -3.645
   62   3HG2  VAL   8          HG2       VAL   8  18.572   2.025  -3.730
   63    H    TRP   9           HN       TRP   9  21.129   3.765  -7.858
   64    HA   TRP   9           HA       TRP   9  21.599   1.607  -9.743
   65   1HB   TRP   9          HB1       TRP   9  21.755   4.506  -9.806
   66   2HB   TRP   9          HB2       TRP   9  23.357   3.935 -10.186
   67    HD1  TRP   9           HD1      TRP   9  20.710   5.179 -12.060
   68    HE1  TRP   9           HE1      TRP   9  20.481   3.961 -14.252
   69    HE3  TRP   9           HE3      TRP   9  23.399   0.985 -11.137
   70    HZ2  TRP   9           HZ2      TRP   9  21.271   1.556 -15.559
   71    HZ3  TRP   9           HZ3      TRP   9  23.653  -0.758 -12.859
   72    HH2  TRP   9           HH2      TRP   9  22.586  -0.476 -15.079
   73    H    GLY  10           HN       GLY  10  22.716   0.084  -8.653
   74   1HA   GLY  10          HA1       GLY  10  25.233  -0.564  -8.700
   75   2HA   GLY  10          HA2       GLY  10  25.426   0.785  -7.582
   76    H    ALA  11           HN       ALA  11  22.517  -0.300  -6.759
   77    HA   ALA  11           HA       ALA  11  23.637  -1.987  -4.597
   78   1HB   ALA  11          HB1       ALA  11  22.166  -0.077  -4.010
   79   2HB   ALA  11          HB2       ALA  11  20.867  -0.847  -4.994
   80   3HB   ALA  11          HB3       ALA  11  21.441  -1.628  -3.502
   81    H    VAL  12           HN       VAL  12  21.881  -3.626  -3.886
   82    HA   VAL  12           HA       VAL  12  21.631  -5.547  -6.071
   83    HB   VAL  12           HB       VAL  12  20.486  -5.918  -3.308
   84   1HG1  VAL  12          HG1       VAL  12  21.833  -7.863  -5.167
   85   2HG1  VAL  12          HG1       VAL  12  21.241  -8.235  -3.519
   86   3HG1  VAL  12          HG1       VAL  12  20.081  -7.772  -4.781
   87   1HG2  VAL  12          HG2       VAL  12  22.725  -5.021  -2.875
   88   2HG2  VAL  12          HG2       VAL  12  22.683  -6.759  -2.495
   89   3HG2  VAL  12          HG2       VAL  12  23.417  -6.199  -4.032
   90    H    ASN  13           HN       ASN  13  19.563  -6.753  -6.190
   91    HA   ASN  13           HA       ASN  13  17.436  -6.637  -7.198
   92   1HB   ASN  13          HB1       ASN  13  15.679  -5.728  -5.481
   93   2HB   ASN  13          HB2       ASN  13  16.434  -7.176  -4.997
   94   1HD2  ASN  13          HD2       ASN  13  18.143  -6.929  -3.223
   95   2HD2  ASN  13          HD2       ASN  13  18.079  -5.523  -2.259
   96    H    TYR  14           HN       TYR  14  19.188  -4.470  -7.730
   97    HA   TYR  14           HA       TYR  14  17.999  -1.938  -7.532
   98   1HB   TYR  14          HB1       TYR  14  20.312  -2.176  -8.282
   99   2HB   TYR  14          HB2       TYR  14  19.815  -3.170  -9.649
  100    HD1  TYR  14           HD1      TYR  14  18.526   0.114  -8.323
  101    HD2  TYR  14           HD2      TYR  14  20.204  -2.006 -11.603
  102    HE1  TYR  14           HE1      TYR  14  18.277   2.096  -9.729
  103    HE2  TYR  14           HE2      TYR  14  19.966  -0.022 -13.008
  104    HH   TYR  14           HH       TYR  14  19.853   2.625 -12.338
  105    H    THR  15           HN       THR  15  16.420  -0.885  -8.608
  106    HA   THR  15           HA       THR  15  14.667  -2.491 -10.277
  107    HB   THR  15           HB       THR  15  14.512   0.221  -8.915
  108    HG1  THR  15           HG1      THR  15  13.113  -2.255  -8.627
  109   1HG2  THR  15          HG2       THR  15  12.173   0.298  -9.392
  110   2HG2  THR  15          HG2       THR  15  13.045   0.279 -10.958
  111   3HG2  THR  15          HG2       THR  15  12.252  -1.206 -10.354
  112    H    SER  16           HN       SER  16  15.700   0.885 -10.685
  113    HA   SER  16           HA       SER  16  16.748   1.917 -12.504
  114   1HB   SER  16          HB1       SER  16  17.487  -0.682 -13.235
  115   2HB   SER  16          HB2       SER  16  16.282  -0.347 -14.484
  116    HG   SER  16           HG       SER  16  18.255   1.514 -13.690
  117    H    ASP  17           HN       ASP  17  13.958  -0.102 -12.940
  118    HA   ASP  17           HA       ASP  17  12.594   2.173 -14.259
  119   1HB   ASP  17          HB1       ASP  17  11.606   0.531 -15.889
  120   2HB   ASP  17          HB2       ASP  17  13.344   0.722 -16.008
  121    H    CYS  18           HN       CYS  18  11.937   2.339 -11.977
  122    HA   CYS  18           HA       CYS  18  10.446   0.503 -10.517
  123   1HB   CYS  18          HB1       CYS  18  11.241   3.101 -10.313
  124   2HB   CYS  18          HB2       CYS  18   9.557   3.397 -10.570
  125    H    ASN  19           HN       ASN  19   9.033   2.956 -12.661
  126    HA   ASN  19           HA       ASN  19   6.440   1.957 -12.735
  127   1HB   ASN  19          HB1       ASN  19   7.617   4.012 -14.057
  128   2HB   ASN  19          HB2       ASN  19   7.572   2.867 -15.381
  129   1HD2  ASN  19          HD2       ASN  19   5.094   1.478 -14.876
  130   2HD2  ASN  19          HD2       ASN  19   3.837   2.614 -14.973
  131    H    GLY  20           HN       GLY  20   9.280   0.757 -14.202
  132   1HA   GLY  20          HA1       GLY  20   7.980  -1.056 -16.080
  133   2HA   GLY  20          HA2       GLY  20   9.679  -1.077 -15.627
  134    H    GLU  21           HN       GLU  21  10.009  -1.774 -13.321
  135    HA   GLU  21           HA       GLU  21   9.304  -4.451 -12.952
  136   1HB   GLU  21          HB1       GLU  21  11.041  -2.835 -11.644
  137   2HB   GLU  21          HB2       GLU  21   9.703  -2.695 -10.533
  138   1HG   GLU  21          HG1       GLU  21   9.613  -5.012 -10.034
  139   2HG   GLU  21          HG2       GLU  21  10.719  -5.411 -11.364
  140    H    CYS  22           HN       CYS  22   7.617  -1.603 -12.024
  141    HA   CYS  22           HA       CYS  22   5.645  -2.884 -10.356
  142   1HB   CYS  22          HB1       CYS  22   6.006  -0.165 -11.559
  143   2HB   CYS  22          HB2       CYS  22   4.447  -0.576 -10.984
  144    H    LEU  23           HN       LEU  23   5.816  -1.698 -13.721
  145    HA   LEU  23           HA       LEU  23   3.156  -2.357 -14.425
  146   1HB   LEU  23          HB1       LEU  23   5.755  -1.775 -15.815
  147   2HB   LEU  23          HB2       LEU  23   4.548  -2.572 -16.747
  148    HG   LEU  23           HG       LEU  23   3.981  -0.009 -15.194
  149   1HD1  LEU  23          HD1       LEU  23   4.723  -0.378 -18.126
  150   2HD1  LEU  23          HD1       LEU  23   4.274   1.172 -17.348
  151   3HD1  LEU  23          HD1       LEU  23   5.784   0.344 -16.880
  152   1HD2  LEU  23          HD2       LEU  23   2.007  -1.307 -15.842
  153   2HD2  LEU  23          HD2       LEU  23   2.112   0.206 -16.779
  154   3HD2  LEU  23          HD2       LEU  23   2.593  -1.347 -17.533
  155    H    LEU  24           HN       LEU  24   6.129  -4.102 -14.178
  156    HA   LEU  24           HA       LEU  24   5.424  -6.435 -15.641
  157   1HB   LEU  24          HB1       LEU  24   7.520  -5.410 -13.919
  158   2HB   LEU  24          HB2       LEU  24   7.161  -7.023 -13.424
  159    HG   LEU  24           HG       LEU  24   7.792  -6.088 -16.264
  160   1HD1  LEU  24          HD1       LEU  24   9.713  -5.809 -14.778
  161   2HD1  LEU  24          HD1       LEU  24   9.550  -7.510 -14.234
  162   3HD1  LEU  24          HD1       LEU  24   9.989  -7.145 -15.927
  163   1HD2  LEU  24          HD2       LEU  24   8.153  -8.480 -16.764
  164   2HD2  LEU  24          HD2       LEU  24   7.692  -8.894 -15.084
  165   3HD2  LEU  24          HD2       LEU  24   6.487  -8.181 -16.199
  166    H    ARG  25           HN       ARG  25   4.816  -5.379 -12.537
  167    HA   ARG  25           HA       ARG  25   3.477  -7.855 -11.597
  168   1HB   ARG  25          HB1       ARG  25   4.179  -5.241 -10.280
  169   2HB   ARG  25          HB2       ARG  25   2.844  -6.133  -9.622
  170   1HG   ARG  25          HG1       ARG  25   4.377  -7.080  -8.255
  171   2HG   ARG  25          HG2       ARG  25   4.731  -8.122  -9.607
  172   1HD   ARG  25          HD1       ARG  25   6.165  -5.447  -9.193
  173   2HD   ARG  25          HD2       ARG  25   6.773  -6.931  -8.483
  174    HE   ARG  25           HE       ARG  25   6.275  -6.605 -11.424
  175   1HH1  ARG  25          HH1       ARG  25   9.786  -7.301 -11.251
  176   2HH1  ARG  25          HH1       ARG  25   8.740  -5.920 -11.407
  177   1HH2  ARG  25          HH2       ARG  25   8.683  -9.326 -10.269
  178   2HH2  ARG  25          HH2       ARG  25   7.018  -9.105  -9.885
  179    H    GLY  26           HN       GLY  26   2.604  -5.285 -13.442
  180   1HA   GLY  26          HA1       GLY  26   0.455  -4.837 -14.338
  181   2HA   GLY  26          HA2       GLY  26  -0.255  -5.881 -13.108
  182    H    TYR  27           HN       TYR  27   1.982  -3.700 -11.854
  183    HA   TYR  27           HA       TYR  27  -0.146  -2.224 -10.507
  184   1HB   TYR  27          HB1       TYR  27   2.879  -1.927 -10.391
  185   2HB   TYR  27          HB2       TYR  27   1.787  -1.083  -9.326
  186    HD1  TYR  27           HD1      TYR  27  -0.158  -3.449  -8.793
  187    HD2  TYR  27           HD2      TYR  27   4.092  -3.185  -8.807
  188    HE1  TYR  27           HE1      TYR  27  -0.046  -5.267  -7.227
  189    HE2  TYR  27           HE2      TYR  27   4.216  -5.006  -7.213
  190    HH   TYR  27           HH       TYR  27   2.126  -7.119  -6.719
  191    H    LYS  28           HN       LYS  28  -0.040   0.099 -10.326
  192    HA   LYS  28           HA       LYS  28   0.112   1.256 -13.012
  193   1HB   LYS  28          HB1       LYS  28  -0.799   2.458 -10.357
  194   2HB   LYS  28          HB2       LYS  28  -1.042   3.185 -11.928
  195   1HG   LYS  28          HG1       LYS  28  -2.995   2.010 -12.167
  196   2HG   LYS  28          HG2       LYS  28  -2.044   0.552 -12.277
  197   1HD   LYS  28          HD1       LYS  28  -3.702   0.200 -10.625
  198   2HD   LYS  28          HD2       LYS  28  -2.142   0.255  -9.830
  199   1HE   LYS  28          HE1       LYS  28  -2.542   2.456  -8.903
  200   2HE   LYS  28          HE2       LYS  28  -3.883   2.754  -9.995
  201   1HZ   LYS  28          HZ1       LYS  28  -3.945   1.594  -7.455
  202   2HZ   LYS  28          HZ2       LYS  28  -5.214   1.933  -8.465
  203   3HZ   LYS  28          HZ3       LYS  28  -4.479   0.408  -8.544
  204    H    GLY  29           HN       GLY  29   0.923   3.486 -13.156
  205   1HA   GLY  29          HA1       GLY  29   3.590   3.786 -13.136
  206   2HA   GLY  29          HA2       GLY  29   2.569   5.157 -12.731
  207    H    GLY  30           HN       GLY  30   4.830   2.861 -11.548
  208   1HA   GLY  30          HA1       GLY  30   4.309   3.401  -8.732
  209   2HA   GLY  30          HA2       GLY  30   5.651   2.446  -9.393
  210    H    HIS  31           HN       HIS  31   6.835   3.650  -7.688
  211    HA   HIS  31           HA       HIS  31   8.242   5.843  -8.902
  212   1HB   HIS  31          HB1       HIS  31   7.674   7.557  -7.191
  213   2HB   HIS  31          HB2       HIS  31   6.156   6.968  -7.836
  214    HD1  HIS  31           HD1      HIS  31   5.266   4.763  -6.347
  215    HD2  HIS  31           HD2      HIS  31   7.892   7.285  -4.413
  216    HE1  HIS  31           HE1      HIS  31   5.049   4.230  -3.908
  217    HE2  HIS  31           HE2      HIS  31   6.660   5.814  -2.809
  218    H    CYS  32           HN       CYS  32   9.839   6.753  -7.254
  219    HA   CYS  32           HA       CYS  32  10.956   4.465  -5.731
  220   1HB   CYS  32          HB1       CYS  32  12.181   6.978  -6.875
  221   2HB   CYS  32          HB2       CYS  32  13.002   6.068  -5.637
  222    H    GLY  33           HN       GLY  33  11.557   4.745  -3.637
  223   1HA   GLY  33          HA1       GLY  33  10.651   5.378  -1.477
  224   2HA   GLY  33          HA2       GLY  33  11.821   6.652  -1.880
  225    H    SER  34           HN       SER  34  11.093   8.517  -1.352
  226    HA   SER  34           HA       SER  34   8.555   9.448  -2.411
  227   1HB   SER  34          HB1       SER  34   7.873   8.246  -0.270
  228   2HB   SER  34          HB2       SER  34   8.918   9.340   0.648
  229    HG   SER  34           HG       SER  34   7.384  10.791  -1.039
  230    H    PHE  35           HN       PHE  35  11.226  10.103  -0.134
  231    HA   PHE  35           HA       PHE  35  12.091  12.409  -1.513
  232   1HB   PHE  35          HB1       PHE  35   9.897  13.092  -0.234
  233   2HB   PHE  35          HB2       PHE  35  10.859  12.983   1.218
  234    HD1  PHE  35           HD1      PHE  35  10.657  14.715  -2.064
  235    HD2  PHE  35           HD2      PHE  35  12.427  14.710   1.810
  236    HE1  PHE  35           HE1      PHE  35  11.581  16.952  -2.485
  237    HE2  PHE  35           HE2      PHE  35  13.350  16.946   1.389
  238    HZ   PHE  35           HZ       PHE  35  12.932  18.074  -0.758
  239    H    ALA  36           HN       ALA  36  13.897  11.230  -1.332
  240    HA   ALA  36           HA       ALA  36  16.096  11.069  -0.549
  241   1HB   ALA  36          HB1       ALA  36  16.745  11.700   1.676
  242   2HB   ALA  36          HB2       ALA  36  15.756  13.016   0.965
  243   3HB   ALA  36          HB3       ALA  36  15.060  11.908   2.194
  244    H    ASN  37           HN       ASN  37  14.686   8.993  -0.935
  245    HA   ASN  37           HA       ASN  37  14.910   7.261   1.411
  246   1HB   ASN  37          HB1       ASN  37  12.683   7.502   0.088
  247   2HB   ASN  37          HB2       ASN  37  13.559   6.599  -1.172
  248   1HD2  ASN  37          HD2       ASN  37  12.535   4.489  -1.047
  249   2HD2  ASN  37          HD2       ASN  37  12.461   3.648   0.437
  250    H    VAL  38           HN       VAL  38  14.933   4.854  -0.262
  251    HA   VAL  38           HA       VAL  38  17.171   4.915  -2.051
  252    HB   VAL  38           HB       VAL  38  18.549   3.279  -0.612
  253   1HG1  VAL  38          HG1       VAL  38  19.298   5.624  -0.863
  254   2HG1  VAL  38          HG1       VAL  38  18.394   6.049   0.629
  255   3HG1  VAL  38          HG1       VAL  38  19.745   4.903   0.715
  256   1HG2  VAL  38          HG2       VAL  38  18.301   3.402   1.829
  257   2HG2  VAL  38          HG2       VAL  38  16.843   4.411   1.617
  258   3HG2  VAL  38          HG2       VAL  38  16.870   2.718   1.018
  259    H    ASN  39           HN       ASN  39  14.423   3.998  -2.073
  260    HA   ASN  39           HA       ASN  39  14.848   1.265  -2.928
  261   1HB   ASN  39          HB1       ASN  39  12.939   2.016  -0.679
  262   2HB   ASN  39          HB2       ASN  39  12.782   0.587  -1.594
  263   1HD2  ASN  39          HD2       ASN  39  14.452   2.050   1.035
  264   2HD2  ASN  39          HD2       ASN  39  15.606   0.814   1.231
  265    H    CYS  40           HN       CYS  40  12.658   0.386  -3.812
  266    HA   CYS  40           HA       CYS  40  11.223   2.655  -5.086
  267   1HB   CYS  40          HB1       CYS  40  12.810   0.578  -6.288
  268   2HB   CYS  40          HB2       CYS  40  11.162   0.245  -6.645
  269    H    TRP  41           HN       TRP  41   9.001   2.416  -5.353
  270    HA   TRP  41           HA       TRP  41   7.708   0.018  -4.283
  271   1HB   TRP  41          HB1       TRP  41   7.094   2.807  -3.170
  272   2HB   TRP  41          HB2       TRP  41   6.211   1.349  -2.836
  273    HD1  TRP  41           HD1      TRP  41   9.893   2.670  -2.398
  274    HE1  TRP  41           HE1      TRP  41  10.694   1.599  -0.275
  275    HE3  TRP  41           HE3      TRP  41   5.924  -0.175  -1.241
  276    HZ2  TRP  41           HZ2      TRP  41   9.808  -0.212   1.791
  277    HZ3  TRP  41           HZ3      TRP  41   5.865  -1.557   0.781
  278    HH2  TRP  41           HH2      TRP  41   7.817  -1.585   2.321
  279    H    CYS  42           HN       CYS  42   5.404   0.021  -4.778
  280    HA   CYS  42           HA       CYS  42   4.996   1.511  -7.314
  281   1HB   CYS  42          HB1       CYS  42   3.471  -0.798  -6.094
  282   2HB   CYS  42          HB2       CYS  42   3.039  -0.032  -7.607
  283    H    GLU  43           HN       GLU  43   2.397   1.846  -7.476
  284    HA   GLU  43           HA       GLU  43   1.461   3.304  -5.094
  285   1HB   GLU  43          HB1       GLU  43   2.461   4.548  -7.649
  286   2HB   GLU  43          HB2       GLU  43   0.961   5.196  -7.047
  287   1HG   GLU  43          HG1       GLU  43   1.894   6.010  -5.079
  288   2HG   GLU  43          HG2       GLU  43   3.138   4.801  -4.978
  289    H    THR  44           HN       THR  44   0.150   1.462  -5.157
  290    HA   THR  44           HA       THR  44  -1.875   1.232  -7.221
  291    HB   THR  44           HB       THR  44  -2.423  -0.859  -5.786
  292    HG1  THR  44           HG1      THR  44  -1.816   0.387  -3.906
  293   1HG2  THR  44          HG2       THR  44  -0.371  -0.911  -7.369
  294   2HG2  THR  44          HG2       THR  44   0.605  -0.351  -5.981
  295   3HG2  THR  44          HG2       THR  44  -0.229  -1.934  -5.912
  Start of MODEL   15
    1   1H    ASP   1          HT1       ASP   1   0.999  -0.877   0.445
    2   2H    ASP   1          HT2       ASP   1   1.379   0.684   1.003
    3   3H    ASP   1          HT3       ASP   1   0.130   0.483  -0.125
    4    HA   ASP   1           HA       ASP   1   1.564   0.625  -1.828
    5   1HB   ASP   1          HB1       ASP   1   3.860   0.626   0.156
    6   2HB   ASP   1          HB2       ASP   1   3.759   1.467  -1.383
    7    H    LYS   2           HN       LYS   2   2.841  -0.644  -3.086
    8    HA   LYS   2           HA       LYS   2   3.566  -3.330  -2.022
    9   1HB   LYS   2          HB1       LYS   2   1.716  -2.618  -4.005
   10   2HB   LYS   2          HB2       LYS   2   3.055  -3.272  -4.921
   11   1HG   LYS   2          HG1       LYS   2   1.406  -4.589  -2.700
   12   2HG   LYS   2          HG2       LYS   2   1.443  -5.048  -4.382
   13   1HD   LYS   2          HD1       LYS   2   3.585  -6.016  -4.302
   14   2HD   LYS   2          HD2       LYS   2   4.064  -5.212  -2.837
   15   1HE   LYS   2          HE1       LYS   2   1.929  -7.388  -3.106
   16   2HE   LYS   2          HE2       LYS   2   3.524  -7.589  -2.398
   17   1HZ   LYS   2          HZ1       LYS   2   2.294  -5.394  -1.124
   18   2HZ   LYS   2          HZ2       LYS   2   1.186  -6.682  -1.115
   19   3HZ   LYS   2          HZ3       LYS   2   2.722  -6.891  -0.445
   20    H    LEU   3           HN       LEU   3   5.646  -3.375  -1.867
   21    HA   LEU   3           HA       LEU   3   7.444  -1.760  -3.441
   22   1HB   LEU   3          HB1       LEU   3   7.794  -2.512  -1.069
   23   2HB   LEU   3          HB2       LEU   3   7.985  -4.155  -1.627
   24    HG   LEU   3           HG       LEU   3   9.859  -2.026  -2.740
   25   1HD1  LEU   3          HD1       LEU   3   9.805  -1.645  -0.357
   26   2HD1  LEU   3          HD1       LEU   3  10.050  -3.390  -0.027
   27   3HD1  LEU   3          HD1       LEU   3  11.329  -2.420  -0.835
   28   1HD2  LEU   3          HD2       LEU   3   9.975  -4.441  -3.528
   29   2HD2  LEU   3          HD2       LEU   3  11.444  -3.850  -2.705
   30   3HD2  LEU   3          HD2       LEU   3  10.276  -4.901  -1.835
   31    H    ILE   4           HN       ILE   4   9.151  -2.668  -4.715
   32    HA   ILE   4           HA       ILE   4   8.476  -5.226  -6.076
   33    HB   ILE   4           HB       ILE   4   8.856  -4.337  -8.204
   34   1HG1  ILE   4          HG1       ILE   4   9.472  -1.652  -6.931
   35   2HG1  ILE   4          HG1       ILE   4  10.390  -2.514  -8.144
   36   1HG2  ILE   4          HG2       ILE   4   6.633  -4.406  -7.450
   37   2HG2  ILE   4          HG2       ILE   4   6.770  -2.774  -6.721
   38   3HG2  ILE   4          HG2       ILE   4   6.802  -2.988  -8.502
   39   1HD1  ILE   4          HD1       ILE   4   9.289  -0.680  -9.225
   40   2HD1  ILE   4          HD2       ILE   4   8.455  -2.176  -9.748
   41   3HD1  ILE   4          HD3       ILE   4   7.754  -1.146  -8.461
   42    H    GLY   5           HN       GLY   5  10.871  -2.657  -5.580
   43   1HA   GLY   5          HA1       GLY   5  12.925  -4.549  -5.028
   44   2HA   GLY   5          HA2       GLY   5  13.145  -3.946  -6.651
   45    H    SER   6           HN       SER   6  15.164  -3.045  -5.793
   46    HA   SER   6           HA       SER   6  14.952  -0.834  -3.893
   47   1HB   SER   6          HB1       SER   6  17.167  -2.543  -5.027
   48   2HB   SER   6          HB2       SER   6  17.524  -0.933  -4.474
   49    HG   SER   6           HG       SER   6  16.838  -3.150  -3.135
   50    H    CYS   7           HN       CYS   7  16.101   1.130  -4.466
   51    HA   CYS   7           HA       CYS   7  15.904   1.854  -7.368
   52   1HB   CYS   7          HB1       CYS   7  14.026   2.897  -6.141
   53   2HB   CYS   7          HB2       CYS   7  15.120   3.516  -4.925
   54    H    VAL   8           HN       VAL   8  18.150   0.868  -6.597
   55    HA   VAL   8           HA       VAL   8  19.963   3.197  -6.160
   56    HB   VAL   8           HB       VAL   8  20.301   0.345  -5.161
   57   1HG1  VAL   8          HG1       VAL   8  22.255   1.213  -3.924
   58   2HG1  VAL   8          HG1       VAL   8  22.473   1.391  -5.686
   59   3HG1  VAL   8          HG1       VAL   8  22.020   2.810  -4.690
   60   1HG2  VAL   8          HG2       VAL   8  19.713   2.871  -3.665
   61   2HG2  VAL   8          HG2       VAL   8  18.617   1.474  -3.915
   62   3HG2  VAL   8          HG2       VAL   8  20.081   1.284  -2.919
   63    H    TRP   9           HN       TRP   9  21.165   3.514  -7.875
   64    HA   TRP   9           HA       TRP   9  21.314   1.571 -10.053
   65   1HB   TRP   9          HB1       TRP   9  21.363   4.331 -10.035
   66   2HB   TRP   9          HB2       TRP   9  23.086   4.020 -10.065
   67    HD1  TRP   9           HD1      TRP   9  19.872   3.529 -12.163
   68    HE1  TRP   9           HE1      TRP   9  20.627   2.845 -14.432
   69    HE3  TRP   9           HE3      TRP   9  24.789   2.908 -11.328
   70    HZ2  TRP   9           HZ2      TRP   9  23.027   2.101 -15.872
   71    HZ3  TRP   9           HZ3      TRP   9  26.318   2.204 -13.133
   72    HH2  TRP   9           HH2      TRP   9  25.438   1.800 -15.409
   73    H    GLY  10           HN       GLY  10  22.202   0.036  -8.507
   74   1HA   GLY  10          HA1       GLY  10  24.579  -1.062  -8.930
   75   2HA   GLY  10          HA2       GLY  10  25.124   0.311  -7.971
   76    H    ALA  11           HN       ALA  11  22.518  -2.095  -7.783
   77    HA   ALA  11           HA       ALA  11  23.496  -3.140  -5.260
   78   1HB   ALA  11          HB1       ALA  11  21.445  -2.530  -3.982
   79   2HB   ALA  11          HB2       ALA  11  22.316  -1.081  -4.554
   80   3HB   ALA  11          HB3       ALA  11  20.856  -1.657  -5.423
   81    H    VAL  12           HN       VAL  12  21.629  -4.584  -4.378
   82    HA   VAL  12           HA       VAL  12  21.012  -6.496  -6.492
   83    HB   VAL  12           HB       VAL  12  19.999  -6.635  -3.655
   84   1HG1  VAL  12          HG1       VAL  12  20.415  -9.042  -3.836
   85   2HG1  VAL  12          HG1       VAL  12  19.236  -8.453  -5.026
   86   3HG1  VAL  12          HG1       VAL  12  20.926  -8.794  -5.533
   87   1HG2  VAL  12          HG2       VAL  12  22.370  -6.051  -3.419
   88   2HG2  VAL  12          HG2       VAL  12  22.108  -7.751  -2.958
   89   3HG2  VAL  12          HG2       VAL  12  22.801  -7.360  -4.563
   90    H    ASN  13           HN       ASN  13  18.771  -7.428  -6.434
   91    HA   ASN  13           HA       ASN  13  16.609  -7.037  -7.317
   92   1HB   ASN  13          HB1       ASN  13  15.254  -5.665  -5.406
   93   2HB   ASN  13          HB2       ASN  13  15.632  -7.325  -5.160
   94   1HD2  ASN  13          HD2       ASN  13  17.450  -7.761  -3.585
   95   2HD2  ASN  13          HD2       ASN  13  17.951  -6.516  -2.536
   96    H    TYR  14           HN       TYR  14  18.623  -5.180  -8.037
   97    HA   TYR  14           HA       TYR  14  17.868  -2.499  -7.982
   98   1HB   TYR  14          HB1       TYR  14  20.042  -3.190  -8.867
   99   2HB   TYR  14          HB2       TYR  14  19.290  -4.187 -10.104
  100    HD1  TYR  14           HD1      TYR  14  18.909  -0.606  -9.003
  101    HD2  TYR  14           HD2      TYR  14  19.575  -3.308 -12.231
  102    HE1  TYR  14           HE1      TYR  14  18.989   1.274 -10.569
  103    HE2  TYR  14           HE2      TYR  14  19.654  -1.424 -13.784
  104    HH   TYR  14           HH       TYR  14  18.668   0.950 -13.805
  105    H    THR  15           HN       THR  15  16.363  -1.272  -8.991
  106    HA   THR  15           HA       THR  15  14.336  -2.698 -10.563
  107    HB   THR  15           HB       THR  15  14.480   0.020  -9.206
  108    HG1  THR  15           HG1      THR  15  14.156  -2.374  -8.235
  109   1HG2  THR  15          HG2       THR  15  12.805  -0.007 -11.117
  110   2HG2  THR  15          HG2       THR  15  12.061  -1.438 -10.337
  111   3HG2  THR  15          HG2       THR  15  12.102   0.122  -9.472
  112    H    SER  16           HN       SER  16  15.619   0.607 -10.921
  113    HA   SER  16           HA       SER  16  16.707   1.581 -12.775
  114   1HB   SER  16          HB1       SER  16  17.243  -0.952 -13.653
  115   2HB   SER  16          HB2       SER  16  15.855  -0.649 -14.682
  116    HG   SER  16           HG       SER  16  16.887   0.796 -15.731
  117    H    ASP  17           HN       ASP  17  13.749  -0.199 -13.156
  118    HA   ASP  17           HA       ASP  17  12.452   2.196 -14.331
  119   1HB   ASP  17          HB1       ASP  17  11.244   0.600 -15.872
  120   2HB   ASP  17          HB2       ASP  17  12.963   0.836 -16.149
  121    H    CYS  18           HN       CYS  18  11.907   2.321 -12.023
  122    HA   CYS  18           HA       CYS  18  10.366   0.517 -10.565
  123   1HB   CYS  18          HB1       CYS  18  11.265   2.908 -10.029
  124   2HB   CYS  18          HB2       CYS  18   9.775   3.519 -10.697
  125    H    ASN  19           HN       ASN  19   9.018   2.949 -12.757
  126    HA   ASN  19           HA       ASN  19   6.370   2.014 -12.756
  127   1HB   ASN  19          HB1       ASN  19   7.364   4.067 -14.010
  128   2HB   ASN  19          HB2       ASN  19   7.664   2.955 -15.336
  129   1HD2  ASN  19          HD2       ASN  19   5.580   1.375 -15.691
  130   2HD2  ASN  19          HD2       ASN  19   4.108   2.221 -15.720
  131    H    GLY  20           HN       GLY  20   9.147   0.906 -14.491
  132   1HA   GLY  20          HA1       GLY  20   7.820  -0.961 -16.255
  133   2HA   GLY  20          HA2       GLY  20   9.531  -0.989 -15.848
  134    H    GLU  21           HN       GLU  21   9.948  -1.740 -13.605
  135    HA   GLU  21           HA       GLU  21   9.238  -4.392 -13.156
  136   1HB   GLU  21          HB1       GLU  21  11.001  -3.182 -12.080
  137   2HB   GLU  21          HB2       GLU  21   9.908  -2.218 -11.169
  138   1HG   GLU  21          HG1       GLU  21  10.679  -4.055  -9.649
  139   2HG   GLU  21          HG2       GLU  21   8.968  -4.189 -10.051
  140    H    CYS  22           HN       CYS  22   7.610  -1.570 -12.181
  141    HA   CYS  22           HA       CYS  22   5.610  -2.814 -10.497
  142   1HB   CYS  22          HB1       CYS  22   5.938  -0.115 -11.759
  143   2HB   CYS  22          HB2       CYS  22   4.391  -0.551 -11.185
  144    H    LEU  23           HN       LEU  23   5.728  -1.673 -13.866
  145    HA   LEU  23           HA       LEU  23   3.060  -2.341 -14.527
  146   1HB   LEU  23          HB1       LEU  23   5.638  -1.793 -15.965
  147   2HB   LEU  23          HB2       LEU  23   4.408  -2.584 -16.864
  148    HG   LEU  23           HG       LEU  23   4.012   0.051 -15.393
  149   1HD1  LEU  23          HD1       LEU  23   5.697   0.191 -17.237
  150   2HD1  LEU  23          HD1       LEU  23   4.508  -0.537 -18.351
  151   3HD1  LEU  23          HD1       LEU  23   4.203   1.084 -17.658
  152   1HD2  LEU  23          HD2       LEU  23   1.924  -1.156 -15.821
  153   2HD2  LEU  23          HD2       LEU  23   2.042   0.298 -16.846
  154   3HD2  LEU  23          HD2       LEU  23   2.377  -1.320 -17.543
  155    H    LEU  24           HN       LEU  24   6.038  -4.072 -14.302
  156    HA   LEU  24           HA       LEU  24   5.308  -6.411 -15.766
  157   1HB   LEU  24          HB1       LEU  24   7.450  -5.394 -14.049
  158   2HB   LEU  24          HB2       LEU  24   7.130  -7.023 -13.652
  159    HG   LEU  24           HG       LEU  24   7.725  -5.907 -16.460
  160   1HD1  LEU  24          HD1       LEU  24   9.507  -7.403 -14.504
  161   2HD1  LEU  24          HD1       LEU  24   9.941  -6.946 -16.183
  162   3HD1  LEU  24          HD1       LEU  24   9.635  -5.683 -14.960
  163   1HD2  LEU  24          HD2       LEU  24   8.125  -8.224 -17.137
  164   2HD2  LEU  24          HD2       LEU  24   7.675  -8.786 -15.498
  165   3HD2  LEU  24          HD2       LEU  24   6.455  -8.004 -16.549
  166    H    ARG  25           HN       ARG  25   4.762  -5.337 -12.638
  167    HA   ARG  25           HA       ARG  25   3.378  -7.831 -11.786
  168   1HB   ARG  25          HB1       ARG  25   4.471  -5.425 -10.307
  169   2HB   ARG  25          HB2       ARG  25   3.275  -6.327  -9.474
  170   1HG   ARG  25          HG1       ARG  25   5.041  -7.307  -8.703
  171   2HG   ARG  25          HG2       ARG  25   4.583  -8.416  -9.992
  172   1HD   ARG  25          HD1       ARG  25   6.377  -7.655 -11.395
  173   2HD   ARG  25          HD2       ARG  25   6.281  -6.083 -10.690
  174    HE   ARG  25           HE       ARG  25   8.037  -6.709  -9.606
  175   1HH1  ARG  25          HH1       ARG  25   7.930  -8.897  -6.840
  176   2HH1  ARG  25          HH1       ARG  25   8.234  -7.258  -7.304
  177   1HH2  ARG  25          HH2       ARG  25   6.948 -10.342  -8.569
  178   2HH2  ARG  25          HH2       ARG  25   6.602  -9.527 -10.056
  179    H    GLY  26           HN       GLY  26   2.517  -5.372 -13.542
  180   1HA   GLY  26          HA1       GLY  26   0.426  -4.508 -14.168
  181   2HA   GLY  26          HA2       GLY  26  -0.304  -5.723 -13.119
  182    H    TYR  27           HN       TYR  27   2.026  -3.672 -11.714
  183    HA   TYR  27           HA       TYR  27  -0.020  -2.472  -9.998
  184   1HB   TYR  27          HB1       TYR  27   3.039  -2.407 -10.038
  185   2HB   TYR  27          HB2       TYR  27   2.100  -1.513  -8.875
  186    HD1  TYR  27           HD1      TYR  27   3.927  -3.230  -7.699
  187    HD2  TYR  27           HD2      TYR  27   0.124  -4.392  -9.230
  188    HE1  TYR  27           HE1      TYR  27   3.916  -5.123  -6.217
  189    HE2  TYR  27           HE2      TYR  27   0.108  -6.282  -7.745
  190    HH   TYR  27           HH       TYR  27   1.936  -7.720  -6.466
  191    H    LYS  28           HN       LYS  28   0.348  -0.134  -9.429
  192    HA   LYS  28           HA       LYS  28   0.049   1.364 -11.920
  193   1HB   LYS  28          HB1       LYS  28  -0.101   2.399  -9.053
  194   2HB   LYS  28          HB2       LYS  28  -0.698   3.205 -10.472
  195   1HG   LYS  28          HG1       LYS  28  -2.713   2.287  -9.904
  196   2HG   LYS  28          HG2       LYS  28  -2.096   0.865 -10.714
  197   1HD   LYS  28          HD1       LYS  28  -2.227  -0.354  -8.816
  198   2HD   LYS  28          HD2       LYS  28  -1.125   0.748  -8.004
  199   1HE   LYS  28          HE1       LYS  28  -2.955   2.230  -7.331
  200   2HE   LYS  28          HE2       LYS  28  -4.120   1.324  -8.280
  201   1HZ   LYS  28          HZ1       LYS  28  -3.377   0.948  -5.637
  202   2HZ   LYS  28          HZ2       LYS  28  -4.452   0.004  -6.524
  203   3HZ   LYS  28          HZ3       LYS  28  -2.814  -0.427  -6.448
  204    H    GLY  29           HN       GLY  29   1.229   3.113 -12.469
  205   1HA   GLY  29          HA1       GLY  29   3.881   3.125 -12.660
  206   2HA   GLY  29          HA2       GLY  29   3.034   4.653 -12.446
  207    H    GLY  30           HN       GLY  30   5.129   2.345 -11.021
  208   1HA   GLY  30          HA1       GLY  30   4.919   3.309  -8.301
  209   2HA   GLY  30          HA2       GLY  30   6.188   2.255  -8.937
  210    H    HIS  31           HN       HIS  31   7.241   3.726  -7.387
  211    HA   HIS  31           HA       HIS  31   8.867   5.611  -8.895
  212   1HB   HIS  31          HB1       HIS  31   8.330   7.631  -7.462
  213   2HB   HIS  31          HB2       HIS  31   6.931   7.099  -8.371
  214    HD1  HIS  31           HD1      HIS  31   4.895   6.551  -6.940
  215    HD2  HIS  31           HD2      HIS  31   8.277   6.610  -4.546
  216    HE1  HIS  31           HE1      HIS  31   4.115   6.271  -4.635
  217    HE2  HIS  31           HE2      HIS  31   6.168   6.316  -3.233
  218    H    CYS  32           HN       CYS  32  10.395   6.809  -7.329
  219    HA   CYS  32           HA       CYS  32  11.448   4.736  -5.512
  220   1HB   CYS  32          HB1       CYS  32  12.578   7.349  -6.562
  221   2HB   CYS  32          HB2       CYS  32  13.411   6.303  -5.444
  222    H    GLY  33           HN       GLY  33  11.928   5.173  -3.352
  223   1HA   GLY  33          HA1       GLY  33  10.242   5.990  -1.553
  224   2HA   GLY  33          HA2       GLY  33  11.903   6.525  -1.363
  225    H    SER  34           HN       SER  34  12.448   8.654  -1.832
  226    HA   SER  34           HA       SER  34  10.592  10.515  -2.996
  227   1HB   SER  34          HB1       SER  34   9.553  10.124  -0.652
  228   2HB   SER  34          HB2       SER  34  10.998  10.849   0.054
  229    HG   SER  34           HG       SER  34   9.762  12.614  -0.345
  230    H    PHE  35           HN       PHE  35  12.944  10.802  -0.368
  231    HA   PHE  35           HA       PHE  35  14.746  12.310  -2.226
  232   1HB   PHE  35          HB1       PHE  35  13.263  13.510  -0.255
  233   2HB   PHE  35          HB2       PHE  35  14.669  13.065   0.687
  234    HD1  PHE  35           HD1      PHE  35  17.024  13.788  -0.301
  235    HD2  PHE  35           HD2      PHE  35  13.300  15.448  -1.555
  236    HE1  PHE  35           HE1      PHE  35  18.189  15.738  -1.189
  237    HE2  PHE  35           HE2      PHE  35  14.476  17.404  -2.441
  238    HZ   PHE  35           HZ       PHE  35  16.923  17.564  -2.264
  239    H    ALA  36           HN       ALA  36  14.906   9.569  -1.702
  240    HA   ALA  36           HA       ALA  36  17.587   9.369  -0.913
  241   1HB   ALA  36          HB1       ALA  36  16.533   9.474   1.333
  242   2HB   ALA  36          HB2       ALA  36  15.454   8.119   0.866
  243   3HB   ALA  36          HB3       ALA  36  17.208   7.846   1.032
  244    H    ASN  37           HN       ASN  37  16.731   8.777  -3.246
  245    HA   ASN  37           HA       ASN  37  15.483   6.503  -4.022
  246   1HB   ASN  37          HB1       ASN  37  17.387   6.339  -5.774
  247   2HB   ASN  37          HB2       ASN  37  16.406   7.773  -5.823
  248   1HD2  ASN  37          HD2       ASN  37  17.635   9.688  -5.970
  249   2HD2  ASN  37          HD2       ASN  37  19.262   9.803  -5.494
  250    H    VAL  38           HN       VAL  38  15.553   4.923  -2.561
  251    HA   VAL  38           HA       VAL  38  17.978   3.213  -2.530
  252    HB   VAL  38           HB       VAL  38  17.530   2.571  -0.153
  253   1HG1  VAL  38          HG1       VAL  38  18.213   5.474  -0.608
  254   2HG1  VAL  38          HG1       VAL  38  18.513   4.558   0.900
  255   3HG1  VAL  38          HG1       VAL  38  19.293   4.061  -0.636
  256   1HG2  VAL  38          HG2       VAL  38  16.299   4.020   1.357
  257   2HG2  VAL  38          HG2       VAL  38  15.596   4.889  -0.040
  258   3HG2  VAL  38          HG2       VAL  38  15.256   3.153   0.197
  259    H    ASN  39           HN       ASN  39  14.524   3.391  -1.717
  260    HA   ASN  39           HA       ASN  39  14.205   0.640  -2.777
  261   1HB   ASN  39          HB1       ASN  39  12.667   1.904  -0.459
  262   2HB   ASN  39          HB2       ASN  39  12.263   0.425  -1.252
  263   1HD2  ASN  39          HD2       ASN  39  12.960  -1.342  -0.027
  264   2HD2  ASN  39          HD2       ASN  39  14.406  -1.361   0.862
  265    H    CYS  40           HN       CYS  40  12.599   0.361  -4.274
  266    HA   CYS  40           HA       CYS  40  11.012   2.769  -4.975
  267   1HB   CYS  40          HB1       CYS  40  12.095   2.135  -6.946
  268   2HB   CYS  40          HB2       CYS  40  12.173   0.464  -6.509
  269    H    TRP  41           HN       TRP  41   8.899   2.621  -5.040
  270    HA   TRP  41           HA       TRP  41   7.604   0.045  -4.253
  271   1HB   TRP  41          HB1       TRP  41   6.924   2.792  -3.125
  272   2HB   TRP  41          HB2       TRP  41   5.935   1.362  -2.938
  273    HD1  TRP  41           HD1      TRP  41   9.631   2.429  -2.094
  274    HE1  TRP  41           HE1      TRP  41  10.146   1.269   0.052
  275    HE3  TRP  41           HE3      TRP  41   5.397  -0.169  -1.503
  276    HZ2  TRP  41           HZ2      TRP  41   8.911  -0.626   1.941
  277    HZ3  TRP  41           HZ3      TRP  41   5.035  -1.656   0.434
  278    HH2  TRP  41           HH2      TRP  41   6.792  -1.885   2.158
  279    H    CYS  42           HN       CYS  42   5.269  -0.021  -4.839
  280    HA   CYS  42           HA       CYS  42   4.969   1.428  -7.380
  281   1HB   CYS  42          HB1       CYS  42   3.510  -0.941  -6.227
  282   2HB   CYS  42          HB2       CYS  42   3.022  -0.114  -7.707
  283    H    GLU  43           HN       GLU  43   2.629   2.077  -7.834
  284    HA   GLU  43           HA       GLU  43   1.811   3.705  -5.486
  285   1HB   GLU  43          HB1       GLU  43   1.538   4.156  -8.487
  286   2HB   GLU  43          HB2       GLU  43   0.640   5.112  -7.317
  287   1HG   GLU  43          HG1       GLU  43   3.013   5.267  -6.081
  288   2HG   GLU  43          HG2       GLU  43   3.659   4.891  -7.665
  289    H    THR  44           HN       THR  44   1.181   1.563  -4.925
  290    HA   THR  44           HA       THR  44  -1.462   0.840  -5.855
  291    HB   THR  44           HB       THR  44  -1.084  -1.110  -4.152
  292    HG1  THR  44           HG1      THR  44   0.383   0.748  -3.318
  293   1HG2  THR  44          HG2       THR  44   0.749  -2.048  -5.511
  294   2HG2  THR  44          HG2       THR  44  -0.224  -1.064  -6.612
  295   3HG2  THR  44          HG2       THR  44   1.301  -0.392  -5.953
  Start of MODEL   16
    1   1H    ASP   1          HT1       ASP   1   0.522   0.805  -0.138
    2   2H    ASP   1          HT2       ASP   1   1.655  -0.398   0.340
    3   3H    ASP   1          HT3       ASP   1   2.029   1.292   0.413
    4    HA   ASP   1           HA       ASP   1   1.320   0.747  -2.199
    5   1HB   ASP   1          HB1       ASP   1   4.104   1.167  -0.929
    6   2HB   ASP   1          HB2       ASP   1   3.711   1.387  -2.628
    7    H    LYS   2           HN       LYS   2   2.793  -0.442  -3.663
    8    HA   LYS   2           HA       LYS   2   3.183  -3.214  -2.720
    9   1HB   LYS   2          HB1       LYS   2   2.067  -1.842  -5.103
   10   2HB   LYS   2          HB2       LYS   2   3.033  -3.219  -5.417
   11   1HG   LYS   2          HG1       LYS   2   0.580  -3.578  -5.262
   12   2HG   LYS   2          HG2       LYS   2   1.404  -4.574  -4.071
   13   1HD   LYS   2          HD1       LYS   2   0.806  -2.893  -2.336
   14   2HD   LYS   2          HD2       LYS   2   0.114  -1.837  -3.556
   15   1HE   LYS   2          HE1       LYS   2  -1.170  -4.350  -3.968
   16   2HE   LYS   2          HE2       LYS   2  -1.028  -4.247  -2.229
   17   1HZ   LYS   2          HZ1       LYS   2  -2.862  -2.980  -3.892
   18   2HZ   LYS   2          HZ2       LYS   2  -2.711  -2.786  -2.208
   19   3HZ   LYS   2          HZ3       LYS   2  -1.899  -1.761  -3.304
   20    H    LEU   3           HN       LEU   3   5.288  -3.152  -2.114
   21    HA   LEU   3           HA       LEU   3   7.404  -1.732  -3.321
   22   1HB   LEU   3          HB1       LEU   3   7.379  -2.972  -1.077
   23   2HB   LEU   3          HB2       LEU   3   7.626  -4.461  -1.956
   24    HG   LEU   3           HG       LEU   3   9.621  -2.166  -2.362
   25   1HD1  LEU   3          HD1       LEU   3   9.322  -2.369   0.049
   26   2HD1  LEU   3          HD1       LEU   3   9.614  -4.126  -0.038
   27   3HD1  LEU   3          HD1       LEU   3  10.920  -2.971  -0.466
   28   1HD2  LEU   3          HD2       LEU   3  11.228  -3.955  -2.529
   29   2HD2  LEU   3          HD2       LEU   3   9.991  -5.169  -2.046
   30   3HD2  LEU   3          HD2       LEU   3   9.887  -4.358  -3.627
   31    H    ILE   4           HN       ILE   4   9.115  -2.573  -4.570
   32    HA   ILE   4           HA       ILE   4   8.412  -4.832  -6.383
   33    HB   ILE   4           HB       ILE   4   9.254  -3.475  -8.364
   34   1HG1  ILE   4          HG1       ILE   4   8.837  -1.026  -6.573
   35   2HG1  ILE   4          HG1       ILE   4  10.427  -1.665  -6.977
   36   1HG2  ILE   4          HG2       ILE   4   6.862  -2.390  -6.872
   37   2HG2  ILE   4          HG2       ILE   4   7.129  -2.310  -8.641
   38   3HG2  ILE   4          HG2       ILE   4   6.899  -3.889  -7.843
   39   1HD1  ILE   4          HD1       ILE   4   8.367  -0.784  -9.018
   40   2HD1  ILE   4          HD2       ILE   4   9.796   0.138  -8.505
   41   3HD1  ILE   4          HD3       ILE   4  10.019  -1.427  -9.326
   42    H    GLY   5           HN       GLY   5  10.905  -2.615  -5.242
   43   1HA   GLY   5          HA1       GLY   5  12.797  -4.613  -4.682
   44   2HA   GLY   5          HA2       GLY   5  13.126  -4.047  -6.324
   45    H    SER   6           HN       SER   6  15.133  -3.059  -5.753
   46    HA   SER   6           HA       SER   6  15.102  -0.990  -3.730
   47   1HB   SER   6          HB1       SER   6  17.236  -2.325  -5.394
   48   2HB   SER   6          HB2       SER   6  17.481  -1.224  -4.046
   49    HG   SER   6           HG       SER   6  17.228  -3.643  -3.823
   50    H    CYS   7           HN       CYS   7  16.824   0.782  -4.651
   51    HA   CYS   7           HA       CYS   7  16.192   1.689  -7.366
   52   1HB   CYS   7          HB1       CYS   7  14.277   2.600  -6.127
   53   2HB   CYS   7          HB2       CYS   7  15.308   3.205  -4.855
   54    H    VAL   8           HN       VAL   8  18.511   0.762  -5.989
   55    HA   VAL   8           HA       VAL   8  20.190   3.207  -6.137
   56    HB   VAL   8           HB       VAL   8  20.081   1.085  -3.955
   57   1HG1  VAL   8          HG1       VAL   8  22.703   2.353  -4.780
   58   2HG1  VAL   8          HG1       VAL   8  22.389   1.410  -3.289
   59   3HG1  VAL   8          HG1       VAL   8  22.287   0.613  -4.876
   60   1HG2  VAL   8          HG2       VAL   8  21.152   3.942  -4.125
   61   2HG2  VAL   8          HG2       VAL   8  19.470   3.522  -3.758
   62   3HG2  VAL   8          HG2       VAL   8  20.780   3.052  -2.617
   63    H    TRP   9           HN       TRP   9  21.685   3.103  -7.569
   64    HA   TRP   9           HA       TRP   9  22.066   0.661  -9.132
   65   1HB   TRP   9          HB1       TRP   9  22.327   3.395  -9.826
   66   2HB   TRP   9          HB2       TRP   9  24.013   2.917  -9.660
   67    HD1  TRP   9           HD1      TRP   9  20.858   2.254 -11.728
   68    HE1  TRP   9           HE1      TRP   9  21.503   0.711 -13.585
   69    HE3  TRP   9           HE3      TRP   9  25.596   1.179 -10.416
   70    HZ2  TRP   9           HZ2      TRP   9  23.750  -0.785 -14.558
   71    HZ3  TRP   9           HZ3      TRP   9  27.001  -0.308 -11.804
   72    HH2  TRP   9           HH2      TRP   9  26.078  -1.292 -13.885
   73    H    GLY  10           HN       GLY  10  22.662  -0.217  -6.939
   74   1HA   GLY  10          HA1       GLY  10  25.207  -1.260  -6.878
   75   2HA   GLY  10          HA2       GLY  10  25.358   0.224  -5.945
   76    H    ALA  11           HN       ALA  11  22.667  -2.068  -6.146
   77    HA   ALA  11           HA       ALA  11  23.151  -3.099  -3.468
   78   1HB   ALA  11          HB1       ALA  11  21.950  -0.999  -3.059
   79   2HB   ALA  11          HB2       ALA  11  20.678  -1.498  -4.216
   80   3HB   ALA  11          HB3       ALA  11  20.886  -2.386  -2.679
   81    H    VAL  12           HN       VAL  12  21.115  -4.474  -2.928
   82    HA   VAL  12           HA       VAL  12  20.890  -6.464  -5.042
   83    HB   VAL  12           HB       VAL  12  19.197  -6.548  -2.548
   84   1HG1  VAL  12          HG1       VAL  12  20.764  -8.671  -3.997
   85   2HG1  VAL  12          HG1       VAL  12  19.754  -8.917  -2.540
   86   3HG1  VAL  12          HG1       VAL  12  18.986  -8.407  -4.055
   87   1HG2  VAL  12          HG2       VAL  12  21.044  -7.507  -1.223
   88   2HG2  VAL  12          HG2       VAL  12  22.177  -7.086  -2.547
   89   3HG2  VAL  12          HG2       VAL  12  21.328  -5.799  -1.634
   90    H    ASN  13           HN       ASN  13  18.688  -7.342  -5.519
   91    HA   ASN  13           HA       ASN  13  16.758  -6.947  -6.803
   92   1HB   ASN  13          HB1       ASN  13  16.118  -5.451  -4.291
   93   2HB   ASN  13          HB2       ASN  13  14.924  -5.908  -5.489
   94   1HD2  ASN  13          HD2       ASN  13  13.758  -7.713  -4.661
   95   2HD2  ASN  13          HD2       ASN  13  14.508  -9.006  -3.849
   96    H    TYR  14           HN       TYR  14  18.963  -5.081  -7.114
   97    HA   TYR  14           HA       TYR  14  18.256  -2.398  -7.241
   98   1HB   TYR  14          HB1       TYR  14  20.519  -2.694  -7.740
   99   2HB   TYR  14          HB2       TYR  14  20.259  -4.201  -8.573
  100    HD1  TYR  14           HD1      TYR  14  19.579  -0.528  -9.058
  101    HD2  TYR  14           HD2      TYR  14  20.487  -4.259 -10.897
  102    HE1  TYR  14           HE1      TYR  14  19.708   0.557 -11.224
  103    HE2  TYR  14           HE2      TYR  14  20.626  -3.141 -13.083
  104    HH   TYR  14           HH       TYR  14  19.355  -0.236 -13.726
  105    H    THR  15           HN       THR  15  17.056  -1.155  -8.566
  106    HA   THR  15           HA       THR  15  15.731  -2.476 -10.896
  107    HB   THR  15           HB       THR  15  14.085  -1.927  -8.929
  108    HG1  THR  15           HG1      THR  15  13.394  -2.380 -11.011
  109   1HG2  THR  15          HG2       THR  15  14.933   0.568  -8.774
  110   2HG2  THR  15          HG2       THR  15  14.236   0.750 -10.416
  111   3HG2  THR  15          HG2       THR  15  13.186   0.305  -9.044
  112    H    SER  16           HN       SER  16  14.793  -0.788 -12.270
  113    HA   SER  16           HA       SER  16  16.539   1.580 -12.687
  114   1HB   SER  16          HB1       SER  16  16.536  -0.855 -14.393
  115   2HB   SER  16          HB2       SER  16  16.202   0.602 -15.319
  116    HG   SER  16           HG       SER  16  18.172   1.150 -15.059
  117    H    ASP  17           HN       ASP  17  13.875  -0.242 -14.016
  118    HA   ASP  17           HA       ASP  17  12.461   2.290 -14.688
  119   1HB   ASP  17          HB1       ASP  17  11.170   0.776 -16.244
  120   2HB   ASP  17          HB2       ASP  17  12.868   0.915 -16.658
  121    H    CYS  18           HN       CYS  18  12.137   2.224 -12.294
  122    HA   CYS  18           HA       CYS  18  10.652   0.485 -10.781
  123   1HB   CYS  18          HB1       CYS  18  11.544   2.818 -10.266
  124   2HB   CYS  18          HB2       CYS  18  10.065   3.500 -10.898
  125    H    ASN  19           HN       ASN  19   9.208   2.949 -12.849
  126    HA   ASN  19           HA       ASN  19   6.537   2.222 -12.781
  127   1HB   ASN  19          HB1       ASN  19   7.591   4.155 -14.091
  128   2HB   ASN  19          HB2       ASN  19   8.051   2.989 -15.325
  129   1HD2  ASN  19          HD2       ASN  19   5.664   5.207 -14.644
  130   2HD2  ASN  19          HD2       ASN  19   4.415   4.473 -15.531
  131    H    GLY  20           HN       GLY  20   9.009   0.934 -14.915
  132   1HA   GLY  20          HA1       GLY  20   7.398  -0.996 -16.248
  133   2HA   GLY  20          HA2       GLY  20   9.152  -1.056 -16.139
  134    H    GLU  21           HN       GLU  21   9.839  -1.578 -13.848
  135    HA   GLU  21           HA       GLU  21   9.392  -4.200 -13.154
  136   1HB   GLU  21          HB1       GLU  21  11.094  -2.425 -12.403
  137   2HB   GLU  21          HB2       GLU  21   9.901  -1.789 -11.345
  138   1HG   GLU  21          HG1       GLU  21  11.248  -2.972  -9.852
  139   2HG   GLU  21          HG2       GLU  21   9.960  -4.094 -10.157
  140    H    CYS  22           HN       CYS  22   7.556  -1.451 -12.227
  141    HA   CYS  22           HA       CYS  22   5.755  -2.834 -10.413
  142   1HB   CYS  22          HB1       CYS  22   5.964  -0.102 -11.565
  143   2HB   CYS  22          HB2       CYS  22   4.384  -0.571 -11.096
  144    H    LEU  23           HN       LEU  23   5.611  -1.688 -13.794
  145    HA   LEU  23           HA       LEU  23   2.979  -2.546 -14.307
  146   1HB   LEU  23          HB1       LEU  23   5.461  -1.974 -15.909
  147   2HB   LEU  23          HB2       LEU  23   4.098  -2.672 -16.688
  148    HG   LEU  23           HG       LEU  23   4.049  -0.043 -15.104
  149   1HD1  LEU  23          HD1       LEU  23   5.473   0.106 -17.091
  150   2HD1  LEU  23          HD1       LEU  23   4.142  -0.542 -18.105
  151   3HD1  LEU  23          HD1       LEU  23   3.983   1.053 -17.300
  152   1HD2  LEU  23          HD2       LEU  23   1.925   0.364 -16.289
  153   2HD2  LEU  23          HD2       LEU  23   2.065  -1.241 -17.072
  154   3HD2  LEU  23          HD2       LEU  23   1.827  -1.121 -15.304
  155    H    LEU  24           HN       LEU  24   6.072  -4.134 -14.179
  156    HA   LEU  24           HA       LEU  24   5.391  -6.519 -15.570
  157   1HB   LEU  24          HB1       LEU  24   7.545  -5.357 -13.992
  158   2HB   LEU  24          HB2       LEU  24   7.302  -6.986 -13.478
  159    HG   LEU  24           HG       LEU  24   7.656  -6.077 -16.368
  160   1HD1  LEU  24          HD1       LEU  24   9.668  -5.604 -15.020
  161   2HD1  LEU  24          HD1       LEU  24   9.681  -7.303 -14.448
  162   3HD1  LEU  24          HD1       LEU  24   9.963  -6.928 -16.174
  163   1HD2  LEU  24          HD2       LEU  24   6.551  -8.270 -16.110
  164   2HD2  LEU  24          HD2       LEU  24   8.192  -8.452 -16.794
  165   3HD2  LEU  24          HD2       LEU  24   7.895  -8.827 -15.070
  166    H    ARG  25           HN       ARG  25   4.984  -5.439 -12.426
  167    HA   ARG  25           HA       ARG  25   3.812  -7.967 -11.421
  168   1HB   ARG  25          HB1       ARG  25   4.720  -5.339 -10.169
  169   2HB   ARG  25          HB2       ARG  25   3.664  -6.405  -9.259
  170   1HG   ARG  25          HG1       ARG  25   5.248  -8.206  -9.241
  171   2HG   ARG  25          HG2       ARG  25   6.156  -7.559 -10.582
  172   1HD   ARG  25          HD1       ARG  25   6.104  -6.079  -7.922
  173   2HD   ARG  25          HD2       ARG  25   7.258  -7.379  -8.148
  174    HE   ARG  25           HE       ARG  25   7.211  -4.869  -9.763
  175   1HH1  ARG  25          HH1       ARG  25   9.868  -6.469 -11.363
  176   2HH1  ARG  25          HH1       ARG  25   8.162  -6.154 -11.592
  177   1HH2  ARG  25          HH2       ARG  25  10.672  -6.328  -9.229
  178   2HH2  ARG  25          HH2       ARG  25   9.655  -5.999  -7.878
  179    H    GLY  26           HN       GLY  26   2.685  -5.601 -13.261
  180   1HA   GLY  26          HA1       GLY  26   0.468  -5.172 -13.950
  181   2HA   GLY  26          HA2       GLY  26  -0.107  -6.197 -12.633
  182    H    TYR  27           HN       TYR  27   2.139  -3.907 -11.659
  183    HA   TYR  27           HA       TYR  27   0.050  -2.384 -10.264
  184   1HB   TYR  27          HB1       TYR  27   3.085  -2.314 -10.107
  185   2HB   TYR  27          HB2       TYR  27   2.060  -1.357  -9.083
  186    HD1  TYR  27           HD1      TYR  27  -0.070  -3.696  -8.624
  187    HD2  TYR  27           HD2      TYR  27   4.171  -3.470  -8.347
  188    HE1  TYR  27           HE1      TYR  27  -0.077  -5.467  -6.961
  189    HE2  TYR  27           HE2      TYR  27   4.160  -5.240  -6.671
  190    HH   TYR  27           HH       TYR  27   2.608  -7.151  -5.962
  191    H    LYS  28           HN       LYS  28   0.480  -0.054 -10.041
  192    HA   LYS  28           HA       LYS  28   0.496   1.161 -12.693
  193   1HB   LYS  28          HB1       LYS  28   0.104   2.316  -9.898
  194   2HB   LYS  28          HB2       LYS  28  -0.115   3.240 -11.359
  195   1HG   LYS  28          HG1       LYS  28  -2.165   2.232 -11.881
  196   2HG   LYS  28          HG2       LYS  28  -1.761   0.717 -11.103
  197   1HD   LYS  28          HD1       LYS  28  -3.507   1.930  -9.778
  198   2HD   LYS  28          HD2       LYS  28  -2.018   1.705  -8.896
  199   1HE   LYS  28          HE1       LYS  28  -1.361   4.130  -9.534
  200   2HE   LYS  28          HE2       LYS  28  -2.964   4.312 -10.217
  201   1HZ   LYS  28          HZ1       LYS  28  -3.650   4.888  -8.108
  202   2HZ   LYS  28          HZ2       LYS  28  -3.302   3.308  -7.608
  203   3HZ   LYS  28          HZ3       LYS  28  -2.109   4.416  -7.514
  204    H    GLY  29           HN       GLY  29   1.797   2.934 -13.193
  205   1HA   GLY  29          HA1       GLY  29   4.487   2.779 -13.102
  206   2HA   GLY  29          HA2       GLY  29   3.681   4.352 -13.093
  207    H    GLY  30           HN       GLY  30   5.412   2.034 -11.207
  208   1HA   GLY  30          HA1       GLY  30   4.943   3.171  -8.629
  209   2HA   GLY  30          HA2       GLY  30   6.277   2.096  -9.063
  210    H    HIS  31           HN       HIS  31   7.251   3.563  -7.478
  211    HA   HIS  31           HA       HIS  31   8.934   5.481  -8.880
  212   1HB   HIS  31          HB1       HIS  31   8.283   7.447  -7.433
  213   2HB   HIS  31          HB2       HIS  31   6.826   6.844  -8.227
  214    HD1  HIS  31           HD1      HIS  31   5.489   5.019  -6.689
  215    HD2  HIS  31           HD2      HIS  31   8.074   7.397  -4.496
  216    HE1  HIS  31           HE1      HIS  31   4.844   4.727  -4.296
  217    HE2  HIS  31           HE2      HIS  31   6.452   6.214  -3.050
  218    H    CYS  32           HN       CYS  32  10.459   6.557  -7.269
  219    HA   CYS  32           HA       CYS  32  11.346   4.468  -5.381
  220   1HB   CYS  32          HB1       CYS  32  12.655   7.039  -6.330
  221   2HB   CYS  32          HB2       CYS  32  13.373   5.911  -5.206
  222    H    GLY  33           HN       GLY  33  11.666   4.958  -3.193
  223   1HA   GLY  33          HA1       GLY  33   9.883   5.944  -1.552
  224   2HA   GLY  33          HA2       GLY  33  11.547   6.372  -1.245
  225    H    SER  34           HN       SER  34  12.280   8.416  -1.687
  226    HA   SER  34           HA       SER  34  10.854  10.427  -3.078
  227   1HB   SER  34          HB1       SER  34  10.205  11.751  -0.924
  228   2HB   SER  34          HB2       SER  34   9.205  10.330  -1.280
  229    HG   SER  34           HG       SER  34   9.868  10.014   0.792
  230    H    PHE  35           HN       PHE  35  12.441  10.440  -0.016
  231    HA   PHE  35           HA       PHE  35  14.731  12.009  -1.218
  232   1HB   PHE  35          HB1       PHE  35  12.958  13.014   0.605
  233   2HB   PHE  35          HB2       PHE  35  14.123  12.317   1.714
  234    HD1  PHE  35           HD1      PHE  35  16.652  12.992   1.371
  235    HD2  PHE  35           HD2      PHE  35  13.395  15.079  -0.427
  236    HE1  PHE  35           HE1      PHE  35  18.091  14.931   1.000
  237    HE2  PHE  35           HE2      PHE  35  14.844  17.014  -0.796
  238    HZ   PHE  35           HZ       PHE  35  17.199  16.952  -0.083
  239    H    ALA  36           HN       ALA  36  14.682   9.212  -1.114
  240    HA   ALA  36           HA       ALA  36  17.158   8.724   0.115
  241   1HB   ALA  36          HB1       ALA  36  14.685   7.327   1.226
  242   2HB   ALA  36          HB2       ALA  36  16.369   6.939   1.667
  243   3HB   ALA  36          HB3       ALA  36  15.682   8.529   2.111
  244    H    ASN  37           HN       ASN  37  16.546   8.568  -2.437
  245    HA   ASN  37           HA       ASN  37  15.449   6.426  -3.691
  246   1HB   ASN  37          HB1       ASN  37  18.111   7.813  -4.272
  247   2HB   ASN  37          HB2       ASN  37  17.277   6.763  -5.397
  248   1HD2  ASN  37          HD2       ASN  37  16.049   7.972  -6.875
  249   2HD2  ASN  37          HD2       ASN  37  15.274   9.440  -6.499
  250    H    VAL  38           HN       VAL  38  15.507   4.581  -2.584
  251    HA   VAL  38           HA       VAL  38  17.933   2.966  -2.782
  252    HB   VAL  38           HB       VAL  38  17.851   4.349  -0.568
  253   1HG1  VAL  38          HG1       VAL  38  15.549   3.884   0.093
  254   2HG1  VAL  38          HG1       VAL  38  15.956   2.138   0.220
  255   3HG1  VAL  38          HG1       VAL  38  16.721   3.319   1.315
  256   1HG2  VAL  38          HG2       VAL  38  18.366   1.394  -0.564
  257   2HG2  VAL  38          HG2       VAL  38  19.469   2.736  -0.999
  258   3HG2  VAL  38          HG2       VAL  38  18.904   2.549   0.688
  259    H    ASN  39           HN       ASN  39  14.591   3.133  -1.632
  260    HA   ASN  39           HA       ASN  39  14.129   0.400  -2.706
  261   1HB   ASN  39          HB1       ASN  39  12.579   1.784  -0.471
  262   2HB   ASN  39          HB2       ASN  39  12.264   0.223  -1.112
  263   1HD2  ASN  39          HD2       ASN  39  14.386  -1.298  -0.966
  264   2HD2  ASN  39          HD2       ASN  39  15.198  -1.191   0.521
  265    H    CYS  40           HN       CYS  40  12.462   0.161  -4.116
  266    HA   CYS  40           HA       CYS  40  10.948   2.652  -4.779
  267   1HB   CYS  40          HB1       CYS  40  12.376   0.761  -6.434
  268   2HB   CYS  40          HB2       CYS  40  10.674   0.555  -6.750
  269    H    TRP  41           HN       TRP  41   8.794   2.526  -4.992
  270    HA   TRP  41           HA       TRP  41   7.392   0.060  -4.111
  271   1HB   TRP  41          HB1       TRP  41   6.934   2.820  -2.927
  272   2HB   TRP  41          HB2       TRP  41   5.860   1.469  -2.742
  273    HD1  TRP  41           HD1      TRP  41   9.580   2.397  -1.907
  274    HE1  TRP  41           HE1      TRP  41  10.114   1.099   0.156
  275    HE3  TRP  41           HE3      TRP  41   5.363  -0.231  -1.458
  276    HZ2  TRP  41           HZ2      TRP  41   8.871  -0.878   1.951
  277    HZ3  TRP  41           HZ3      TRP  41   4.986  -1.805   0.391
  278    HH2  TRP  41           HH2      TRP  41   6.752  -2.138   2.107
  279    H    CYS  42           HN       CYS  42   5.220  -0.078  -4.831
  280    HA   CYS  42           HA       CYS  42   4.808   1.518  -7.266
  281   1HB   CYS  42          HB1       CYS  42   3.305  -0.800  -6.107
  282   2HB   CYS  42          HB2       CYS  42   2.828   0.004  -7.583
  283    H    GLU  43           HN       GLU  43   2.200   1.854  -7.407
  284    HA   GLU  43           HA       GLU  43   1.295   3.299  -4.993
  285   1HB   GLU  43          HB1       GLU  43   0.768   5.103  -7.141
  286   2HB   GLU  43          HB2       GLU  43   1.945   5.301  -5.862
  287   1HG   GLU  43          HG1       GLU  43   3.598   4.012  -7.264
  288   2HG   GLU  43          HG2       GLU  43   2.427   4.016  -8.580
  289    H    THR  44           HN       THR  44   0.025   1.412  -5.061
  290    HA   THR  44           HA       THR  44  -2.088   1.157  -7.053
  291    HB   THR  44           HB       THR  44  -2.739  -0.838  -5.691
  292    HG1  THR  44           HG1      THR  44  -1.908   0.589  -3.788
  293   1HG2  THR  44          HG2       THR  44   0.309  -0.496  -5.608
  294   2HG2  THR  44          HG2       THR  44  -0.617  -2.034  -5.698
  295   3HG2  THR  44          HG2       THR  44  -0.576  -0.939  -7.098
  Start of MODEL   17
    1   1H    ASP   1          HT1       ASP   1   0.502   0.679  -0.427
    2   2H    ASP   1          HT2       ASP   1   1.823  -0.283   0.103
    3   3H    ASP   1          HT3       ASP   1   1.957   1.418   0.012
    4    HA   ASP   1           HA       ASP   1   1.221   0.564  -2.517
    5   1HB   ASP   1          HB1       ASP   1   3.945   1.397  -1.410
    6   2HB   ASP   1          HB2       ASP   1   3.397   1.533  -3.084
    7    H    LYS   2           HN       LYS   2   2.545  -0.754  -3.918
    8    HA   LYS   2           HA       LYS   2   3.308  -3.309  -2.636
    9   1HB   LYS   2          HB1       LYS   2   1.633  -2.847  -4.757
   10   2HB   LYS   2          HB2       LYS   2   3.135  -3.006  -5.634
   11   1HG   LYS   2          HG1       LYS   2   1.951  -5.065  -3.752
   12   2HG   LYS   2          HG2       LYS   2   1.944  -5.114  -5.496
   13   1HD   LYS   2          HD1       LYS   2   4.460  -5.173  -5.556
   14   2HD   LYS   2          HD2       LYS   2   4.568  -5.049  -3.832
   15   1HE   LYS   2          HE1       LYS   2   3.470  -7.449  -5.352
   16   2HE   LYS   2          HE2       LYS   2   4.996  -7.322  -4.521
   17   1HZ   LYS   2          HZ1       LYS   2   2.988  -6.589  -2.713
   18   2HZ   LYS   2          HZ2       LYS   2   2.477  -8.009  -3.493
   19   3HZ   LYS   2          HZ3       LYS   2   3.964  -7.989  -2.679
   20    H    LEU   3           HN       LEU   3   5.369  -3.282  -2.076
   21    HA   LEU   3           HA       LEU   3   7.372  -1.691  -3.329
   22   1HB   LEU   3          HB1       LEU   3   7.339  -2.690  -0.950
   23   2HB   LEU   3          HB2       LEU   3   7.834  -4.219  -1.649
   24    HG   LEU   3           HG       LEU   3   9.489  -1.791  -2.394
   25   1HD1  LEU   3          HD1       LEU   3   9.059  -1.430  -0.055
   26   2HD1  LEU   3          HD1       LEU   3   9.631  -3.078   0.341
   27   3HD1  LEU   3          HD1       LEU   3  10.758  -1.863  -0.354
   28   1HD2  LEU   3          HD2       LEU   3  10.109  -4.124  -3.132
   29   2HD2  LEU   3          HD2       LEU   3  11.335  -3.278  -2.149
   30   3HD2  LEU   3          HD2       LEU   3  10.290  -4.546  -1.416
   31    H    ILE   4           HN       ILE   4   9.254  -2.523  -4.399
   32    HA   ILE   4           HA       ILE   4   8.807  -4.981  -6.017
   33    HB   ILE   4           HB       ILE   4   9.717  -3.811  -8.055
   34   1HG1  ILE   4          HG1       ILE   4   9.117  -1.182  -6.648
   35   2HG1  ILE   4          HG1       ILE   4  10.730  -1.890  -6.730
   36   1HG2  ILE   4          HG2       ILE   4   7.181  -2.647  -6.885
   37   2HG2  ILE   4          HG2       ILE   4   7.611  -2.675  -8.625
   38   3HG2  ILE   4          HG2       ILE   4   7.333  -4.205  -7.748
   39   1HD1  ILE   4          HD1       ILE   4  10.715  -1.951  -9.103
   40   2HD1  ILE   4          HD2       ILE   4   9.053  -1.268  -9.145
   41   3HD1  ILE   4          HD3       ILE   4  10.399  -0.292  -8.512
   42    H    GLY   5           HN       GLY   5  11.072  -2.510  -4.885
   43   1HA   GLY   5          HA1       GLY   5  13.046  -4.345  -4.095
   44   2HA   GLY   5          HA2       GLY   5  13.444  -3.817  -5.730
   45    H    SER   6           HN       SER   6  15.275  -2.731  -5.136
   46    HA   SER   6           HA       SER   6  14.942  -0.428  -3.288
   47   1HB   SER   6          HB1       SER   6  17.083  -2.369  -3.690
   48   2HB   SER   6          HB2       SER   6  17.714  -0.775  -4.043
   49    HG   SER   6           HG       SER   6  17.756  -0.633  -1.905
   50    H    CYS   7           HN       CYS   7  16.242   1.518  -3.914
   51    HA   CYS   7           HA       CYS   7  16.356   2.013  -6.844
   52   1HB   CYS   7          HB1       CYS   7  15.074   3.760  -4.717
   53   2HB   CYS   7          HB2       CYS   7  15.544   4.334  -6.274
   54    H    VAL   8           HN       VAL   8  18.446   1.320  -5.243
   55    HA   VAL   8           HA       VAL   8  19.950   3.888  -4.955
   56    HB   VAL   8           HB       VAL   8  20.513   1.315  -3.414
   57   1HG1  VAL   8          HG1       VAL   8  22.424   2.806  -3.639
   58   2HG1  VAL   8          HG1       VAL   8  21.446   4.157  -2.990
   59   3HG1  VAL   8          HG1       VAL   8  21.846   2.755  -1.951
   60   1HG2  VAL   8          HG2       VAL   8  19.511   2.387  -1.455
   61   2HG2  VAL   8          HG2       VAL   8  18.999   3.751  -2.503
   62   3HG2  VAL   8          HG2       VAL   8  18.333   2.114  -2.769
   63    H    TRP   9           HN       TRP   9  21.554   4.052  -6.337
   64    HA   TRP   9           HA       TRP   9  22.340   1.799  -8.006
   65   1HB   TRP   9          HB1       TRP   9  22.361   4.607  -8.314
   66   2HB   TRP   9          HB2       TRP   9  24.064   4.230  -8.158
   67    HD1  TRP   9           HD1      TRP   9  22.131   5.072 -10.818
   68    HE1  TRP   9           HE1      TRP   9  22.551   3.656 -12.838
   69    HE3  TRP   9           HE3      TRP   9  24.449   1.047  -8.747
   70    HZ2  TRP   9           HZ2      TRP   9  23.682   1.155 -13.622
   71    HZ3  TRP   9           HZ3      TRP   9  25.179  -0.830 -10.140
   72    HH2  TRP   9           HH2      TRP   9  24.802  -0.788 -12.588
   73    H    GLY  10           HN       GLY  10  22.900   0.590  -6.118
   74   1HA   GLY  10          HA1       GLY  10  25.461  -0.199  -5.777
   75   2HA   GLY  10          HA2       GLY  10  25.441   1.231  -4.754
   76    H    ALA  11           HN       ALA  11  23.110  -1.377  -5.338
   77    HA   ALA  11           HA       ALA  11  23.419  -2.486  -2.690
   78   1HB   ALA  11          HB1       ALA  11  22.057  -0.485  -2.217
   79   2HB   ALA  11          HB2       ALA  11  20.882  -1.011  -3.463
   80   3HB   ALA  11          HB3       ALA  11  21.086  -1.966  -1.968
   81    H    VAL  12           HN       VAL  12  21.515  -4.059  -2.364
   82    HA   VAL  12           HA       VAL  12  21.463  -5.832  -4.687
   83    HB   VAL  12           HB       VAL  12  19.905  -6.259  -2.134
   84   1HG1  VAL  12          HG1       VAL  12  19.539  -7.980  -3.757
   85   2HG1  VAL  12          HG1       VAL  12  21.314  -8.213  -3.932
   86   3HG1  VAL  12          HG1       VAL  12  20.485  -8.609  -2.397
   87   1HG2  VAL  12          HG2       VAL  12  22.871  -6.769  -2.500
   88   2HG2  VAL  12          HG2       VAL  12  22.143  -5.583  -1.376
   89   3HG2  VAL  12          HG2       VAL  12  21.894  -7.325  -1.102
   90    H    ASN  13           HN       ASN  13  19.338  -6.875  -5.154
   91    HA   ASN  13           HA       ASN  13  17.330  -6.577  -6.366
   92   1HB   ASN  13          HB1       ASN  13  16.534  -5.108  -3.896
   93   2HB   ASN  13          HB2       ASN  13  15.488  -6.073  -4.916
   94   1HD2  ASN  13          HD2       ASN  13  16.745  -6.235  -1.910
   95   2HD2  ASN  13          HD2       ASN  13  17.041  -7.906  -1.802
   96    H    TYR  14           HN       TYR  14  19.396  -4.550  -6.649
   97    HA   TYR  14           HA       TYR  14  18.345  -1.926  -6.642
   98   1HB   TYR  14          HB1       TYR  14  20.764  -2.224  -6.923
   99   2HB   TYR  14          HB2       TYR  14  20.527  -3.223  -8.349
  100    HD1  TYR  14           HD1      TYR  14  19.435   0.194  -7.196
  101    HD2  TYR  14           HD2      TYR  14  20.991  -2.148 -10.387
  102    HE1  TYR  14           HE1      TYR  14  19.540   2.187  -8.614
  103    HE2  TYR  14           HE2      TYR  14  21.094  -0.145 -11.795
  104    HH   TYR  14           HH       TYR  14  21.315   2.453 -11.208
  105    H    THR  15           HN       THR  15  17.039  -0.821  -7.998
  106    HA   THR  15           HA       THR  15  16.181  -2.158 -10.476
  107    HB   THR  15           HB       THR  15  14.667  -0.787  -8.246
  108    HG1  THR  15           HG1      THR  15  13.705  -3.117  -9.585
  109   1HG2  THR  15          HG2       THR  15  12.623  -0.715  -9.377
  110   2HG2  THR  15          HG2       THR  15  13.777   0.402 -10.154
  111   3HG2  THR  15          HG2       THR  15  13.369  -1.168 -10.932
  112    H    SER  16           HN       SER  16  15.111  -0.499 -11.883
  113    HA   SER  16           HA       SER  16  16.478   2.134 -11.920
  114   1HB   SER  16          HB1       SER  16  17.979   0.788 -13.272
  115   2HB   SER  16          HB2       SER  16  16.636   0.015 -14.128
  116    HG   SER  16           HG       SER  16  16.207   1.878 -15.162
  117    H    ASP  17           HN       ASP  17  14.237  -0.013 -13.654
  118    HA   ASP  17           HA       ASP  17  12.578   2.332 -14.355
  119   1HB   ASP  17          HB1       ASP  17  11.645   0.790 -16.078
  120   2HB   ASP  17          HB2       ASP  17  13.394   0.850 -16.205
  121    H    CYS  18           HN       CYS  18  12.187   2.208 -11.970
  122    HA   CYS  18           HA       CYS  18  10.757   0.280 -10.589
  123   1HB   CYS  18          HB1       CYS  18  11.576   2.642 -10.016
  124   2HB   CYS  18          HB2       CYS  18   9.988   3.237 -10.447
  125    H    ASN  19           HN       ASN  19   8.964   2.979 -12.144
  126    HA   ASN  19           HA       ASN  19   6.497   1.807 -12.179
  127   1HB   ASN  19          HB1       ASN  19   7.434   4.085 -13.320
  128   2HB   ASN  19          HB2       ASN  19   7.203   3.125 -14.781
  129   1HD2  ASN  19          HD2       ASN  19   4.941   1.803 -14.684
  130   2HD2  ASN  19          HD2       ASN  19   3.626   2.705 -14.104
  131    H    GLY  20           HN       GLY  20   9.193   0.984 -14.085
  132   1HA   GLY  20          HA1       GLY  20   7.845  -0.633 -16.077
  133   2HA   GLY  20          HA2       GLY  20   9.571  -0.693 -15.705
  134    H    GLU  21           HN       GLU  21   9.866  -1.545 -13.357
  135    HA   GLU  21           HA       GLU  21   9.225  -4.290 -13.317
  136   1HB   GLU  21          HB1       GLU  21  10.962  -2.846 -11.991
  137   2HB   GLU  21          HB2       GLU  21   9.704  -2.728 -10.800
  138   1HG   GLU  21          HG1       GLU  21  10.180  -4.822  -9.990
  139   2HG   GLU  21          HG2       GLU  21   9.885  -5.527 -11.530
  140    H    CYS  22           HN       CYS  22   7.549  -1.564 -12.033
  141    HA   CYS  22           HA       CYS  22   5.659  -3.105 -10.471
  142   1HB   CYS  22          HB1       CYS  22   5.921  -0.234 -11.280
  143   2HB   CYS  22          HB2       CYS  22   4.408  -0.764 -10.683
  144    H    LEU  23           HN       LEU  23   5.677  -1.497 -13.682
  145    HA   LEU  23           HA       LEU  23   3.003  -2.120 -14.310
  146   1HB   LEU  23          HB1       LEU  23   5.530  -1.426 -15.794
  147   2HB   LEU  23          HB2       LEU  23   4.157  -1.977 -16.683
  148    HG   LEU  23           HG       LEU  23   3.975   0.282 -14.644
  149   1HD1  LEU  23          HD1       LEU  23   4.340   0.435 -17.665
  150   2HD1  LEU  23          HD1       LEU  23   4.096   1.850 -16.601
  151   3HD1  LEU  23          HD1       LEU  23   5.592   0.874 -16.467
  152   1HD2  LEU  23          HD2       LEU  23   1.839  -0.708 -15.227
  153   2HD2  LEU  23          HD2       LEU  23   1.963   0.947 -15.869
  154   3HD2  LEU  23          HD2       LEU  23   2.190  -0.454 -16.963
  155    H    LEU  24           HN       LEU  24   5.999  -3.885 -14.358
  156    HA   LEU  24           HA       LEU  24   5.129  -6.009 -16.043
  157   1HB   LEU  24          HB1       LEU  24   7.299  -5.317 -14.143
  158   2HB   LEU  24          HB2       LEU  24   6.994  -6.996 -14.299
  159    HG   LEU  24           HG       LEU  24   7.592  -5.018 -16.573
  160   1HD1  LEU  24          HD1       LEU  24   9.762  -6.123 -16.734
  161   2HD1  LEU  24          HD1       LEU  24   9.542  -5.402 -15.121
  162   3HD1  LEU  24          HD1       LEU  24   9.348  -7.176 -15.352
  163   1HD2  LEU  24          HD2       LEU  24   7.956  -6.987 -17.981
  164   2HD2  LEU  24          HD2       LEU  24   7.484  -8.057 -16.621
  165   3HD2  LEU  24          HD2       LEU  24   6.280  -6.972 -17.381
  166    H    ARG  25           HN       ARG  25   4.749  -5.285 -12.779
  167    HA   ARG  25           HA       ARG  25   3.483  -7.858 -12.118
  168   1HB   ARG  25          HB1       ARG  25   4.252  -5.401 -10.550
  169   2HB   ARG  25          HB2       ARG  25   2.996  -6.457  -9.949
  170   1HG   ARG  25          HG1       ARG  25   4.760  -7.498  -8.868
  171   2HG   ARG  25          HG2       ARG  25   4.836  -8.394 -10.357
  172   1HD   ARG  25          HD1       ARG  25   6.543  -5.930  -9.745
  173   2HD   ARG  25          HD2       ARG  25   7.147  -7.545  -9.505
  174    HE   ARG  25           HE       ARG  25   6.331  -6.358 -12.107
  175   1HH1  ARG  25          HH1       ARG  25   9.515  -7.569 -13.021
  176   2HH1  ARG  25          HH1       ARG  25   8.661  -6.111 -12.625
  177   1HH2  ARG  25          HH2       ARG  25   8.348  -9.655 -12.217
  178   2HH2  ARG  25          HH2       ARG  25   6.867  -9.380 -11.379
  179    H    GLY  26           HN       GLY  26   2.471  -5.284 -13.759
  180   1HA   GLY  26          HA1       GLY  26   0.299  -4.868 -14.606
  181   2HA   GLY  26          HA2       GLY  26  -0.349  -6.020 -13.442
  182    H    TYR  27           HN       TYR  27   1.763  -3.733 -12.112
  183    HA   TYR  27           HA       TYR  27  -0.486  -2.554 -10.653
  184   1HB   TYR  27          HB1       TYR  27   2.458  -1.779 -10.602
  185   2HB   TYR  27          HB2       TYR  27   1.270  -1.278  -9.415
  186    HD1  TYR  27           HD1      TYR  27  -0.231  -4.035  -9.295
  187    HD2  TYR  27           HD2      TYR  27   3.878  -2.963  -9.103
  188    HE1  TYR  27           HE1      TYR  27   0.212  -6.034  -8.056
  189    HE2  TYR  27           HE2      TYR  27   4.339  -4.990  -7.828
  190    HH   TYR  27           HH       TYR  27   2.269  -7.531  -7.778
  191    H    LYS  28           HN       LYS  28  -1.275  -0.656 -10.766
  192    HA   LYS  28           HA       LYS  28  -1.616   0.705 -13.144
  193   1HB   LYS  28          HB1       LYS  28  -1.878   2.812 -11.470
  194   2HB   LYS  28          HB2       LYS  28  -3.089   1.555 -11.575
  195   1HG   LYS  28          HG1       LYS  28  -0.773   1.081  -9.658
  196   2HG   LYS  28          HG2       LYS  28  -1.859   2.365  -9.268
  197   1HD   LYS  28          HD1       LYS  28  -3.028  -0.346 -10.041
  198   2HD   LYS  28          HD2       LYS  28  -2.413  -0.140  -8.424
  199   1HE   LYS  28          HE1       LYS  28  -3.859   2.209  -8.671
  200   2HE   LYS  28          HE2       LYS  28  -4.700   1.271  -9.886
  201   1HZ   LYS  28          HZ1       LYS  28  -5.857   0.352  -8.246
  202   2HZ   LYS  28          HZ2       LYS  28  -4.443  -0.312  -7.558
  203   3HZ   LYS  28          HZ3       LYS  28  -4.899   1.252  -7.151
  204    H    GLY  29           HN       GLY  29   0.733   1.497 -10.608
  205   1HA   GLY  29          HA1       GLY  29   2.704   2.287 -12.539
  206   2HA   GLY  29          HA2       GLY  29   1.986   3.686 -11.728
  207    H    GLY  30           HN       GLY  30   4.660   3.289 -11.416
  208   1HA   GLY  30          HA1       GLY  30   4.812   2.727  -8.569
  209   2HA   GLY  30          HA2       GLY  30   5.876   1.767  -9.614
  210    H    HIS  31           HN       HIS  31   6.703   3.585  -7.569
  211    HA   HIS  31           HA       HIS  31   8.391   5.310  -9.213
  212   1HB   HIS  31          HB1       HIS  31   7.767   7.391  -8.117
  213   2HB   HIS  31          HB2       HIS  31   6.310   6.647  -8.725
  214    HD1  HIS  31           HD1      HIS  31   4.680   7.475  -7.182
  215    HD2  HIS  31           HD2      HIS  31   7.842   5.925  -5.005
  216    HE1  HIS  31           HE1      HIS  31   3.956   7.534  -4.815
  217    HE2  HIS  31           HE2      HIS  31   5.921   6.576  -3.543
  218    H    CYS  32           HN       CYS  32  10.135   6.229  -7.941
  219    HA   CYS  32           HA       CYS  32  11.036   4.308  -5.933
  220   1HB   CYS  32          HB1       CYS  32  12.354   6.667  -7.294
  221   2HB   CYS  32          HB2       CYS  32  13.085   5.899  -5.906
  222    H    GLY  33           HN       GLY  33  11.529   4.814  -3.862
  223   1HA   GLY  33          HA1       GLY  33  10.575   5.708  -1.827
  224   2HA   GLY  33          HA2       GLY  33  11.746   6.916  -2.362
  225    H    SER  34           HN       SER  34  10.984   8.827  -2.024
  226    HA   SER  34           HA       SER  34   8.510   9.655  -3.349
  227   1HB   SER  34          HB1       SER  34   7.768   8.768  -1.017
  228   2HB   SER  34          HB2       SER  34   8.666  10.126  -0.314
  229    HG   SER  34           HG       SER  34   7.075  11.406  -1.009
  230    H    PHE  35           HN       PHE  35  11.077  10.558  -1.038
  231    HA   PHE  35           HA       PHE  35  12.051  12.660  -2.655
  232   1HB   PHE  35          HB1       PHE  35   9.789  13.507  -1.606
  233   2HB   PHE  35          HB2       PHE  35  10.683  13.610  -0.112
  234    HD1  PHE  35           HD1      PHE  35  12.848  15.050  -0.053
  235    HD2  PHE  35           HD2      PHE  35  10.045  15.200  -3.263
  236    HE1  PHE  35           HE1      PHE  35  13.793  17.191  -0.779
  237    HE2  PHE  35           HE2      PHE  35  10.992  17.348  -3.982
  238    HZ   PHE  35           HZ       PHE  35  12.868  18.348  -2.745
  239    H    ALA  36           HN       ALA  36  13.826  11.498  -2.218
  240    HA   ALA  36           HA       ALA  36  15.977  11.439  -1.300
  241   1HB   ALA  36          HB1       ALA  36  16.500  12.338   0.869
  242   2HB   ALA  36          HB2       ALA  36  15.556  13.554  -0.046
  243   3HB   ALA  36          HB3       ALA  36  14.790  12.591   1.263
  244    H    ASN  37           HN       ASN  37  14.527   9.310  -1.514
  245    HA   ASN  37           HA       ASN  37  14.631   7.909   1.044
  246   1HB   ASN  37          HB1       ASN  37  12.447   7.923  -0.405
  247   2HB   ASN  37          HB2       ASN  37  13.398   6.902  -1.500
  248   1HD2  ASN  37          HD2       ASN  37  12.390   6.932   2.016
  249   2HD2  ASN  37          HD2       ASN  37  12.267   5.238   2.062
  250    H    VAL  38           HN       VAL  38  14.722   5.300  -0.358
  251    HA   VAL  38           HA       VAL  38  17.093   5.159  -1.945
  252    HB   VAL  38           HB       VAL  38  18.321   3.695  -0.190
  253   1HG1  VAL  38          HG1       VAL  38  18.038   6.568   0.758
  254   2HG1  VAL  38          HG1       VAL  38  19.386   5.444   1.053
  255   3HG1  VAL  38          HG1       VAL  38  19.076   6.036  -0.605
  256   1HG2  VAL  38          HG2       VAL  38  16.391   5.040   1.699
  257   2HG2  VAL  38          HG2       VAL  38  16.454   3.297   1.279
  258   3HG2  VAL  38          HG2       VAL  38  17.804   4.053   2.166
  259    H    ASN  39           HN       ASN  39  14.324   4.290  -2.000
  260    HA   ASN  39           HA       ASN  39  14.776   1.476  -2.620
  261   1HB   ASN  39          HB1       ASN  39  13.249   2.199  -0.156
  262   2HB   ASN  39          HB2       ASN  39  12.270   1.328  -1.297
  263   1HD2  ASN  39          HD2       ASN  39  15.834   0.825  -0.762
  264   2HD2  ASN  39          HD2       ASN  39  15.592  -0.803  -0.391
  265    H    CYS  40           HN       CYS  40  12.581   0.488  -3.462
  266    HA   CYS  40           HA       CYS  40  11.240   2.571  -5.091
  267   1HB   CYS  40          HB1       CYS  40  12.695   0.247  -5.949
  268   2HB   CYS  40          HB2       CYS  40  11.022  -0.044  -6.230
  269    H    TRP  41           HN       TRP  41   8.992   2.378  -5.320
  270    HA   TRP  41           HA       TRP  41   7.663   0.113  -4.045
  271   1HB   TRP  41          HB1       TRP  41   7.052   3.007  -3.302
  272   2HB   TRP  41          HB2       TRP  41   6.191   1.602  -2.752
  273    HD1  TRP  41           HD1      TRP  41   9.826   3.132  -2.426
  274    HE1  TRP  41           HE1      TRP  41  10.625   2.372  -0.159
  275    HE3  TRP  41           HE3      TRP  41   5.970   0.230  -1.061
  276    HZ2  TRP  41           HZ2      TRP  41   9.779   0.710   2.063
  277    HZ3  TRP  41           HZ3      TRP  41   5.918  -0.938   1.081
  278    HH2  TRP  41           HH2      TRP  41   7.833  -0.706   2.680
  279    H    CYS  42           HN       CYS  42   5.390   0.057  -4.685
  280    HA   CYS  42           HA       CYS  42   5.099   1.250  -7.347
  281   1HB   CYS  42          HB1       CYS  42   3.450  -0.808  -5.866
  282   2HB   CYS  42          HB2       CYS  42   2.998  -0.179  -7.434
  283    H    GLU  43           HN       GLU  43   2.548   1.782  -7.637
  284    HA   GLU  43           HA       GLU  43   1.691   3.646  -5.494
  285   1HB   GLU  43          HB1       GLU  43   3.355   4.524  -7.201
  286   2HB   GLU  43          HB2       GLU  43   2.114   4.339  -8.409
  287   1HG   GLU  43          HG1       GLU  43   0.839   6.141  -7.542
  288   2HG   GLU  43          HG2       GLU  43   1.742   6.163  -6.026
  289    H    THR  44           HN       THR  44   0.259   1.813  -5.355
  290    HA   THR  44           HA       THR  44  -1.775   1.425  -7.385
  291    HB   THR  44           HB       THR  44  -2.587  -0.278  -5.600
  292    HG1  THR  44           HG1      THR  44  -1.454   1.495  -4.205
  293   1HG2  THR  44          HG2       THR  44  -0.571  -1.637  -5.559
  294   2HG2  THR  44          HG2       THR  44  -0.613  -0.884  -7.182
  295   3HG2  THR  44          HG2       THR  44   0.468  -0.226  -5.921
  Start of MODEL   18
    1   1H    ASP   1          HT1       ASP   1  -0.284   0.750  -0.633
    2   2H    ASP   1          HT2       ASP   1   0.561  -0.601  -0.005
    3   3H    ASP   1          HT3       ASP   1   0.964   0.943   0.512
    4    HA   ASP   1           HA       ASP   1   1.246   0.860  -2.270
    5   1HB   ASP   1          HB1       ASP   1   3.725   1.161  -1.540
    6   2HB   ASP   1          HB2       ASP   1   2.609   2.355  -0.942
    7    H    LYS   2           HN       LYS   2   2.996  -0.349  -3.294
    8    HA   LYS   2           HA       LYS   2   3.260  -3.150  -2.395
    9   1HB   LYS   2          HB1       LYS   2   1.586  -2.178  -4.507
   10   2HB   LYS   2          HB2       LYS   2   2.961  -2.892  -5.289
   11   1HG   LYS   2          HG1       LYS   2   1.126  -4.495  -4.889
   12   2HG   LYS   2          HG2       LYS   2   2.589  -5.015  -4.050
   13   1HD   LYS   2          HD1       LYS   2   1.543  -3.976  -1.939
   14   2HD   LYS   2          HD2       LYS   2   0.137  -3.588  -2.924
   15   1HE   LYS   2          HE1       LYS   2  -0.121  -6.034  -3.406
   16   2HE   LYS   2          HE2       LYS   2   1.308  -6.361  -2.438
   17   1HZ   LYS   2          HZ1       LYS   2  -1.331  -6.007  -1.572
   18   2HZ   LYS   2          HZ2       LYS   2   0.023  -6.347  -0.625
   19   3HZ   LYS   2          HZ3       LYS   2  -0.420  -4.733  -0.919
   20    H    LEU   3           HN       LEU   3   5.276  -3.120  -1.897
   21    HA   LEU   3           HA       LEU   3   7.380  -1.721  -3.184
   22   1HB   LEU   3          HB1       LEU   3   7.392  -2.819  -0.870
   23   2HB   LEU   3          HB2       LEU   3   7.568  -4.366  -1.652
   24    HG   LEU   3           HG       LEU   3   9.653  -2.182  -2.185
   25   1HD1  LEU   3          HD1       LEU   3   9.584  -4.104   0.169
   26   2HD1  LEU   3          HD1       LEU   3  10.945  -3.027  -0.293
   27   3HD1  LEU   3          HD1       LEU   3   9.385  -2.337   0.243
   28   1HD2  LEU   3          HD2       LEU   3  11.184  -4.020  -2.350
   29   2HD2  LEU   3          HD2       LEU   3   9.927  -5.195  -1.811
   30   3HD2  LEU   3          HD2       LEU   3   9.798  -4.428  -3.399
   31    H    ILE   4           HN       ILE   4   9.071  -2.636  -4.394
   32    HA   ILE   4           HA       ILE   4   8.366  -4.976  -6.043
   33    HB   ILE   4           HB       ILE   4   9.292  -3.635  -8.119
   34   1HG1  ILE   4          HG1       ILE   4   9.003  -1.308  -6.182
   35   2HG1  ILE   4          HG1       ILE   4  10.466  -1.905  -6.967
   36   1HG2  ILE   4          HG2       ILE   4   6.893  -4.094  -7.723
   37   2HG2  ILE   4          HG2       ILE   4   6.794  -2.582  -6.764
   38   3HG2  ILE   4          HG2       ILE   4   7.157  -2.533  -8.522
   39   1HD1  ILE   4          HD1       ILE   4   9.581   0.041  -8.140
   40   2HD1  ILE   4          HD2       ILE   4   9.542  -1.421  -9.155
   41   3HD1  ILE   4          HD3       ILE   4   8.036  -0.784  -8.383
   42    H    GLY   5           HN       GLY   5  10.870  -2.692  -5.082
   43   1HA   GLY   5          HA1       GLY   5  12.768  -4.655  -4.430
   44   2HA   GLY   5          HA2       GLY   5  13.082  -4.148  -6.096
   45    H    SER   6           HN       SER   6  15.067  -3.132  -5.607
   46    HA   SER   6           HA       SER   6  14.842  -0.821  -3.745
   47   1HB   SER   6          HB1       SER   6  16.883  -2.371  -3.328
   48   2HB   SER   6          HB2       SER   6  17.469  -1.945  -4.921
   49    HG   SER   6           HG       SER   6  17.141  -0.311  -2.611
   50    H    CYS   7           HN       CYS   7  16.251   0.964  -4.391
   51    HA   CYS   7           HA       CYS   7  16.231   1.594  -7.293
   52   1HB   CYS   7          HB1       CYS   7  14.014   2.358  -6.467
   53   2HB   CYS   7          HB2       CYS   7  14.791   3.251  -5.182
   54    H    VAL   8           HN       VAL   8  18.286   0.999  -5.574
   55    HA   VAL   8           HA       VAL   8  19.705   3.642  -5.386
   56    HB   VAL   8           HB       VAL   8  20.418   1.167  -3.754
   57   1HG1  VAL   8          HG1       VAL   8  21.629   2.734  -2.325
   58   2HG1  VAL   8          HG1       VAL   8  22.210   2.793  -4.011
   59   3HG1  VAL   8          HG1       VAL   8  21.128   4.079  -3.392
   60   1HG2  VAL   8          HG2       VAL   8  19.355   2.195  -1.825
   61   2HG2  VAL   8          HG2       VAL   8  18.717   3.489  -2.896
   62   3HG2  VAL   8          HG2       VAL   8  18.206   1.791  -3.127
   63    H    TRP   9           HN       TRP   9  21.408   3.800  -6.657
   64    HA   TRP   9           HA       TRP   9  22.284   1.554  -8.278
   65   1HB   TRP   9          HB1       TRP   9  22.185   3.835  -9.222
   66   2HB   TRP   9          HB2       TRP   9  23.319   4.406  -8.010
   67    HD1  TRP   9           HD1      TRP   9  24.707   5.352 -10.080
   68    HE1  TRP   9           HE1      TRP   9  26.445   4.178 -11.450
   69    HE3  TRP   9           HE3      TRP   9  23.708   0.434  -9.057
   70    HZ2  TRP   9           HZ2      TRP   9  27.389   1.621 -12.120
   71    HZ3  TRP   9           HZ3      TRP   9  25.056  -1.323 -10.085
   72    HH2  TRP   9           HH2      TRP   9  26.901  -0.751 -11.622
   73    H    GLY  10           HN       GLY  10  22.707   0.441  -6.197
   74   1HA   GLY  10          HA1       GLY  10  25.272  -0.344  -5.751
   75   2HA   GLY  10          HA2       GLY  10  25.171   1.097  -4.746
   76    H    ALA  11           HN       ALA  11  22.874  -1.515  -5.440
   77    HA   ALA  11           HA       ALA  11  23.021  -2.590  -2.754
   78   1HB   ALA  11          HB1       ALA  11  21.572  -0.624  -2.439
   79   2HB   ALA  11          HB2       ALA  11  20.517  -1.196  -3.768
   80   3HB   ALA  11          HB3       ALA  11  20.636  -2.134  -2.250
   81    H    VAL  12           HN       VAL  12  21.087  -4.188  -2.568
   82    HA   VAL  12           HA       VAL  12  21.289  -5.975  -4.881
   83    HB   VAL  12           HB       VAL  12  19.572  -6.563  -2.469
   84   1HG1  VAL  12          HG1       VAL  12  20.459  -8.824  -2.686
   85   2HG1  VAL  12          HG1       VAL  12  19.650  -8.266  -4.164
   86   3HG1  VAL  12          HG1       VAL  12  21.446  -8.286  -4.079
   87   1HG2  VAL  12          HG2       VAL  12  22.600  -6.690  -2.454
   88   2HG2  VAL  12          HG2       VAL  12  21.577  -5.627  -1.436
   89   3HG2  VAL  12          HG2       VAL  12  21.526  -7.390  -1.200
   90    H    ASN  13           HN       ASN  13  19.246  -7.081  -5.526
   91    HA   ASN  13           HA       ASN  13  17.338  -6.837  -6.858
   92   1HB   ASN  13          HB1       ASN  13  15.779  -5.421  -4.826
   93   2HB   ASN  13          HB2       ASN  13  15.573  -7.056  -5.399
   94   1HD2  ASN  13          HD2       ASN  13  16.269  -5.299  -2.611
   95   2HD2  ASN  13          HD2       ASN  13  16.994  -6.555  -1.725
   96    H    TYR  14           HN       TYR  14  19.292  -4.717  -6.908
   97    HA   TYR  14           HA       TYR  14  18.184  -2.128  -6.921
   98   1HB   TYR  14          HB1       TYR  14  20.595  -2.209  -7.131
   99   2HB   TYR  14          HB2       TYR  14  20.531  -3.405  -8.412
  100    HD1  TYR  14           HD1      TYR  14  19.536   0.161  -7.752
  101    HD2  TYR  14           HD2      TYR  14  20.733  -2.701 -10.654
  102    HE1  TYR  14           HE1      TYR  14  19.647   1.923  -9.447
  103    HE2  TYR  14           HE2      TYR  14  20.836  -0.935 -12.347
  104    HH   TYR  14           HH       TYR  14  19.542   1.383 -12.573
  105    H    THR  15           HN       THR  15  16.948  -1.013  -8.299
  106    HA   THR  15           HA       THR  15  16.165  -2.349 -10.853
  107    HB   THR  15           HB       THR  15  14.316  -2.093  -8.954
  108    HG1  THR  15           HG1      THR  15  13.373  -2.554 -10.674
  109   1HG2  THR  15          HG2       THR  15  14.024   0.504 -10.555
  110   2HG2  THR  15          HG2       THR  15  13.004  -0.115  -9.234
  111   3HG2  THR  15          HG2       THR  15  14.634   0.507  -8.862
  112    H    SER  16           HN       SER  16  15.066  -0.661 -12.169
  113    HA   SER  16           HA       SER  16  16.598   1.908 -12.296
  114   1HB   SER  16          HB1       SER  16  16.790  -0.325 -14.304
  115   2HB   SER  16          HB2       SER  16  16.643   1.296 -14.970
  116    HG   SER  16           HG       SER  16  18.695   1.382 -14.561
  117    H    ASP  17           HN       ASP  17  14.168  -0.053 -13.936
  118    HA   ASP  17           HA       ASP  17  12.622   2.398 -14.574
  119   1HB   ASP  17          HB1       ASP  17  11.489   0.896 -16.242
  120   2HB   ASP  17          HB2       ASP  17  13.220   0.980 -16.526
  121    H    CYS  18           HN       CYS  18  12.269   2.202 -12.161
  122    HA   CYS  18           HA       CYS  18  10.819   0.357 -10.749
  123   1HB   CYS  18          HB1       CYS  18  11.583   2.842 -10.263
  124   2HB   CYS  18          HB2       CYS  18   9.979   3.291 -10.725
  125    H    ASN  19           HN       ASN  19   9.024   2.996 -12.414
  126    HA   ASN  19           HA       ASN  19   6.553   1.958 -12.449
  127   1HB   ASN  19          HB1       ASN  19   7.269   4.064 -13.690
  128   2HB   ASN  19          HB2       ASN  19   7.805   3.023 -15.007
  129   1HD2  ASN  19          HD2       ASN  19   6.117   3.074 -16.549
  130   2HD2  ASN  19          HD2       ASN  19   4.483   2.825 -16.154
  131    H    GLY  20           HN       GLY  20   9.117   1.019 -14.545
  132   1HA   GLY  20          HA1       GLY  20   7.654  -0.863 -16.159
  133   2HA   GLY  20          HA2       GLY  20   9.401  -0.848 -15.966
  134    H    GLU  21           HN       GLU  21   9.842  -1.389 -13.449
  135    HA   GLU  21           HA       GLU  21   9.385  -4.169 -13.198
  136   1HB   GLU  21          HB1       GLU  21  11.081  -2.471 -11.907
  137   2HB   GLU  21          HB2       GLU  21   9.853  -2.600 -10.670
  138   1HG   GLU  21          HG1       GLU  21   9.806  -5.065 -10.964
  139   2HG   GLU  21          HG2       GLU  21  11.191  -4.979 -12.018
  140    H    CYS  22           HN       CYS  22   7.568  -1.482 -12.136
  141    HA   CYS  22           HA       CYS  22   5.755  -2.926 -10.376
  142   1HB   CYS  22          HB1       CYS  22   5.895  -0.167 -11.526
  143   2HB   CYS  22          HB2       CYS  22   4.352  -0.698 -10.995
  144    H    LEU  23           HN       LEU  23   5.639  -1.646 -13.719
  145    HA   LEU  23           HA       LEU  23   3.056  -2.509 -14.372
  146   1HB   LEU  23          HB1       LEU  23   5.607  -1.951 -15.891
  147   2HB   LEU  23          HB2       LEU  23   4.195  -2.503 -16.703
  148    HG   LEU  23           HG       LEU  23   4.274   0.048 -15.013
  149   1HD1  LEU  23          HD1       LEU  23   5.761   0.176 -16.960
  150   2HD1  LEU  23          HD1       LEU  23   4.434  -0.393 -18.020
  151   3HD1  LEU  23          HD1       LEU  23   4.319   1.199 -17.222
  152   1HD2  LEU  23          HD2       LEU  23   2.257  -0.930 -17.051
  153   2HD2  LEU  23          HD2       LEU  23   2.019  -0.887 -15.280
  154   3HD2  LEU  23          HD2       LEU  23   2.217   0.638 -16.185
  155    H    LEU  24           HN       LEU  24   6.170  -4.043 -14.255
  156    HA   LEU  24           HA       LEU  24   5.611  -6.411 -15.699
  157   1HB   LEU  24          HB1       LEU  24   7.677  -5.246 -14.056
  158   2HB   LEU  24          HB2       LEU  24   7.417  -6.844 -13.466
  159    HG   LEU  24           HG       LEU  24   7.897  -6.025 -16.345
  160   1HD1  LEU  24          HD1       LEU  24   9.796  -7.280 -14.317
  161   2HD1  LEU  24          HD1       LEU  24  10.174  -6.975 -16.039
  162   3HD1  LEU  24          HD1       LEU  24   9.868  -5.602 -14.942
  163   1HD2  LEU  24          HD2       LEU  24   6.720  -8.202 -16.106
  164   2HD2  LEU  24          HD2       LEU  24   8.379  -8.450 -16.720
  165   3HD2  LEU  24          HD2       LEU  24   8.004  -8.767 -14.998
  166    H    ARG  25           HN       ARG  25   5.091  -5.483 -12.521
  167    HA   ARG  25           HA       ARG  25   3.929  -8.055 -11.658
  168   1HB   ARG  25          HB1       ARG  25   4.737  -5.484 -10.306
  169   2HB   ARG  25          HB2       ARG  25   3.533  -6.468  -9.499
  170   1HG   ARG  25          HG1       ARG  25   5.013  -8.318  -9.214
  171   2HG   ARG  25          HG2       ARG  25   6.048  -7.820 -10.533
  172   1HD   ARG  25          HD1       ARG  25   5.858  -6.010  -8.131
  173   2HD   ARG  25          HD2       ARG  25   6.877  -7.429  -7.981
  174    HE   ARG  25           HE       ARG  25   7.231  -5.407 -10.165
  175   1HH1  ARG  25          HH1       ARG  25  10.353  -7.198 -10.110
  176   2HH1  ARG  25          HH1       ARG  25   8.898  -7.436 -11.059
  177   1HH2  ARG  25          HH2       ARG  25  10.328  -6.116  -8.120
  178   2HH2  ARG  25          HH2       ARG  25   8.784  -5.486  -7.634
  179    H    GLY  26           HN       GLY  26   2.800  -5.567 -13.393
  180   1HA   GLY  26          HA1       GLY  26   0.599  -5.253 -14.179
  181   2HA   GLY  26          HA2       GLY  26   0.017  -6.357 -12.932
  182    H    TYR  27           HN       TYR  27   2.133  -4.011 -11.752
  183    HA   TYR  27           HA       TYR  27  -0.107  -2.689 -10.378
  184   1HB   TYR  27          HB1       TYR  27   2.935  -2.499 -10.187
  185   2HB   TYR  27          HB2       TYR  27   1.885  -1.529  -9.188
  186    HD1  TYR  27           HD1      TYR  27   3.856  -3.449  -8.027
  187    HD2  TYR  27           HD2      TYR  27  -0.218  -4.135  -9.114
  188    HE1  TYR  27           HE1      TYR  27   3.691  -5.229  -6.382
  189    HE2  TYR  27           HE2      TYR  27  -0.359  -5.886  -7.496
  190    HH   TYR  27           HH       TYR  27   1.778  -7.515  -6.312
  191    H    LYS  28           HN       LYS  28  -0.131  -0.360 -10.140
  192    HA   LYS  28           HA       LYS  28  -0.024   0.792 -12.837
  193   1HB   LYS  28          HB1       LYS  28  -1.090   2.828 -11.484
  194   2HB   LYS  28          HB2       LYS  28  -2.077   1.434 -11.839
  195   1HG   LYS  28          HG1       LYS  28  -0.480   1.401  -9.272
  196   2HG   LYS  28          HG2       LYS  28  -1.784   2.538  -9.354
  197   1HD   LYS  28          HD1       LYS  28  -2.387  -0.276 -10.297
  198   2HD   LYS  28          HD2       LYS  28  -2.189  -0.066  -8.581
  199   1HE   LYS  28          HE1       LYS  28  -3.909   2.057  -9.789
  200   2HE   LYS  28          HE2       LYS  28  -4.535   0.444 -10.048
  201   1HZ   LYS  28          HZ1       LYS  28  -5.283   0.512  -7.964
  202   2HZ   LYS  28          HZ2       LYS  28  -3.735   0.526  -7.348
  203   3HZ   LYS  28          HZ3       LYS  28  -4.485   1.960  -7.622
  204    H    GLY  29           HN       GLY  29   0.569   3.109 -12.898
  205   1HA   GLY  29          HA1       GLY  29   3.141   3.710 -13.018
  206   2HA   GLY  29          HA2       GLY  29   2.034   4.899 -12.390
  207    H    GLY  30           HN       GLY  30   4.710   2.941 -11.603
  208   1HA   GLY  30          HA1       GLY  30   4.286   3.330  -8.689
  209   2HA   GLY  30          HA2       GLY  30   5.518   2.302  -9.430
  210    H    HIS  31           HN       HIS  31   6.803   3.540  -7.742
  211    HA   HIS  31           HA       HIS  31   8.352   5.523  -9.124
  212   1HB   HIS  31          HB1       HIS  31   7.874   7.441  -7.606
  213   2HB   HIS  31          HB2       HIS  31   6.408   6.946  -8.418
  214    HD1  HIS  31           HD1      HIS  31   4.449   6.622  -6.787
  215    HD2  HIS  31           HD2      HIS  31   8.086   6.163  -4.833
  216    HE1  HIS  31           HE1      HIS  31   3.920   6.268  -4.425
  217    HE2  HIS  31           HE2      HIS  31   6.137   6.013  -3.280
  218    H    CYS  32           HN       CYS  32   9.935   6.528  -7.426
  219    HA   CYS  32           HA       CYS  32  10.950   4.262  -5.810
  220   1HB   CYS  32          HB1       CYS  32  12.261   6.776  -6.863
  221   2HB   CYS  32          HB2       CYS  32  13.033   5.735  -5.703
  222    H    GLY  33           HN       GLY  33  11.501   4.549  -3.701
  223   1HA   GLY  33          HA1       GLY  33  10.619   5.230  -1.556
  224   2HA   GLY  33          HA2       GLY  33  11.765   6.491  -2.001
  225    H    SER  34           HN       SER  34  11.020   8.354  -1.455
  226    HA   SER  34           HA       SER  34   8.498   9.300  -2.598
  227   1HB   SER  34          HB1       SER  34   7.882   8.168  -0.330
  228   2HB   SER  34          HB2       SER  34   8.790   9.470   0.456
  229    HG   SER  34           HG       SER  34   7.144  10.753   0.000
  230    H    PHE  35           HN       PHE  35  11.158   9.984  -0.312
  231    HA   PHE  35           HA       PHE  35  12.076  12.236  -1.757
  232   1HB   PHE  35          HB1       PHE  35   9.876  12.986  -0.538
  233   2HB   PHE  35          HB2       PHE  35  10.817  12.920   0.932
  234    HD1  PHE  35           HD1      PHE  35  10.669  14.520  -2.415
  235    HD2  PHE  35           HD2      PHE  35  12.418  14.649   1.468
  236    HE1  PHE  35           HE1      PHE  35  11.629  16.721  -2.924
  237    HE2  PHE  35           HE2      PHE  35  13.379  16.851   0.958
  238    HZ   PHE  35           HZ       PHE  35  12.988  17.892  -1.237
  239    H    ALA  36           HN       ALA  36  13.866  11.030  -1.500
  240    HA   ALA  36           HA       ALA  36  16.049  10.882  -0.673
  241   1HB   ALA  36          HB1       ALA  36  16.661  11.561   1.554
  242   2HB   ALA  36          HB2       ALA  36  15.686  12.863   0.802
  243   3HB   ALA  36          HB3       ALA  36  14.966  11.775   2.036
  244    H    ASN  37           HN       ASN  37  14.599   8.806  -1.033
  245    HA   ASN  37           HA       ASN  37  14.766   7.137   1.356
  246   1HB   ASN  37          HB1       ASN  37  12.547   7.335   0.034
  247   2HB   ASN  37          HB2       ASN  37  13.461   6.543  -1.263
  248   1HD2  ASN  37          HD2       ASN  37  12.572   5.849   2.231
  249   2HD2  ASN  37          HD2       ASN  37  12.421   4.186   1.907
  250    H    VAL  38           HN       VAL  38  14.807   4.690  -0.318
  251    HA   VAL  38           HA       VAL  38  17.095   4.699  -1.989
  252    HB   VAL  38           HB       VAL  38  18.190   2.900  -0.185
  253   1HG1  VAL  38          HG1       VAL  38  18.706   5.881   0.029
  254   2HG1  VAL  38          HG1       VAL  38  19.772   4.551   0.545
  255   3HG1  VAL  38          HG1       VAL  38  19.406   4.779  -1.194
  256   1HG2  VAL  38          HG2       VAL  38  18.109   3.766   2.061
  257   2HG2  VAL  38          HG2       VAL  38  16.944   5.020   1.564
  258   3HG2  VAL  38          HG2       VAL  38  16.486   3.287   1.486
  259    H    ASN  39           HN       ASN  39  14.303   3.794  -2.058
  260    HA   ASN  39           HA       ASN  39  14.818   1.118  -2.991
  261   1HB   ASN  39          HB1       ASN  39  13.221   1.562  -0.427
  262   2HB   ASN  39          HB2       ASN  39  12.569   0.486  -1.601
  263   1HD2  ASN  39          HD2       ASN  39  14.901   0.583   0.954
  264   2HD2  ASN  39          HD2       ASN  39  15.723  -0.837   0.506
  265    H    CYS  40           HN       CYS  40  12.549   0.173  -3.834
  266    HA   CYS  40           HA       CYS  40  11.182   2.464  -5.101
  267   1HB   CYS  40          HB1       CYS  40  12.655   0.316  -6.294
  268   2HB   CYS  40          HB2       CYS  40  10.984   0.079  -6.667
  269    H    TRP  41           HN       TRP  41   8.993   2.290  -5.401
  270    HA   TRP  41           HA       TRP  41   7.597  -0.023  -4.261
  271   1HB   TRP  41          HB1       TRP  41   7.065   2.824  -3.256
  272   2HB   TRP  41          HB2       TRP  41   6.135   1.402  -2.875
  273    HD1  TRP  41           HD1      TRP  41   9.864   2.636  -2.418
  274    HE1  TRP  41           HE1      TRP  41  10.601   1.588  -0.269
  275    HE3  TRP  41           HE3      TRP  41   5.767  -0.066  -1.247
  276    HZ2  TRP  41           HZ2      TRP  41   9.652  -0.176   1.804
  277    HZ3  TRP  41           HZ3      TRP  41   5.677  -1.410   0.793
  278    HH2  TRP  41           HH2      TRP  41   7.620  -1.479   2.336
  279    H    CYS  42           HN       CYS  42   5.287   0.080  -4.731
  280    HA   CYS  42           HA       CYS  42   4.940   1.444  -7.349
  281   1HB   CYS  42          HB1       CYS  42   3.379  -0.764  -6.003
  282   2HB   CYS  42          HB2       CYS  42   2.859  -0.013  -7.495
  283    H    GLU  43           HN       GLU  43   2.357   1.907  -7.543
  284    HA   GLU  43           HA       GLU  43   1.526   3.521  -5.217
  285   1HB   GLU  43          HB1       GLU  43   2.927   4.796  -7.191
  286   2HB   GLU  43          HB2       GLU  43   1.338   4.861  -7.895
  287   1HG   GLU  43          HG1       GLU  43   0.385   5.936  -5.945
  288   2HG   GLU  43          HG2       GLU  43   1.881   5.803  -5.041
  289    H    THR  44           HN       THR  44   0.134   1.717  -5.184
  290    HA   THR  44           HA       THR  44  -1.960   1.634  -7.244
  291    HB   THR  44           HB       THR  44  -0.991  -0.520  -6.387
  292    HG1  THR  44           HG1      THR  44  -3.566  -0.435  -5.352
  293   1HG2  THR  44          HG2       THR  44  -1.553  -1.335  -4.170
  294   2HG2  THR  44          HG2       THR  44  -0.617   0.186  -4.016
  295   3HG2  THR  44          HG2       THR  44  -2.378   0.209  -3.772